NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
562253 | 2lsu | 18445 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 2 H1 SER 2 9.416 -2.814 -2.752 2 H2 SER 2 H2 SER 2 9.076 -1.269 -2.294 3 H3 SER 2 H3 SER 2 9.006 -1.685 -3.884 4 HA SER 2 HA SER 2 7.265 -2.707 -1.764 5 HB2 SER 2 HB2 SER 2 6.689 -0.741 -4.013 6 HB3 SER 2 HB3 SER 2 5.493 -1.399 -2.870 7 HG SER 2 HG SER 2 6.324 0.645 -2.207 8 H GLN 3 H GLN 3 6.251 -4.569 -2.222 9 HA GLN 3 HA GLN 3 5.813 -5.389 -5.036 10 HB2 GLN 3 HB2 GLN 3 7.306 -7.043 -2.956 11 HB3 GLN 3 HB3 GLN 3 6.736 -7.639 -4.525 12 HG2 GLN 3 HG2 GLN 3 8.157 -5.945 -5.674 13 HG3 GLN 3 HG3 GLN 3 8.786 -5.424 -4.107 14 HE21 GLN 3 HE22 GLN 3 10.452 -6.376 -6.174 15 HE22 GLN 3 HE21 GLN 3 11.171 -7.882 -5.642 16 H PHE 4 H PHE 4 4.505 -7.509 -5.026 17 HA PHE 4 HA PHE 4 2.815 -7.915 -2.644 18 HB2 PHE 4 HB2 PHE 4 1.760 -6.009 -3.766 19 HB3 PHE 4 HB3 PHE 4 1.797 -6.842 -5.308 20 HD1 PHE 4 HD2 PHE 4 0.423 -9.046 -5.520 21 HD2 PHE 4 HD1 PHE 4 -0.136 -6.159 -2.399 22 HE1 PHE 4 HE2 PHE 4 -1.835 -9.951 -5.096 23 HE2 PHE 4 HE1 PHE 4 -2.427 -7.020 -1.999 24 HZ PHE 4 HZ PHE 4 -3.289 -8.915 -3.361 25 H GLU 5 H GLU 5 3.198 -8.584 -6.183 26 HA GLU 5 HA GLU 5 1.840 -11.129 -5.949 27 HB2 GLU 5 HB2 GLU 5 3.567 -9.938 -8.154 28 HB3 GLU 5 HB3 GLU 5 2.584 -11.411 -8.303 29 HG2 GLU 5 HG2 GLU 5 0.546 -10.098 -7.780 30 HG3 GLU 5 HG3 GLU 5 1.521 -8.619 -7.688 31 H LYS 6 H LYS 6 5.122 -10.117 -5.363 32 HA LYS 6 HA LYS 6 6.472 -12.467 -6.257 33 HB2 LYS 6 HB2 LYS 6 7.499 -10.246 -5.871 34 HB3 LYS 6 HB3 LYS 6 7.254 -10.476 -4.138 35 HG2 LYS 6 HG2 LYS 6 9.545 -11.019 -4.767 36 HG3 LYS 6 HG3 LYS 6 8.725 -12.469 -4.186 37 HD2 LYS 6 HD2 LYS 6 8.384 -13.248 -6.489 38 HD3 LYS 6 HD3 LYS 6 9.048 -11.732 -7.132 39 HE2 LYS 6 HE2 LYS 6 10.578 -13.699 -5.383 40 HE3 LYS 6 HE3 LYS 6 10.670 -13.641 -7.153 41 HZ1 LYS 6 HZ1 LYS 6 12.461 -12.426 -6.136 42 HZ2 LYS 6 HZ2 LYS 6 11.493 -11.404 -6.990 43 HZ3 LYS 6 HZ3 LYS 6 11.415 -11.437 -5.346 44 H GLN 7 H GLN 7 5.451 -11.467 -2.910 45 HA GLN 7 HA GLN 7 6.387 -13.900 -1.744 46 HB2 GLN 7 HB2 GLN 7 5.458 -11.429 -0.863 47 HB3 GLN 7 HB3 GLN 7 4.144 -12.509 -0.398 48 HG2 GLN 7 HG2 GLN 7 7.088 -12.855 0.269 49 HG3 GLN 7 HG3 GLN 7 5.823 -12.318 1.389 50 HE21 GLN 7 HE22 GLN 7 3.852 -13.942 1.508 51 HE22 GLN 7 HE21 GLN 7 4.308 -15.630 1.614 52 H LYS 8 H LYS 8 3.334 -12.916 -3.234 53 HA LYS 8 HA LYS 8 1.702 -15.023 -2.129 54 HB2 LYS 8 HB2 LYS 8 0.937 -12.777 -2.940 55 HB3 LYS 8 HB3 LYS 8 1.400 -13.238 -4.556 56 HG2 LYS 8 HG2 LYS 8 -0.272 -15.265 -4.190 57 HG3 LYS 8 HG3 LYS 8 -0.880 -14.268 -2.876 58 HD2 LYS 8 HD2 LYS 8 -2.194 -13.718 -4.807 59 HD3 LYS 8 HD3 LYS 8 -1.078 -12.362 -4.545 60 HE2 LYS 8 HE2 LYS 8 -0.980 -12.863 -6.902 61 HE3 LYS 8 HE3 LYS 8 0.511 -13.464 -6.204 62 HZ1 LYS 8 HZ1 LYS 8 -1.863 -15.098 -6.829 63 HZ2 LYS 8 HZ2 LYS 8 -0.470 -15.054 -7.693 64 HZ3 LYS 8 HZ3 LYS 8 -0.471 -15.672 -6.166 65 H GLU 9 H GLU 9 3.069 -14.470 -5.469 66 HA GLU 9 HA GLU 9 2.183 -16.945 -6.509 67 HB2 GLU 9 HB2 GLU 9 2.883 -14.902 -7.763 68 HB3 GLU 9 HB3 GLU 9 4.572 -15.242 -7.318 69 HG2 GLU 9 HG2 GLU 9 4.445 -17.405 -8.457 70 HG3 GLU 9 HG3 GLU 9 2.729 -17.126 -8.818 71 H GLN 10 H GLN 10 5.127 -16.092 -4.653 72 HA GLN 10 HA GLN 10 6.539 -18.511 -5.269 73 HB2 GLN 10 HB2 GLN 10 6.779 -16.420 -3.093 74 HB3 GLN 10 HB3 GLN 10 7.823 -17.860 -3.132 75 HG2 GLN 10 HG2 GLN 10 8.537 -17.316 -5.430 76 HG3 GLN 10 HG3 GLN 10 7.588 -15.819 -5.389 77 HE21 GLN 10 HE22 GLN 10 10.632 -16.634 -5.429 78 HE22 GLN 10 HE21 GLN 10 11.326 -15.581 -4.210 79 H GLY 11 H GLY 11 3.631 -18.273 -3.719 80 HA2 GLY 11 HA2 GLY 11 4.226 -20.734 -2.138 81 HA3 GLY 11 HA3 GLY 11 3.103 -19.498 -1.562 82 H ASN 12 H ASN 12 2.716 -19.575 -4.905 83 HA ASN 12 HA ASN 12 0.200 -20.901 -4.768 84 HB2 ASN 12 HB2 ASN 12 -0.004 -20.371 -6.966 85 HB3 ASN 12 HB3 ASN 12 1.346 -19.296 -6.599 86 HD21 ASN 12 HD22 ASN 12 3.492 -19.996 -7.268 87 HD22 ASN 12 HD21 ASN 12 3.653 -21.145 -8.570 88 H SER 13 H SER 13 3.484 -22.024 -5.297 89 HA SER 13 HA SER 13 2.698 -24.694 -6.150 90 HB2 SER 13 HB2 SER 13 5.121 -25.166 -5.836 91 HB3 SER 13 HB3 SER 13 4.838 -23.724 -6.834 92 HG SER 13 HG SER 13 6.427 -23.351 -5.234 93 H LEU 14 H LEU 14 3.725 -23.126 -3.053 94 HA LEU 14 HA LEU 14 3.924 -25.461 -1.499 95 HB2 LEU 14 HB2 LEU 14 3.100 -22.597 -0.856 96 HB3 LEU 14 HB3 LEU 14 3.431 -23.810 0.362 97 HG LEU 14 HG LEU 14 5.434 -22.864 -1.715 98 HD11 LEU 14 HD11 LEU 14 5.178 -22.271 1.275 99 HD12 LEU 14 HD12 LEU 14 6.495 -21.719 0.205 100 HD13 LEU 14 HD13 LEU 14 4.837 -21.126 -0.043 101 HD21 LEU 14 HD21 LEU 14 7.075 -24.046 -0.283 102 HD22 LEU 14 HD22 LEU 14 5.756 -24.634 0.759 103 HD23 LEU 14 HD23 LEU 14 5.883 -25.181 -0.926 104 H PHE 15 H PHE 15 1.105 -23.512 -2.476 105 HA PHE 15 HA PHE 15 -0.811 -24.767 -0.766 106 HB2 PHE 15 HB2 PHE 15 -1.280 -22.666 -1.844 107 HB3 PHE 15 HB3 PHE 15 -0.915 -23.331 -3.435 108 HD1 PHE 15 HD1 PHE 15 -3.083 -24.624 -0.659 109 HD2 PHE 15 HD2 PHE 15 -2.807 -23.287 -4.724 110 HE1 PHE 15 HE1 PHE 15 -5.476 -25.170 -0.988 111 HE2 PHE 15 HE2 PHE 15 -5.259 -23.730 -5.035 112 HZ PHE 15 HZ PHE 15 -6.557 -24.734 -3.192 113 H LYS 16 H LYS 16 0.789 -25.832 -3.657 114 HA LYS 16 HA LYS 16 -1.270 -27.920 -4.113 115 HB2 LYS 16 HB2 LYS 16 0.977 -26.912 -5.894 116 HB3 LYS 16 HB3 LYS 16 -0.265 -28.093 -6.362 117 HG2 LYS 16 HG2 LYS 16 -2.032 -26.414 -6.033 118 HG3 LYS 16 HG3 LYS 16 -0.849 -25.249 -5.409 119 HD2 LYS 16 HD2 LYS 16 0.358 -25.398 -7.639 120 HD3 LYS 16 HD3 LYS 16 -1.060 -26.304 -8.242 121 HE2 LYS 16 HE2 LYS 16 -2.515 -24.407 -7.474 122 HE3 LYS 16 HE3 LYS 16 -1.049 -23.519 -6.989 123 HZ1 LYS 16 HZ1 LYS 16 -0.323 -23.561 -9.258 124 HZ2 LYS 16 HZ2 LYS 16 -1.646 -24.414 -9.738 125 HZ3 LYS 16 HZ3 LYS 16 -1.815 -22.877 -9.184 126 H GLN 17 H GLN 17 1.687 -27.536 -2.519 127 HA GLN 17 HA GLN 17 2.917 -30.064 -3.239 128 HB2 GLN 17 HB2 GLN 17 3.487 -27.929 -1.214 129 HB3 GLN 17 HB3 GLN 17 4.359 -29.481 -1.231 130 HG2 GLN 17 HG2 GLN 17 4.934 -29.159 -3.608 131 HG3 GLN 17 HG3 GLN 17 4.034 -27.679 -3.650 132 HE21 GLN 17 HE22 GLN 17 5.514 -26.124 -3.965 133 HE22 GLN 17 HE21 GLN 17 6.873 -25.869 -2.907 134 H GLY 18 H GLY 18 0.449 -29.058 -0.920 135 HA2 GLY 18 HA2 GLY 18 -0.905 -30.649 0.187 136 HA3 GLY 18 HA3 GLY 18 0.415 -31.829 0.156 137 H LEU 19 H LEU 19 1.109 -28.535 1.120 138 HA LEU 19 HA LEU 19 1.077 -29.266 3.999 139 HB2 LEU 19 HB2 LEU 19 3.292 -28.004 4.168 140 HB3 LEU 19 HB3 LEU 19 3.291 -29.647 3.530 141 HG LEU 19 HG LEU 19 3.452 -28.796 1.222 142 HD11 LEU 19 HD11 LEU 19 3.742 -26.086 2.571 143 HD12 LEU 19 HD12 LEU 19 4.021 -26.425 0.845 144 HD13 LEU 19 HD13 LEU 19 2.394 -26.590 1.532 145 HD21 LEU 19 HD21 LEU 19 5.463 -29.365 2.534 146 HD22 LEU 19 HD22 LEU 19 5.787 -28.024 1.413 147 HD23 LEU 19 HD23 LEU 19 5.537 -27.703 3.148 148 H TYR 20 H TYR 20 -0.991 -28.101 3.059 149 HA TYR 20 HA TYR 20 -1.120 -25.526 2.185 150 HB2 TYR 20 HB2 TYR 20 -3.089 -26.771 4.114 151 HB3 TYR 20 HB3 TYR 20 -3.416 -25.587 2.841 152 HD1 TYR 20 HD2 TYR 20 -2.215 -26.642 0.444 153 HD2 TYR 20 HD1 TYR 20 -4.109 -28.768 3.663 154 HE1 TYR 20 HE2 TYR 20 -2.773 -28.493 -1.100 155 HE2 TYR 20 HE1 TYR 20 -4.676 -30.614 2.129 156 HH TYR 20 HH TYR 20 -4.502 -31.441 -0.017 157 H ARG 21 H ARG 21 -0.480 -26.462 5.553 158 HA ARG 21 HA ARG 21 -1.436 -24.153 6.836 159 HB2 ARG 21 HB2 ARG 21 -0.743 -26.244 7.944 160 HB3 ARG 21 HB3 ARG 21 0.935 -25.978 7.450 161 HG2 ARG 21 HG2 ARG 21 0.508 -25.354 9.835 162 HG3 ARG 21 HG3 ARG 21 1.142 -24.023 8.845 163 HD2 ARG 21 HD2 ARG 21 -0.642 -23.178 10.237 164 HD3 ARG 21 HD3 ARG 21 -1.170 -23.180 8.541 165 HE ARG 21 HE ARG 21 -1.909 -25.578 10.050 166 HH11 ARG 21 HH11 ARG 21 -2.884 -22.289 9.140 167 HH12 ARG 21 HH12 ARG 21 -4.594 -22.631 9.389 168 HH21 ARG 21 HH21 ARG 21 -4.166 -25.922 10.381 169 HH22 ARG 21 HH22 ARG 21 -5.295 -24.610 10.071 170 H GLU 22 H GLU 22 1.474 -24.652 4.916 171 HA GLU 22 HA GLU 22 2.762 -22.161 5.762 172 HB2 GLU 22 HB2 GLU 22 3.197 -23.929 3.324 173 HB3 GLU 22 HB3 GLU 22 4.344 -22.748 3.976 174 HG2 GLU 22 HG2 GLU 22 3.345 -25.138 5.590 175 HG3 GLU 22 HG3 GLU 22 4.724 -25.203 4.493 176 H ALA 23 H ALA 23 0.760 -23.415 3.156 177 HA ALA 23 HA ALA 23 1.008 -21.223 1.344 178 HB1 ALA 23 HB1 ALA 23 0.363 -23.527 0.754 179 HB2 ALA 23 HB2 ALA 23 -1.179 -23.304 1.613 180 HB3 ALA 23 HB3 ALA 23 -0.821 -22.320 0.181 181 H VAL 24 H VAL 24 -0.961 -21.547 4.258 182 HA VAL 24 HA VAL 24 -2.990 -19.593 3.422 183 HB VAL 24 HB VAL 24 -1.968 -20.428 6.196 184 HG11 VAL 24 HG11 VAL 24 -4.180 -19.585 6.985 185 HG12 VAL 24 HG12 VAL 24 -3.212 -18.298 6.246 186 HG13 VAL 24 HG13 VAL 24 -4.555 -19.036 5.339 187 HG21 VAL 24 HG21 VAL 24 -2.942 -22.357 4.937 188 HG22 VAL 24 HG22 VAL 24 -4.014 -21.880 6.269 189 HG23 VAL 24 HG23 VAL 24 -4.405 -21.412 4.598 190 H HIS 25 H HIS 25 -0.078 -19.852 5.210 191 HA HIS 25 HA HIS 25 0.310 -17.169 6.108 192 HB2 HIS 25 HB2 HIS 25 1.297 -19.887 6.368 193 HB3 HIS 25 HB3 HIS 25 2.627 -18.844 6.109 194 HD2 HIS 25 HD2 HIS 25 3.439 -17.554 8.352 195 HE1 HIS 25 HE1 HIS 25 -0.027 -18.231 10.730 196 HE2 HIS 25 HE2 HIS 25 2.346 -17.277 10.720 197 H CYS 26 H CYS 26 0.293 -18.108 3.042 198 HA CYS 26 HA CYS 26 2.635 -16.435 2.250 199 HB2 CYS 26 HB2 CYS 26 1.454 -18.935 0.994 200 HB3 CYS 26 HB3 CYS 26 2.475 -17.800 0.103 201 HG CYS 26 HG CYS 26 3.119 -19.390 2.940 202 H TYR 27 H TYR 27 -0.679 -16.544 2.405 203 HA TYR 27 HA TYR 27 -0.901 -14.613 0.131 204 HB2 TYR 27 HB2 TYR 27 -3.089 -16.384 1.191 205 HB3 TYR 27 HB3 TYR 27 -3.174 -15.339 -0.233 206 HD1 TYR 27 HD2 TYR 27 -0.630 -16.070 -1.636 207 HD2 TYR 27 HD1 TYR 27 -3.496 -18.485 0.452 208 HE1 TYR 27 HE2 TYR 27 -0.040 -18.010 -3.082 209 HE2 TYR 27 HE1 TYR 27 -2.901 -20.439 -0.959 210 HH TYR 27 HH TYR 27 -1.649 -21.185 -2.724 211 H ASP 28 H ASP 28 -0.943 -14.911 3.478 212 HA ASP 28 HA ASP 28 -3.254 -13.261 4.070 213 HB2 ASP 28 HB2 ASP 28 -2.134 -14.967 5.568 214 HB3 ASP 28 HB3 ASP 28 -0.773 -13.864 5.742 215 H GLN 29 H GLN 29 0.107 -12.651 3.171 216 HA GLN 29 HA GLN 29 0.212 -10.075 4.463 217 HB2 GLN 29 HB2 GLN 29 2.359 -9.863 3.618 218 HB3 GLN 29 HB3 GLN 29 2.187 -11.583 3.994 219 HG2 GLN 29 HG2 GLN 29 1.805 -10.329 1.276 220 HG3 GLN 29 HG3 GLN 29 3.324 -11.067 1.807 221 HE21 GLN 29 HE22 GLN 29 1.820 -11.797 -0.507 222 HE22 GLN 29 HE21 GLN 29 1.267 -13.441 -0.327 223 H LEU 30 H LEU 30 -1.282 -11.138 1.522 224 HA LEU 30 HA LEU 30 -1.100 -8.558 0.168 225 HB2 LEU 30 HB2 LEU 30 -3.028 -10.896 -0.142 226 HB3 LEU 30 HB3 LEU 30 -2.912 -9.518 -1.226 227 HG LEU 30 HG LEU 30 -1.686 -11.016 -2.403 228 HD11 LEU 30 HD11 LEU 30 0.720 -10.794 -2.081 229 HD12 LEU 30 HD12 LEU 30 -0.057 -9.230 -1.832 230 HD13 LEU 30 HD13 LEU 30 0.482 -10.180 -0.445 231 HD21 LEU 30 HD21 LEU 30 -2.122 -12.852 -0.909 232 HD22 LEU 30 HD22 LEU 30 -0.417 -12.871 -1.375 233 HD23 LEU 30 HD23 LEU 30 -0.880 -12.275 0.224 234 H ILE 31 H ILE 31 -3.287 -10.175 2.413 235 HA ILE 31 HA ILE 31 -5.404 -8.237 2.156 236 HB ILE 31 HB ILE 31 -4.741 -10.371 4.235 237 HG12 ILE 31 HG12 ILE 31 -6.888 -10.592 2.110 238 HG13 ILE 31 HG13 ILE 31 -5.231 -10.927 1.686 239 HG21 ILE 31 HG21 ILE 31 -7.168 -10.291 4.815 240 HG22 ILE 31 HG22 ILE 31 -6.314 -8.797 5.232 241 HG23 ILE 31 HG23 ILE 31 -7.344 -8.856 3.778 242 HD11 ILE 31 HD11 ILE 31 -6.751 -12.297 3.903 243 HD12 ILE 31 HD12 ILE 31 -6.322 -12.986 2.307 244 HD13 ILE 31 HD13 ILE 31 -5.042 -12.548 3.477 245 H THR 32 H THR 32 -2.377 -8.311 3.706 246 HA THR 32 HA THR 32 -3.162 -6.076 5.532 247 HB THR 32 HB THR 32 -0.681 -7.830 5.562 248 HG1 THR 32 HG1 THR 32 -1.710 -8.781 7.335 249 HG21 THR 32 HG21 THR 32 -0.248 -5.665 6.607 250 HG22 THR 32 HG22 THR 32 -1.765 -5.779 7.539 251 HG23 THR 32 HG23 THR 32 -0.422 -6.898 7.865 252 H ALA 33 H ALA 33 -1.144 -6.855 2.693 253 HA ALA 33 HA ALA 33 0.424 -4.401 2.906 254 HB1 ALA 33 HB1 ALA 33 0.033 -6.380 0.626 255 HB2 ALA 33 HB2 ALA 33 1.242 -5.077 0.662 256 HB3 ALA 33 HB3 ALA 33 1.345 -6.412 1.826 257 H GLN 34 H GLN 34 -2.505 -5.497 1.226 258 HA GLN 34 HA GLN 34 -3.562 -2.921 0.807 259 HB2 GLN 34 HB2 GLN 34 -3.330 -2.815 -1.712 260 HB3 GLN 34 HB3 GLN 34 -1.919 -2.382 -0.753 261 HG2 GLN 34 HG2 GLN 34 -1.276 -4.933 -1.118 262 HG3 GLN 34 HG3 GLN 34 -2.373 -4.774 -2.505 263 HE21 GLN 34 HE22 GLN 34 0.483 -3.347 -0.884 264 HE22 GLN 34 HE21 GLN 34 1.232 -2.726 -2.329 265 HA PRO 35 HA PRO 35 -6.211 -6.661 0.577 266 HB2 PRO 35 HB2 PRO 35 -8.299 -5.611 2.068 267 HB3 PRO 35 HB3 PRO 35 -6.847 -6.388 2.763 268 HG2 PRO 35 HG2 PRO 35 -7.376 -3.442 2.326 269 HG3 PRO 35 HG3 PRO 35 -6.742 -4.245 3.802 270 HD2 PRO 35 HD2 PRO 35 -5.103 -3.030 2.026 271 HD3 PRO 35 HD3 PRO 35 -4.620 -4.567 2.815 272 H GLN 36 H GLN 36 -6.378 -3.569 -0.764 273 HA GLN 36 HA GLN 36 -9.032 -3.546 -1.790 274 HB2 GLN 36 HB2 GLN 36 -8.213 -1.741 -3.230 275 HB3 GLN 36 HB3 GLN 36 -7.634 -1.539 -1.570 276 HG2 GLN 36 HG2 GLN 36 -5.476 -2.606 -2.213 277 HG3 GLN 36 HG3 GLN 36 -6.046 -2.732 -3.882 278 HE21 GLN 36 HE22 GLN 36 -3.706 -1.428 -3.520 279 HE22 GLN 36 HE21 GLN 36 -3.915 0.299 -3.696 280 H ASN 37 H ASN 37 -7.210 -6.050 -2.303 281 HA ASN 37 HA ASN 37 -7.851 -6.274 -5.195 282 HB2 ASN 37 HB2 ASN 37 -5.259 -6.985 -3.770 283 HB3 ASN 37 HB3 ASN 37 -5.657 -7.517 -5.412 284 HD21 ASN 37 HD22 ASN 37 -4.055 -5.186 -3.636 285 HD22 ASN 37 HD21 ASN 37 -3.973 -3.937 -4.856 286 HA PRO 38 HA PRO 38 -9.885 -9.852 -3.487 287 HB2 PRO 38 HB2 PRO 38 -10.830 -10.941 -5.757 288 HB3 PRO 38 HB3 PRO 38 -11.368 -9.329 -5.211 289 HG2 PRO 38 HG2 PRO 38 -9.161 -9.894 -7.212 290 HG3 PRO 38 HG3 PRO 38 -10.632 -8.879 -7.454 291 HD2 PRO 38 HD2 PRO 38 -8.374 -7.673 -6.631 292 HD3 PRO 38 HD3 PRO 38 -9.896 -7.294 -5.884 293 H VAL 39 H VAL 39 -7.087 -10.038 -5.627 294 HA VAL 39 HA VAL 39 -7.039 -12.873 -5.967 295 HB VAL 39 HB VAL 39 -5.778 -11.169 -7.289 296 HG11 VAL 39 HG11 VAL 39 -4.940 -9.790 -5.401 297 HG12 VAL 39 HG12 VAL 39 -3.871 -11.134 -4.919 298 HG13 VAL 39 HG13 VAL 39 -3.635 -10.320 -6.481 299 HG21 VAL 39 HG21 VAL 39 -5.215 -13.569 -7.398 300 HG22 VAL 39 HG22 VAL 39 -3.769 -12.553 -7.596 301 HG23 VAL 39 HG23 VAL 39 -4.075 -13.365 -6.047 302 H GLY 40 H GLY 40 -6.066 -10.737 -3.351 303 HA2 GLY 40 HA2 GLY 40 -4.507 -12.578 -1.789 304 HA3 GLY 40 HA3 GLY 40 -5.348 -11.123 -1.215 305 H TYR 41 H TYR 41 -7.868 -12.414 -2.531 306 HA TYR 41 HA TYR 41 -8.511 -14.340 -0.356 307 HB2 TYR 41 HB2 TYR 41 -10.587 -12.710 -1.796 308 HB3 TYR 41 HB3 TYR 41 -10.715 -13.490 -0.299 309 HD1 TYR 41 HD1 TYR 41 -9.052 -10.557 -1.876 310 HD2 TYR 41 HD2 TYR 41 -10.320 -12.433 1.764 311 HE1 TYR 41 HE1 TYR 41 -8.618 -8.452 -0.663 312 HE2 TYR 41 HE2 TYR 41 -9.883 -10.320 3.007 313 HH TYR 41 HH TYR 41 -8.703 -7.374 1.337 314 H SER 42 H SER 42 -7.389 -14.673 -3.180 315 HA SER 42 HA SER 42 -9.551 -16.451 -4.225 316 HB2 SER 42 HB2 SER 42 -9.106 -14.404 -5.620 317 HB3 SER 42 HB3 SER 42 -7.437 -14.996 -5.852 318 HG SER 42 HG SER 42 -8.803 -15.648 -7.547 319 H ASN 43 H ASN 43 -6.701 -16.392 -2.595 320 HA ASN 43 HA ASN 43 -5.969 -19.090 -3.600 321 HB2 ASN 43 HB2 ASN 43 -4.114 -16.790 -2.864 322 HB3 ASN 43 HB3 ASN 43 -3.604 -18.452 -3.178 323 HD21 ASN 43 HD22 ASN 43 -4.688 -15.436 -4.613 324 HD22 ASN 43 HD21 ASN 43 -4.471 -15.933 -6.279 325 H LYS 44 H LYS 44 -5.867 -16.687 -0.868 326 HA LYS 44 HA LYS 44 -5.366 -18.708 1.146 327 HB2 LYS 44 HB2 LYS 44 -5.114 -16.156 1.294 328 HB3 LYS 44 HB3 LYS 44 -6.845 -16.068 1.390 329 HG2 LYS 44 HG2 LYS 44 -6.792 -17.557 3.410 330 HG3 LYS 44 HG3 LYS 44 -5.016 -17.570 3.309 331 HD2 LYS 44 HD2 LYS 44 -4.964 -15.124 3.634 332 HD3 LYS 44 HD3 LYS 44 -6.743 -15.090 3.658 333 HE2 LYS 44 HE2 LYS 44 -6.667 -16.670 5.625 334 HE3 LYS 44 HE3 LYS 44 -4.901 -16.485 5.648 335 HZ1 LYS 44 HZ1 LYS 44 -6.032 -15.001 7.184 336 HZ2 LYS 44 HZ2 LYS 44 -5.206 -14.144 6.048 337 HZ3 LYS 44 HZ3 LYS 44 -6.852 -14.287 5.950 338 H ALA 45 H ALA 45 -8.171 -17.293 -0.407 339 HA ALA 45 HA ALA 45 -10.211 -18.574 1.128 340 HB1 ALA 45 HB1 ALA 45 -11.676 -17.840 -0.710 341 HB2 ALA 45 HB2 ALA 45 -10.526 -16.543 -0.313 342 HB3 ALA 45 HB3 ALA 45 -10.265 -17.563 -1.749 343 H MET 46 H MET 46 -7.885 -20.054 -0.763 344 HA MET 46 HA MET 46 -9.676 -22.388 -1.309 345 HB2 MET 46 HB2 MET 46 -7.246 -21.458 -2.902 346 HB3 MET 46 HB3 MET 46 -8.167 -22.942 -3.193 347 HG2 MET 46 HG2 MET 46 -9.189 -20.100 -3.485 348 HG3 MET 46 HG3 MET 46 -8.771 -21.231 -4.780 349 HE1 MET 46 HE1 MET 46 -11.069 -20.640 -5.915 350 HE2 MET 46 HE2 MET 46 -12.646 -20.806 -5.117 351 HE3 MET 46 HE3 MET 46 -11.494 -19.575 -4.564 352 H ALA 47 H ALA 47 -6.980 -21.183 0.449 353 HA ALA 47 HA ALA 47 -5.929 -23.958 0.709 354 HB1 ALA 47 HB1 ALA 47 -4.703 -21.300 1.558 355 HB2 ALA 47 HB2 ALA 47 -3.939 -22.911 1.680 356 HB3 ALA 47 HB3 ALA 47 -4.302 -22.226 0.088 357 H LEU 48 H LEU 48 -7.565 -21.345 2.514 358 HA LEU 48 HA LEU 48 -7.210 -22.475 5.122 359 HB2 LEU 48 HB2 LEU 48 -9.357 -20.768 3.805 360 HB3 LEU 48 HB3 LEU 48 -9.489 -21.288 5.493 361 HG LEU 48 HG LEU 48 -7.115 -19.731 4.397 362 HD11 LEU 48 HD11 LEU 48 -9.584 -18.837 5.943 363 HD12 LEU 48 HD12 LEU 48 -8.187 -17.816 5.591 364 HD13 LEU 48 HD13 LEU 48 -9.193 -18.422 4.255 365 HD21 LEU 48 HD21 LEU 48 -6.723 -19.314 6.832 366 HD22 LEU 48 HD22 LEU 48 -8.067 -20.412 7.221 367 HD23 LEU 48 HD23 LEU 48 -6.602 -21.035 6.430 368 H ILE 49 H ILE 49 -9.634 -23.022 2.533 369 HA ILE 49 HA ILE 49 -11.270 -24.839 3.956 370 HB ILE 49 HB ILE 49 -11.925 -25.657 1.710 371 HG12 ILE 49 HG12 ILE 49 -10.046 -23.569 0.646 372 HG13 ILE 49 HG13 ILE 49 -9.486 -25.213 0.819 373 HG21 ILE 49 HG21 ILE 49 -12.902 -23.540 0.967 374 HG22 ILE 49 HG22 ILE 49 -12.933 -23.605 2.742 375 HG23 ILE 49 HG23 ILE 49 -11.713 -22.624 1.904 376 HD11 ILE 49 HD11 ILE 49 -11.200 -26.125 -0.559 377 HD12 ILE 49 HD12 ILE 49 -11.885 -24.500 -0.844 378 HD13 ILE 49 HD13 ILE 49 -10.257 -24.914 -1.446 379 H LYS 50 H LYS 50 -8.105 -25.151 2.494 380 HA LYS 50 HA LYS 50 -8.376 -27.928 1.853 381 HB2 LYS 50 HB2 LYS 50 -6.741 -25.829 1.110 382 HB3 LYS 50 HB3 LYS 50 -5.648 -26.837 2.065 383 HG2 LYS 50 HG2 LYS 50 -5.393 -27.652 -0.095 384 HG3 LYS 50 HG3 LYS 50 -6.560 -28.795 0.569 385 HD2 LYS 50 HD2 LYS 50 -7.186 -26.334 -1.113 386 HD3 LYS 50 HD3 LYS 50 -7.046 -27.972 -1.766 387 HE2 LYS 50 HE2 LYS 50 -9.053 -27.133 0.342 388 HE3 LYS 50 HE3 LYS 50 -9.389 -27.184 -1.395 389 HZ1 LYS 50 HZ1 LYS 50 -8.902 -29.525 -1.380 390 HZ2 LYS 50 HZ2 LYS 50 -8.571 -29.505 0.229 391 HZ3 LYS 50 HZ3 LYS 50 -10.102 -29.198 -0.296 392 H LEU 51 H LEU 51 -7.311 -26.133 4.706 393 HA LEU 51 HA LEU 51 -6.166 -28.550 5.978 394 HB2 LEU 51 HB2 LEU 51 -6.815 -25.766 7.077 395 HB3 LEU 51 HB3 LEU 51 -6.090 -27.082 7.990 396 HG LEU 51 HG LEU 51 -4.389 -25.570 7.497 397 HD11 LEU 51 HD11 LEU 51 -4.138 -27.975 5.657 398 HD12 LEU 51 HD12 LEU 51 -2.797 -27.011 6.328 399 HD13 LEU 51 HD13 LEU 51 -3.833 -27.971 7.404 400 HD21 LEU 51 HD21 LEU 51 -3.742 -24.878 5.280 401 HD22 LEU 51 HD22 LEU 51 -5.032 -25.863 4.555 402 HD23 LEU 51 HD23 LEU 51 -5.441 -24.461 5.569 403 H GLY 52 H GLY 52 -9.148 -26.651 5.845 404 HA2 GLY 52 HA2 GLY 52 -11.181 -28.079 6.361 405 HA3 GLY 52 HA3 GLY 52 -10.398 -28.396 7.921 406 H GLU 53 H GLU 53 -9.507 -25.284 7.128 407 HA GLU 53 HA GLU 53 -11.337 -24.157 9.079 408 HB2 GLU 53 HB2 GLU 53 -9.069 -22.945 7.449 409 HB3 GLU 53 HB3 GLU 53 -9.975 -22.111 8.715 410 HG2 GLU 53 HG2 GLU 53 -9.307 -23.923 10.326 411 HG3 GLU 53 HG3 GLU 53 -8.272 -24.611 9.057 412 H TYR 54 H TYR 54 -12.896 -25.028 6.949 413 HA TYR 54 HA TYR 54 -13.422 -23.156 4.906 414 HB2 TYR 54 HB2 TYR 54 -15.282 -24.985 6.456 415 HB3 TYR 54 HB3 TYR 54 -15.764 -24.069 5.033 416 HD1 TYR 54 HD2 TYR 54 -13.695 -26.900 6.232 417 HD2 TYR 54 HD1 TYR 54 -15.099 -24.701 2.816 418 HE1 TYR 54 HE2 TYR 54 -12.948 -28.735 4.750 419 HE2 TYR 54 HE1 TYR 54 -14.367 -26.542 1.324 420 HH TYR 54 HH TYR 54 -13.386 -28.590 1.188 421 H THR 55 H THR 55 -14.275 -23.136 8.355 422 HA THR 55 HA THR 55 -16.295 -21.149 8.305 423 HB THR 55 HB THR 55 -14.192 -21.763 10.408 424 HG1 THR 55 HG1 THR 55 -15.807 -23.113 11.226 425 HG21 THR 55 HG21 THR 55 -16.931 -20.404 10.575 426 HG22 THR 55 HG22 THR 55 -15.935 -20.878 11.981 427 HG23 THR 55 HG23 THR 55 -15.361 -19.628 10.860 428 H GLN 56 H GLN 56 -12.712 -20.877 8.243 429 HA GLN 56 HA GLN 56 -12.822 -17.955 8.504 430 HB2 GLN 56 HB2 GLN 56 -10.622 -20.001 8.145 431 HB3 GLN 56 HB3 GLN 56 -10.349 -18.255 8.033 432 HG2 GLN 56 HG2 GLN 56 -9.853 -18.883 10.243 433 HG3 GLN 56 HG3 GLN 56 -11.352 -17.961 10.305 434 HE21 GLN 56 HE22 GLN 56 -9.859 -21.173 10.638 435 HE22 GLN 56 HE21 GLN 56 -11.230 -21.919 11.444 436 H ALA 57 H ALA 57 -12.899 -20.372 5.940 437 HA ALA 57 HA ALA 57 -11.608 -18.758 3.923 438 HB1 ALA 57 HB1 ALA 57 -11.767 -21.229 3.862 439 HB2 ALA 57 HB2 ALA 57 -13.529 -21.116 3.670 440 HB3 ALA 57 HB3 ALA 57 -12.455 -20.478 2.393 441 H ILE 58 H ILE 58 -14.991 -19.321 4.899 442 HA ILE 58 HA ILE 58 -16.248 -17.816 2.767 443 HB ILE 58 HB ILE 58 -17.089 -18.408 5.669 444 HG12 ILE 58 HG12 ILE 58 -17.744 -19.979 3.156 445 HG13 ILE 58 HG13 ILE 58 -16.469 -20.445 4.281 446 HG21 ILE 58 HG21 ILE 58 -18.498 -16.704 4.428 447 HG22 ILE 58 HG22 ILE 58 -18.880 -18.006 3.261 448 HG23 ILE 58 HG23 ILE 58 -19.378 -18.152 4.951 449 HD11 ILE 58 HD11 ILE 58 -19.442 -20.244 4.900 450 HD12 ILE 58 HD12 ILE 58 -18.450 -21.707 4.865 451 HD13 ILE 58 HD13 ILE 58 -18.167 -20.494 6.128 452 H GLN 59 H GLN 59 -14.880 -17.000 5.972 453 HA GLN 59 HA GLN 59 -15.842 -14.281 5.960 454 HB2 GLN 59 HB2 GLN 59 -13.598 -15.653 7.505 455 HB3 GLN 59 HB3 GLN 59 -14.181 -14.005 7.813 456 HG2 GLN 59 HG2 GLN 59 -16.450 -14.874 8.268 457 HG3 GLN 59 HG3 GLN 59 -15.870 -16.528 7.997 458 HE21 GLN 59 HE22 GLN 59 -15.260 -17.641 9.773 459 HE22 GLN 59 HE21 GLN 59 -14.751 -16.925 11.295 460 H MET 60 H MET 60 -13.565 -15.795 3.997 461 HA MET 60 HA MET 60 -12.125 -13.234 3.548 462 HB2 MET 60 HB2 MET 60 -11.448 -16.084 2.738 463 HB3 MET 60 HB3 MET 60 -10.460 -14.673 2.353 464 HG2 MET 60 HG2 MET 60 -11.141 -15.275 5.237 465 HG3 MET 60 HG3 MET 60 -9.932 -16.249 4.404 466 HE1 MET 60 HE1 MET 60 -10.439 -12.310 3.808 467 HE2 MET 60 HE2 MET 60 -10.985 -12.675 5.458 468 HE3 MET 60 HE3 MET 60 -9.488 -11.715 5.175 469 H CYS 61 H CYS 61 -14.214 -15.741 2.120 470 HA CYS 61 HA CYS 61 -13.906 -14.855 -0.577 471 HB2 CYS 61 HB2 CYS 61 -16.209 -16.293 0.853 472 HB3 CYS 61 HB3 CYS 61 -16.114 -16.068 -0.895 473 HG CYS 61 HG CYS 61 -13.885 -17.517 1.058 474 H GLN 62 H GLN 62 -16.222 -13.923 2.059 475 HA GLN 62 HA GLN 62 -17.601 -12.016 0.366 476 HB2 GLN 62 HB2 GLN 62 -17.481 -12.240 3.404 477 HB3 GLN 62 HB3 GLN 62 -18.699 -11.367 2.445 478 HG2 GLN 62 HG2 GLN 62 -19.513 -13.483 1.495 479 HG3 GLN 62 HG3 GLN 62 -18.223 -14.363 2.314 480 HE21 GLN 62 HE22 GLN 62 -19.722 -15.653 3.385 481 HE22 GLN 62 HE21 GLN 62 -20.707 -15.020 4.666 482 H GLN 63 H GLN 63 -14.444 -11.908 1.488 483 HA GLN 63 HA GLN 63 -14.557 -8.944 1.770 484 HB2 GLN 63 HB2 GLN 63 -12.538 -10.904 2.936 485 HB3 GLN 63 HB3 GLN 63 -12.450 -9.129 3.010 486 HG2 GLN 63 HG2 GLN 63 -14.836 -9.280 4.033 487 HG3 GLN 63 HG3 GLN 63 -14.423 -10.973 4.356 488 HE21 GLN 63 HE22 GLN 63 -13.175 -11.428 6.157 489 HE22 GLN 63 HE21 GLN 63 -12.402 -10.202 7.151 490 H GLY 64 H GLY 64 -13.964 -11.295 -0.425 491 HA2 GLY 64 HA2 GLY 64 -11.802 -9.701 -1.747 492 HA3 GLY 64 HA3 GLY 64 -12.161 -11.413 -2.066 493 H LEU 65 H LEU 65 -15.064 -11.105 -1.999 494 HA LEU 65 HA LEU 65 -15.619 -10.305 -4.688 495 HB2 LEU 65 HB2 LEU 65 -17.259 -10.902 -2.206 496 HB3 LEU 65 HB3 LEU 65 -18.039 -10.473 -3.724 497 HG LEU 65 HG LEU 65 -16.032 -12.764 -3.514 498 HD11 LEU 65 HD11 LEU 65 -19.080 -12.833 -3.394 499 HD12 LEU 65 HD12 LEU 65 -17.995 -14.248 -3.443 500 HD13 LEU 65 HD13 LEU 65 -17.983 -13.165 -2.030 501 HD21 LEU 65 HD21 LEU 65 -16.391 -11.884 -5.795 502 HD22 LEU 65 HD22 LEU 65 -17.135 -13.482 -5.616 503 HD23 LEU 65 HD23 LEU 65 -18.148 -12.021 -5.576 504 H ARG 66 H ARG 66 -14.953 -8.407 -1.965 505 HA ARG 66 HA ARG 66 -16.602 -6.091 -2.677 506 HB2 ARG 66 HB2 ARG 66 -14.172 -6.403 -0.850 507 HB3 ARG 66 HB3 ARG 66 -15.281 -5.025 -0.879 508 HG2 ARG 66 HG2 ARG 66 -17.125 -6.490 -0.126 509 HG3 ARG 66 HG3 ARG 66 -16.016 -7.882 -0.110 510 HD2 ARG 66 HD2 ARG 66 -14.577 -6.707 1.526 511 HD3 ARG 66 HD3 ARG 66 -15.690 -5.335 1.511 512 HE ARG 66 HE ARG 66 -16.947 -7.897 2.162 513 HH11 ARG 66 HH11 ARG 66 -15.249 -5.092 3.486 514 HH12 ARG 66 HH12 ARG 66 -15.893 -5.305 5.090 515 HH21 ARG 66 HH21 ARG 66 -17.788 -8.145 4.254 516 HH22 ARG 66 HH22 ARG 66 -17.343 -7.025 5.525 517 H TYR 67 H TYR 67 -13.999 -7.529 -4.170 518 HA TYR 67 HA TYR 67 -12.719 -4.964 -5.000 519 HB2 TYR 67 HB2 TYR 67 -11.367 -7.473 -4.001 520 HB3 TYR 67 HB3 TYR 67 -10.527 -6.070 -4.646 521 HD1 TYR 67 HD2 TYR 67 -11.447 -3.727 -3.483 522 HD2 TYR 67 HD1 TYR 67 -11.352 -7.637 -1.692 523 HE1 TYR 67 HE2 TYR 67 -11.494 -2.696 -1.230 524 HE2 TYR 67 HE1 TYR 67 -11.369 -6.618 0.558 525 HH TYR 67 HH TYR 67 -11.443 -4.679 1.768 526 H THR 68 H THR 68 -14.619 -7.210 -6.101 527 HA THR 68 HA THR 68 -13.068 -7.761 -8.594 528 HB THR 68 HB THR 68 -14.722 -9.624 -8.905 529 HG1 THR 68 HG1 THR 68 -16.357 -8.841 -7.537 530 HG21 THR 68 HG21 THR 68 -13.170 -9.715 -6.297 531 HG22 THR 68 HG22 THR 68 -13.703 -11.106 -7.260 532 HG23 THR 68 HG23 THR 68 -12.478 -9.992 -7.915 533 H SER 69 H SER 69 -14.529 -5.290 -7.820 534 HA SER 69 HA SER 69 -17.043 -5.135 -9.159 535 HB2 SER 69 HB2 SER 69 -16.756 -2.721 -8.759 536 HB3 SER 69 HB3 SER 69 -16.303 -3.661 -7.325 537 HG SER 69 HG SER 69 -14.760 -2.041 -7.844 538 H THR 70 H THR 70 -14.212 -5.792 -10.695 539 HA THR 70 HA THR 70 -14.997 -4.313 -13.121 540 HB THR 70 HB THR 70 -13.577 -2.704 -12.097 541 HG1 THR 70 HG1 THR 70 -11.864 -2.663 -13.563 542 HG21 THR 70 HG21 THR 70 -11.605 -4.971 -11.639 543 HG22 THR 70 HG22 THR 70 -11.258 -3.251 -11.362 544 HG23 THR 70 HG23 THR 70 -12.494 -4.063 -10.385 545 H ALA 71 H ALA 71 -13.654 -4.931 -14.992 546 HA ALA 71 HA ALA 71 -13.795 -7.730 -15.349 547 HB1 ALA 71 HB1 ALA 71 -14.142 -6.037 -17.105 548 HB2 ALA 71 HB2 ALA 71 -12.431 -5.570 -17.003 549 HB3 ALA 71 HB3 ALA 71 -12.875 -7.193 -17.578 550 H GLU 72 H GLU 72 -11.213 -5.863 -13.959 551 HA GLU 72 HA GLU 72 -8.984 -7.435 -14.797 552 HB2 GLU 72 HB2 GLU 72 -9.500 -5.859 -12.277 553 HB3 GLU 72 HB3 GLU 72 -7.923 -6.545 -12.710 554 HG2 GLU 72 HG2 GLU 72 -7.947 -5.225 -14.804 555 HG3 GLU 72 HG3 GLU 72 -9.493 -4.497 -14.319 556 H HIS 73 H HIS 73 -11.701 -8.318 -12.961 557 HA HIS 73 HA HIS 73 -10.304 -10.680 -11.840 558 HB2 HIS 73 HB2 HIS 73 -12.283 -9.122 -10.170 559 HB3 HIS 73 HB3 HIS 73 -11.063 -10.284 -9.645 560 HD2 HIS 73 HD2 HIS 73 -11.698 -6.628 -9.970 561 HE1 HIS 73 HE1 HIS 73 -7.502 -6.908 -9.422 562 HE2 HIS 73 HE2 HIS 73 -9.488 -5.327 -9.453 563 H VAL 74 H VAL 74 -12.159 -10.185 -14.119 564 HA VAL 74 HA VAL 74 -14.848 -10.554 -13.594 565 HB VAL 74 HB VAL 74 -13.749 -9.987 -15.747 566 HG11 VAL 74 HG11 VAL 74 -13.313 -12.981 -16.017 567 HG12 VAL 74 HG12 VAL 74 -13.011 -11.752 -17.263 568 HG13 VAL 74 HG13 VAL 74 -12.029 -11.766 -15.784 569 HG21 VAL 74 HG21 VAL 74 -16.150 -10.605 -15.616 570 HG22 VAL 74 HG22 VAL 74 -15.415 -11.066 -17.166 571 HG23 VAL 74 HG23 VAL 74 -15.713 -12.299 -15.932 572 H ALA 75 H ALA 75 -12.327 -13.009 -13.412 573 HA ALA 75 HA ALA 75 -14.381 -15.157 -13.231 574 HB1 ALA 75 HB1 ALA 75 -11.334 -15.262 -13.168 575 HB2 ALA 75 HB2 ALA 75 -12.434 -16.660 -13.222 576 HB3 ALA 75 HB3 ALA 75 -12.356 -15.534 -14.598 577 H ILE 76 H ILE 76 -11.867 -13.528 -11.198 578 HA ILE 76 HA ILE 76 -12.274 -15.170 -8.902 579 HB ILE 76 HB ILE 76 -11.440 -12.245 -9.105 580 HG12 ILE 76 HG12 ILE 76 -9.802 -14.810 -9.001 581 HG13 ILE 76 HG13 ILE 76 -9.960 -13.725 -10.385 582 HG21 ILE 76 HG21 ILE 76 -11.065 -14.260 -6.859 583 HG22 ILE 76 HG22 ILE 76 -10.410 -12.610 -6.889 584 HG23 ILE 76 HG23 ILE 76 -12.150 -12.846 -6.817 585 HD11 ILE 76 HD11 ILE 76 -7.850 -13.279 -9.341 586 HD12 ILE 76 HD12 ILE 76 -8.920 -11.892 -9.040 587 HD13 ILE 76 HD13 ILE 76 -8.600 -13.083 -7.752 588 H ARG 77 H ARG 77 -14.084 -12.526 -10.321 589 HA ARG 77 HA ARG 77 -15.779 -11.716 -8.241 590 HB2 ARG 77 HB2 ARG 77 -15.512 -10.723 -10.525 591 HB3 ARG 77 HB3 ARG 77 -16.359 -12.118 -11.204 592 HG2 ARG 77 HG2 ARG 77 -18.377 -11.511 -9.860 593 HG3 ARG 77 HG3 ARG 77 -17.506 -10.081 -9.253 594 HD2 ARG 77 HD2 ARG 77 -17.227 -9.281 -11.582 595 HD3 ARG 77 HD3 ARG 77 -18.005 -10.760 -12.174 596 HE ARG 77 HE ARG 77 -20.095 -9.940 -11.565 597 HH11 ARG 77 HH11 ARG 77 -17.569 -7.794 -10.294 598 HH12 ARG 77 HH12 ARG 77 -18.708 -6.533 -9.877 599 HH21 ARG 77 HH21 ARG 77 -21.537 -8.268 -11.000 600 HH22 ARG 77 HH22 ARG 77 -20.938 -6.804 -10.267 601 H SER 78 H SER 78 -15.601 -14.765 -9.855 602 HA SER 78 HA SER 78 -18.205 -15.606 -8.640 603 HB2 SER 78 HB2 SER 78 -16.939 -16.413 -11.293 604 HB3 SER 78 HB3 SER 78 -18.402 -17.156 -10.586 605 HG SER 78 HG SER 78 -18.899 -15.490 -12.077 606 H LYS 79 H LYS 79 -14.752 -16.160 -8.752 607 HA LYS 79 HA LYS 79 -15.004 -18.977 -8.087 608 HB2 LYS 79 HB2 LYS 79 -12.688 -17.004 -7.985 609 HB3 LYS 79 HB3 LYS 79 -12.560 -18.678 -7.456 610 HG2 LYS 79 HG2 LYS 79 -13.162 -17.708 -10.267 611 HG3 LYS 79 HG3 LYS 79 -11.723 -18.545 -9.696 612 HD2 LYS 79 HD2 LYS 79 -14.519 -19.655 -10.093 613 HD3 LYS 79 HD3 LYS 79 -12.999 -20.167 -10.856 614 HE2 LYS 79 HE2 LYS 79 -12.189 -20.857 -8.539 615 HE3 LYS 79 HE3 LYS 79 -13.841 -20.533 -7.948 616 HZ1 LYS 79 HZ1 LYS 79 -13.536 -22.841 -8.508 617 HZ2 LYS 79 HZ2 LYS 79 -14.661 -22.163 -9.499 618 HZ3 LYS 79 HZ3 LYS 79 -13.144 -22.464 -10.059 619 H LEU 80 H LEU 80 -14.823 -15.905 -6.224 620 HA LEU 80 HA LEU 80 -14.407 -17.320 -3.709 621 HB2 LEU 80 HB2 LEU 80 -15.151 -14.513 -4.582 622 HB3 LEU 80 HB3 LEU 80 -15.282 -14.995 -2.881 623 HG LEU 80 HG LEU 80 -12.942 -15.483 -2.727 624 HD11 LEU 80 HD11 LEU 80 -12.827 -14.952 -5.718 625 HD12 LEU 80 HD12 LEU 80 -11.399 -15.066 -4.669 626 HD13 LEU 80 HD13 LEU 80 -12.446 -16.481 -4.884 627 HD21 LEU 80 HD21 LEU 80 -11.998 -13.249 -3.299 628 HD22 LEU 80 HD22 LEU 80 -13.436 -12.909 -4.275 629 HD23 LEU 80 HD23 LEU 80 -13.585 -13.132 -2.513 630 H GLN 81 H GLN 81 -17.145 -16.200 -5.702 631 HA GLN 81 HA GLN 81 -19.163 -16.844 -3.750 632 HB2 GLN 81 HB2 GLN 81 -18.997 -16.189 -6.677 633 HB3 GLN 81 HB3 GLN 81 -20.387 -17.121 -6.182 634 HG2 GLN 81 HG2 GLN 81 -19.576 -14.390 -5.160 635 HG3 GLN 81 HG3 GLN 81 -21.040 -14.832 -6.056 636 HE21 GLN 81 HE22 GLN 81 -21.842 -17.176 -4.639 637 HE22 GLN 81 HE21 GLN 81 -22.227 -16.718 -2.981 638 H TYR 82 H TYR 82 -17.587 -18.644 -6.423 639 HA TYR 82 HA TYR 82 -19.179 -20.982 -6.324 640 HB2 TYR 82 HB2 TYR 82 -17.614 -20.646 -8.148 641 HB3 TYR 82 HB3 TYR 82 -16.300 -20.339 -7.032 642 HD1 TYR 82 HD2 TYR 82 -18.353 -22.987 -8.585 643 HD2 TYR 82 HD1 TYR 82 -15.043 -22.094 -5.984 644 HE1 TYR 82 HE2 TYR 82 -17.622 -25.355 -8.711 645 HE2 TYR 82 HE1 TYR 82 -14.317 -24.460 -6.082 646 HH TYR 82 HH TYR 82 -14.729 -26.552 -6.948 647 H ARG 83 H ARG 83 -16.309 -20.010 -4.353 648 HA ARG 83 HA ARG 83 -16.314 -22.643 -3.098 649 HB2 ARG 83 HB2 ARG 83 -14.218 -21.365 -3.516 650 HB3 ARG 83 HB3 ARG 83 -14.755 -20.126 -2.373 651 HG2 ARG 83 HG2 ARG 83 -13.167 -21.745 -1.357 652 HG3 ARG 83 HG3 ARG 83 -14.744 -21.738 -0.535 653 HD2 ARG 83 HD2 ARG 83 -13.996 -24.024 -0.798 654 HD3 ARG 83 HD3 ARG 83 -15.381 -23.788 -1.857 655 HE ARG 83 HE ARG 83 -12.968 -23.232 -3.300 656 HH11 ARG 83 HH11 ARG 83 -14.799 -25.936 -1.946 657 HH12 ARG 83 HH12 ARG 83 -14.131 -27.105 -3.061 658 HH21 ARG 83 HH21 ARG 83 -12.082 -24.789 -4.727 659 HH22 ARG 83 HH22 ARG 83 -12.598 -26.452 -4.634 660 H LEU 84 H LEU 84 -17.582 -19.413 -2.374 661 HA LEU 84 HA LEU 84 -18.300 -19.943 0.350 662 HB2 LEU 84 HB2 LEU 84 -18.161 -17.748 -0.972 663 HB3 LEU 84 HB3 LEU 84 -19.748 -18.128 -1.632 664 HG LEU 84 HG LEU 84 -19.045 -17.846 1.294 665 HD11 LEU 84 HD11 LEU 84 -20.356 -15.879 -0.600 666 HD12 LEU 84 HD12 LEU 84 -20.175 -15.653 1.157 667 HD13 LEU 84 HD13 LEU 84 -18.729 -15.734 0.132 668 HD21 LEU 84 HD21 LEU 84 -21.041 -19.161 1.159 669 HD22 LEU 84 HD22 LEU 84 -21.520 -17.526 1.601 670 HD23 LEU 84 HD23 LEU 84 -21.740 -18.078 -0.078 671 H GLU 85 H GLU 85 -19.843 -20.417 -2.795 672 HA GLU 85 HA GLU 85 -22.338 -21.500 -1.932 673 HB2 GLU 85 HB2 GLU 85 -20.725 -21.399 -4.481 674 HB3 GLU 85 HB3 GLU 85 -22.201 -22.348 -4.436 675 HG2 GLU 85 HG2 GLU 85 -23.527 -20.432 -3.732 676 HG3 GLU 85 HG3 GLU 85 -22.078 -19.442 -3.550 677 H LEU 86 H LEU 86 -19.342 -22.833 -1.406 678 HA LEU 86 HA LEU 86 -20.527 -25.570 -1.350 679 HB2 LEU 86 HB2 LEU 86 -17.741 -24.760 -2.264 680 HB3 LEU 86 HB3 LEU 86 -18.235 -26.434 -1.942 681 HG LEU 86 HG LEU 86 -19.532 -24.642 -4.035 682 HD11 LEU 86 HD11 LEU 86 -17.504 -26.897 -4.309 683 HD12 LEU 86 HD12 LEU 86 -18.307 -26.051 -5.651 684 HD13 LEU 86 HD13 LEU 86 -17.190 -25.170 -4.585 685 HD21 LEU 86 HD21 LEU 86 -19.762 -27.631 -3.469 686 HD22 LEU 86 HD22 LEU 86 -21.037 -26.422 -3.205 687 HD23 LEU 86 HD23 LEU 86 -20.482 -26.779 -4.850 688 H ALA 87 H ALA 87 -18.642 -23.060 0.216 689 HA ALA 87 HA ALA 87 -17.441 -24.722 2.226 690 HB1 ALA 87 HB1 ALA 87 -18.243 -21.776 2.281 691 HB2 ALA 87 HB2 ALA 87 -17.112 -22.582 3.391 692 HB3 ALA 87 HB3 ALA 87 -16.688 -22.406 1.674 693 H GLN 88 H GLN 88 -20.619 -23.159 1.849 694 HA GLN 88 HA GLN 88 -21.493 -23.597 4.551 695 HB2 GLN 88 HB2 GLN 88 -22.995 -23.061 1.954 696 HB3 GLN 88 HB3 GLN 88 -23.694 -22.997 3.583 697 HG2 GLN 88 HG2 GLN 88 -22.044 -21.224 4.208 698 HG3 GLN 88 HG3 GLN 88 -21.430 -21.236 2.553 699 HE21 GLN 88 HE22 GLN 88 -22.691 -19.019 4.048 700 HE22 GLN 88 HE21 GLN 88 -24.086 -18.540 3.106 701 H GLY 89 H GLY 89 -20.573 -25.849 2.421 702 HA2 GLY 89 HA2 GLY 89 -22.512 -27.857 3.433 703 HA3 GLY 89 HA3 GLY 89 -22.129 -27.778 1.698 704 H ALA 90 H ALA 90 -19.527 -26.859 3.766 705 HA ALA 90 HA ALA 90 -18.412 -29.598 3.873 706 HB1 ALA 90 HB1 ALA 90 -17.012 -27.197 2.636 707 HB2 ALA 90 HB2 ALA 90 -16.295 -28.811 2.882 708 HB3 ALA 90 HB3 ALA 90 -17.648 -28.595 1.743 709 H VAL 91 H VAL 91 -18.949 -26.538 5.306 710 HA VAL 91 HA VAL 91 -16.725 -26.422 7.089 711 HB VAL 91 HB VAL 91 -18.341 -24.605 6.484 712 HG11 VAL 91 HG11 VAL 91 -20.439 -25.906 6.733 713 HG12 VAL 91 HG12 VAL 91 -20.166 -25.992 8.483 714 HG13 VAL 91 HG13 VAL 91 -20.453 -24.425 7.713 715 HG21 VAL 91 HG21 VAL 91 -18.309 -23.528 8.673 716 HG22 VAL 91 HG22 VAL 91 -18.043 -25.088 9.471 717 HG23 VAL 91 HG23 VAL 91 -16.793 -24.406 8.407 718 H GLY 92 H GLY 92 -19.353 -28.559 6.878 719 HA2 GLY 92 HA2 GLY 92 -18.667 -29.757 9.502 720 HA3 GLY 92 HA3 GLY 92 -20.353 -29.325 9.198 721 H SER 93 H SER 93 -18.603 -30.308 6.379 722 HA SER 93 HA SER 93 -19.305 -33.160 6.640 723 HB2 SER 93 HB2 SER 93 -20.356 -31.395 4.404 724 HB3 SER 93 HB3 SER 93 -20.553 -33.157 4.544 725 HG SER 93 HG SER 93 -21.719 -32.772 6.498 726 H VAL 94 H VAL 94 -18.595 -34.331 4.542 727 HA VAL 94 HA VAL 94 -16.293 -33.043 3.258 728 HB VAL 94 HB VAL 94 -16.009 -35.622 4.827 729 HG11 VAL 94 HG11 VAL 94 -14.006 -33.876 3.344 730 HG12 VAL 94 HG12 VAL 94 -13.611 -35.325 4.306 731 HG13 VAL 94 HG13 VAL 94 -14.583 -35.476 2.827 732 HG21 VAL 94 HG21 VAL 94 -16.174 -33.731 6.386 733 HG22 VAL 94 HG22 VAL 94 -14.507 -34.322 6.315 734 HG23 VAL 94 HG23 VAL 94 -14.958 -32.833 5.454 735 H GLN 95 H GLN 95 -16.838 -33.326 1.228 736 HA GLN 95 HA GLN 95 -17.173 -36.082 0.247 737 HB2 GLN 95 HB2 GLN 95 -19.070 -35.458 -1.168 738 HB3 GLN 95 HB3 GLN 95 -19.423 -35.178 0.561 739 HG2 GLN 95 HG2 GLN 95 -18.418 -32.886 -1.070 740 HG3 GLN 95 HG3 GLN 95 -20.111 -33.380 -1.213 741 HE21 GLN 95 HE22 GLN 95 -18.135 -31.280 0.457 742 HE22 GLN 95 HE21 GLN 95 -19.072 -31.171 1.933 743 H ILE 96 H ILE 96 -15.206 -33.612 0.235 744 HA ILE 96 HA ILE 96 -14.400 -34.071 -2.565 745 HB ILE 96 HB ILE 96 -14.227 -31.282 -1.393 746 HG12 ILE 96 HG12 ILE 96 -16.533 -32.402 -3.047 747 HG13 ILE 96 HG13 ILE 96 -16.607 -31.817 -1.369 748 HG21 ILE 96 HG21 ILE 96 -14.340 -32.320 -4.266 749 HG22 ILE 96 HG22 ILE 96 -13.950 -30.664 -3.744 750 HG23 ILE 96 HG23 ILE 96 -12.835 -31.986 -3.396 751 HD11 ILE 96 HD11 ILE 96 -17.463 -30.095 -2.825 752 HD12 ILE 96 HD12 ILE 96 -15.917 -29.555 -2.147 753 HD13 ILE 96 HD13 ILE 96 -16.008 -30.140 -3.827 754 HA PRO 97 HA PRO 97 -11.028 -34.003 0.797 755 HB2 PRO 97 HB2 PRO 97 -10.485 -36.658 1.118 756 HB3 PRO 97 HB3 PRO 97 -11.784 -35.822 2.034 757 HG2 PRO 97 HG2 PRO 97 -12.041 -37.452 -0.510 758 HG3 PRO 97 HG3 PRO 97 -13.012 -37.605 0.995 759 HD2 PRO 97 HD2 PRO 97 -13.898 -36.174 -1.145 760 HD3 PRO 97 HD3 PRO 97 -14.189 -35.616 0.529 761 H VAL 98 H VAL 98 -8.799 -34.492 0.456 762 HA VAL 98 HA VAL 98 -8.048 -35.616 -2.166 763 HB VAL 98 HB VAL 98 -6.623 -33.599 -2.649 764 HG11 VAL 98 HG11 VAL 98 -9.601 -33.011 -2.507 765 HG12 VAL 98 HG12 VAL 98 -8.413 -32.252 -3.585 766 HG13 VAL 98 HG13 VAL 98 -8.802 -33.970 -3.775 767 HG21 VAL 98 HG21 VAL 98 -6.619 -32.644 -0.349 768 HG22 VAL 98 HG22 VAL 98 -7.156 -31.473 -1.567 769 HG23 VAL 98 HG23 VAL 98 -8.349 -32.270 -0.519 770 H VAL 99 H VAL 99 -7.540 -35.570 1.089 771 HA VAL 99 HA VAL 99 -4.778 -36.561 0.777 772 HB VAL 99 HB VAL 99 -4.087 -35.273 2.823 773 HG11 VAL 99 HG11 VAL 99 -4.858 -33.558 0.443 774 HG12 VAL 99 HG12 VAL 99 -3.614 -33.188 1.654 775 HG13 VAL 99 HG13 VAL 99 -3.402 -34.575 0.558 776 HG21 VAL 99 HG21 VAL 99 -6.593 -33.638 2.251 777 HG22 VAL 99 HG22 VAL 99 -6.357 -34.711 3.652 778 HG23 VAL 99 HG23 VAL 99 -5.335 -33.270 3.455 779 H GLU 100 H GLU 100 -7.768 -37.362 1.637 780 HA GLU 100 HA GLU 100 -7.551 -38.251 4.334 781 HB2 GLU 100 HB2 GLU 100 -9.465 -39.650 3.824 782 HB3 GLU 100 HB3 GLU 100 -9.687 -38.037 3.118 783 HG2 GLU 100 HG2 GLU 100 -8.956 -38.905 0.913 784 HG3 GLU 100 HG3 GLU 100 -8.743 -40.522 1.609 785 H VAL 101 H VAL 101 -7.431 -40.502 5.106 786 HA VAL 101 HA VAL 101 -5.915 -42.358 3.416 787 HB VAL 101 HB VAL 101 -4.413 -40.741 4.657 788 HG11 VAL 101 HG11 VAL 101 -5.291 -42.345 7.087 789 HG12 VAL 101 HG12 VAL 101 -4.002 -41.132 7.038 790 HG13 VAL 101 HG13 VAL 101 -5.685 -40.638 6.774 791 HG21 VAL 101 HG21 VAL 101 -4.092 -43.695 5.351 792 HG22 VAL 101 HG22 VAL 101 -3.635 -42.935 3.801 793 HG23 VAL 101 HG23 VAL 101 -2.799 -42.481 5.300 794 H ASP 102 H ASP 102 -5.819 -44.523 4.328 795 HA ASP 102 HA ASP 102 -7.588 -45.170 6.595 796 HB2 ASP 102 HB2 ASP 102 -8.009 -46.122 3.728 797 HB3 ASP 102 HB3 ASP 102 -8.761 -46.858 5.146 798 H GLU 103 H GLU 103 -7.474 -47.594 7.005 799 HA GLU 103 HA GLU 103 -4.946 -48.804 6.039 800 HB2 GLU 103 HB2 GLU 103 -5.841 -48.956 8.922 801 HB3 GLU 103 HB3 GLU 103 -4.296 -49.417 8.227 802 HG2 GLU 103 HG2 GLU 103 -3.957 -46.966 7.618 803 HG3 GLU 103 HG3 GLU 103 -5.385 -46.597 8.593 804 H LEU 104 H LEU 104 -4.915 -51.164 7.124 805 HA LEU 104 HA LEU 104 -7.157 -52.545 5.921 806 HB2 LEU 104 HB2 LEU 104 -4.845 -53.564 7.599 807 HB3 LEU 104 HB3 LEU 104 -5.929 -54.569 6.702 808 HG LEU 104 HG LEU 104 -3.932 -54.446 5.467 809 HD11 LEU 104 HD11 LEU 104 -4.705 -53.588 3.319 810 HD12 LEU 104 HD12 LEU 104 -6.051 -54.376 4.172 811 HD13 LEU 104 HD13 LEU 104 -5.934 -52.597 4.128 812 HD21 LEU 104 HD21 LEU 104 -2.864 -52.482 4.655 813 HD22 LEU 104 HD22 LEU 104 -4.139 -51.428 5.271 814 HD23 LEU 104 HD23 LEU 104 -3.066 -52.288 6.407 815 HA PRO 105 HA PRO 105 -9.572 -53.110 9.562 816 HB2 PRO 105 HB2 PRO 105 -11.056 -55.285 8.933 817 HB3 PRO 105 HB3 PRO 105 -11.083 -53.828 7.887 818 HG2 PRO 105 HG2 PRO 105 -9.503 -56.380 7.502 819 HG3 PRO 105 HG3 PRO 105 -10.461 -55.466 6.287 820 HD2 PRO 105 HD2 PRO 105 -7.711 -55.252 6.703 821 HD3 PRO 105 HD3 PRO 105 -8.673 -53.968 5.942 822 H GLU 106 H GLU 106 -6.780 -54.434 9.530 823 HA GLU 106 HA GLU 106 -5.552 -55.848 10.807 824 HB2 GLU 106 HB2 GLU 106 -7.879 -55.396 12.705 825 HB3 GLU 106 HB3 GLU 106 -6.326 -56.136 13.167 826 HG2 GLU 106 HG2 GLU 106 -5.141 -54.092 12.419 827 HG3 GLU 106 HG3 GLU 106 -6.695 -53.344 12.009 828 H GLY 107 H GLY 107 -7.580 -57.015 8.939 829 HA2 GLY 107 HA2 GLY 107 -7.261 -59.792 9.793 830 HA3 GLY 107 HA3 GLY 107 -8.948 -59.232 9.698 831 H TYR 108 H TYR 108 -6.650 -57.770 7.516 832 HA TYR 108 HA TYR 108 -8.061 -58.573 5.196 833 HB2 TYR 108 HB2 TYR 108 -6.350 -57.458 3.971 834 HB3 TYR 108 HB3 TYR 108 -6.725 -56.518 5.404 835 HD1 TYR 108 HD2 TYR 108 -5.151 -56.960 7.494 836 HD2 TYR 108 HD1 TYR 108 -4.151 -57.868 3.413 837 HE1 TYR 108 HE2 TYR 108 -2.731 -56.924 8.079 838 HE2 TYR 108 HE1 TYR 108 -1.733 -57.824 3.987 839 HH TYR 108 HH TYR 108 -0.176 -57.515 5.647 840 H ASP 109 H ASP 109 -6.826 -59.540 3.255 841 HA ASP 109 HA ASP 109 -6.424 -62.296 3.881 842 HB2 ASP 109 HB2 ASP 109 -7.579 -61.322 1.859 843 HB3 ASP 109 HB3 ASP 109 -5.994 -60.820 1.253 844 H ARG 110 H ARG 110 -4.350 -60.372 4.909 845 HA ARG 110 HA ARG 110 -2.117 -60.078 5.098 846 HB2 ARG 110 HB2 ARG 110 -2.043 -63.036 4.475 847 HB3 ARG 110 HB3 ARG 110 -0.860 -62.098 5.394 848 HG2 ARG 110 HG2 ARG 110 -3.736 -62.652 6.203 849 HG3 ARG 110 HG3 ARG 110 -2.284 -63.358 6.931 850 HD2 ARG 110 HD2 ARG 110 -3.065 -60.412 6.978 851 HD3 ARG 110 HD3 ARG 110 -3.191 -61.555 8.327 852 HE ARG 110 HE ARG 110 -0.499 -61.530 7.357 853 HH11 ARG 110 HH11 ARG 110 -2.783 -59.525 9.163 854 HH12 ARG 110 HH12 ARG 110 -1.536 -58.696 10.055 855 HH21 ARG 110 HH21 ARG 110 1.108 -60.426 8.531 856 HH22 ARG 110 HH22 ARG 110 0.668 -59.201 9.690 857 H SER 111 H SER 111 -3.227 -59.823 2.287 858 HA SER 111 HA SER 111 -0.625 -59.619 0.945 859 HB2 SER 111 HB2 SER 111 -1.435 -61.917 0.422 860 HB3 SER 111 HB3 SER 111 -2.938 -61.217 -0.224 861 HG SER 111 HG SER 111 -1.692 -60.131 -1.780 Start of MODEL 2 1 H1 SER 2 H1 SER 2 7.517 -1.955 -5.650 2 H2 SER 2 H2 SER 2 8.499 -3.180 -6.118 3 H3 SER 2 H3 SER 2 8.220 -2.918 -4.516 4 HA SER 2 HA SER 2 5.933 -3.484 -4.740 5 HB2 SER 2 HB2 SER 2 6.674 -4.046 -7.633 6 HB3 SER 2 HB3 SER 2 5.096 -4.387 -6.872 7 HG SER 2 HG SER 2 5.110 -2.385 -7.962 8 H GLN 3 H GLN 3 5.536 -5.446 -3.870 9 HA GLN 3 HA GLN 3 7.081 -7.782 -4.768 10 HB2 GLN 3 HB2 GLN 3 7.836 -8.334 -2.498 11 HB3 GLN 3 HB3 GLN 3 8.499 -6.777 -3.026 12 HG2 GLN 3 HG2 GLN 3 6.750 -5.586 -1.733 13 HG3 GLN 3 HG3 GLN 3 6.084 -7.141 -1.197 14 HE21 GLN 3 HE22 GLN 3 6.776 -5.373 0.748 15 HE22 GLN 3 HE21 GLN 3 8.253 -5.876 1.543 16 H PHE 4 H PHE 4 4.150 -6.551 -4.259 17 HA PHE 4 HA PHE 4 2.777 -8.188 -2.453 18 HB2 PHE 4 HB2 PHE 4 1.865 -6.195 -3.548 19 HB3 PHE 4 HB3 PHE 4 1.944 -6.979 -5.113 20 HD1 PHE 4 HD1 PHE 4 0.531 -9.225 -5.359 21 HD2 PHE 4 HD2 PHE 4 -0.128 -6.227 -2.358 22 HE1 PHE 4 HE1 PHE 4 -1.749 -10.090 -5.018 23 HE2 PHE 4 HE2 PHE 4 -2.462 -7.022 -2.062 24 HZ PHE 4 HZ PHE 4 -3.286 -8.954 -3.403 25 H GLU 5 H GLU 5 3.381 -8.725 -5.975 26 HA GLU 5 HA GLU 5 2.046 -11.323 -5.881 27 HB2 GLU 5 HB2 GLU 5 3.770 -10.001 -8.023 28 HB3 GLU 5 HB3 GLU 5 2.823 -11.496 -8.228 29 HG2 GLU 5 HG2 GLU 5 0.746 -10.238 -7.678 30 HG3 GLU 5 HG3 GLU 5 1.695 -8.746 -7.542 31 H LYS 6 H LYS 6 5.321 -10.165 -5.357 32 HA LYS 6 HA LYS 6 6.713 -12.512 -6.181 33 HB2 LYS 6 HB2 LYS 6 7.687 -10.251 -5.930 34 HB3 LYS 6 HB3 LYS 6 7.503 -10.409 -4.183 35 HG2 LYS 6 HG2 LYS 6 9.791 -10.895 -4.863 36 HG3 LYS 6 HG3 LYS 6 9.030 -12.332 -4.168 37 HD2 LYS 6 HD2 LYS 6 8.608 -13.227 -6.433 38 HD3 LYS 6 HD3 LYS 6 9.289 -11.761 -7.156 39 HE2 LYS 6 HE2 LYS 6 10.795 -13.698 -5.342 40 HE3 LYS 6 HE3 LYS 6 10.885 -13.677 -7.122 41 HZ1 LYS 6 HZ1 LYS 6 11.686 -11.466 -5.346 42 HZ2 LYS 6 HZ2 LYS 6 12.703 -12.472 -6.145 43 HZ3 LYS 6 HZ3 LYS 6 11.737 -11.443 -6.990 44 H GLN 7 H GLN 7 5.401 -11.475 -3.003 45 HA GLN 7 HA GLN 7 6.482 -13.775 -1.626 46 HB2 GLN 7 HB2 GLN 7 5.403 -11.304 -0.962 47 HB3 GLN 7 HB3 GLN 7 4.104 -12.418 -0.488 48 HG2 GLN 7 HG2 GLN 7 7.031 -12.498 0.346 49 HG3 GLN 7 HG3 GLN 7 5.668 -12.005 1.363 50 HE21 GLN 7 HE22 GLN 7 3.814 -13.798 1.434 51 HE22 GLN 7 HE21 GLN 7 4.392 -15.425 1.700 52 H LYS 8 H LYS 8 3.533 -13.058 -3.406 53 HA LYS 8 HA LYS 8 1.918 -15.148 -2.183 54 HB2 LYS 8 HB2 LYS 8 1.129 -12.912 -3.020 55 HB3 LYS 8 HB3 LYS 8 1.523 -13.414 -4.635 56 HG2 LYS 8 HG2 LYS 8 -0.133 -15.425 -4.150 57 HG3 LYS 8 HG3 LYS 8 -0.672 -14.412 -2.817 58 HD2 LYS 8 HD2 LYS 8 -2.099 -13.794 -4.641 59 HD3 LYS 8 HD3 LYS 8 -0.855 -12.530 -4.632 60 HE2 LYS 8 HE2 LYS 8 -0.977 -13.219 -6.905 61 HE3 LYS 8 HE3 LYS 8 0.476 -13.987 -6.268 62 HZ1 LYS 8 HZ1 LYS 8 -0.802 -15.567 -7.495 63 HZ2 LYS 8 HZ2 LYS 8 -0.872 -15.993 -5.917 64 HZ3 LYS 8 HZ3 LYS 8 -2.165 -15.263 -6.621 65 H GLU 9 H GLU 9 3.183 -14.583 -5.497 66 HA GLU 9 HA GLU 9 2.400 -17.081 -6.581 67 HB2 GLU 9 HB2 GLU 9 4.573 -15.080 -7.156 68 HB3 GLU 9 HB3 GLU 9 4.342 -16.509 -8.183 69 HG2 GLU 9 HG2 GLU 9 2.211 -14.405 -7.595 70 HG3 GLU 9 HG3 GLU 9 3.203 -14.452 -9.057 71 H GLN 10 H GLN 10 5.274 -16.230 -4.608 72 HA GLN 10 HA GLN 10 6.678 -18.675 -5.297 73 HB2 GLN 10 HB2 GLN 10 7.057 -16.583 -3.136 74 HB3 GLN 10 HB3 GLN 10 8.073 -18.038 -3.266 75 HG2 GLN 10 HG2 GLN 10 8.603 -17.445 -5.629 76 HG3 GLN 10 HG3 GLN 10 7.743 -15.919 -5.420 77 HE21 GLN 10 HE22 GLN 10 8.499 -14.563 -3.477 78 HE22 GLN 10 HE21 GLN 10 10.223 -14.549 -3.139 79 H GLY 11 H GLY 11 3.833 -18.348 -3.627 80 HA2 GLY 11 HA2 GLY 11 4.454 -20.749 -1.954 81 HA3 GLY 11 HA3 GLY 11 3.271 -19.521 -1.501 82 H ASN 12 H ASN 12 2.903 -19.687 -4.792 83 HA ASN 12 HA ASN 12 0.468 -21.138 -4.647 84 HB2 ASN 12 HB2 ASN 12 0.229 -20.549 -6.811 85 HB3 ASN 12 HB3 ASN 12 1.585 -19.470 -6.482 86 HD21 ASN 12 HD22 ASN 12 3.692 -20.119 -7.260 87 HD22 ASN 12 HD21 ASN 12 3.818 -21.283 -8.569 88 H SER 13 H SER 13 3.800 -22.112 -5.180 89 HA SER 13 HA SER 13 3.104 -24.789 -6.117 90 HB2 SER 13 HB2 SER 13 5.210 -23.642 -6.789 91 HB3 SER 13 HB3 SER 13 5.737 -23.629 -5.090 92 HG SER 13 HG SER 13 6.586 -25.411 -6.271 93 H LEU 14 H LEU 14 4.065 -23.242 -3.016 94 HA LEU 14 HA LEU 14 4.387 -25.614 -1.485 95 HB2 LEU 14 HB2 LEU 14 3.729 -22.710 -0.961 96 HB3 LEU 14 HB3 LEU 14 3.530 -23.868 0.341 97 HG LEU 14 HG LEU 14 5.885 -24.550 0.170 98 HD11 LEU 14 HD11 LEU 14 6.052 -22.439 -2.017 99 HD12 LEU 14 HD12 LEU 14 7.444 -23.242 -1.250 100 HD13 LEU 14 HD13 LEU 14 6.304 -24.193 -2.215 101 HD21 LEU 14 HD21 LEU 14 6.863 -22.443 0.979 102 HD22 LEU 14 HD22 LEU 14 5.507 -21.537 0.272 103 HD23 LEU 14 HD23 LEU 14 5.220 -22.666 1.617 104 H PHE 15 H PHE 15 1.534 -23.697 -2.412 105 HA PHE 15 HA PHE 15 -0.378 -25.074 -0.798 106 HB2 PHE 15 HB2 PHE 15 -0.885 -22.941 -1.756 107 HB3 PHE 15 HB3 PHE 15 -0.465 -23.487 -3.378 108 HD1 PHE 15 HD1 PHE 15 -2.803 -24.508 -0.616 109 HD2 PHE 15 HD2 PHE 15 -2.165 -23.933 -4.819 110 HE1 PHE 15 HE1 PHE 15 -5.182 -25.095 -1.040 111 HE2 PHE 15 HE2 PHE 15 -4.562 -24.481 -5.263 112 HZ PHE 15 HZ PHE 15 -6.058 -25.053 -3.376 113 H LYS 16 H LYS 16 1.411 -26.080 -3.563 114 HA LYS 16 HA LYS 16 -0.581 -28.210 -4.169 115 HB2 LYS 16 HB2 LYS 16 1.687 -27.099 -5.861 116 HB3 LYS 16 HB3 LYS 16 0.540 -28.362 -6.359 117 HG2 LYS 16 HG2 LYS 16 -1.342 -26.828 -6.162 118 HG3 LYS 16 HG3 LYS 16 -0.312 -25.579 -5.449 119 HD2 LYS 16 HD2 LYS 16 1.038 -25.553 -7.581 120 HD3 LYS 16 HD3 LYS 16 -0.208 -26.609 -8.300 121 HE2 LYS 16 HE2 LYS 16 -1.940 -24.912 -7.695 122 HE3 LYS 16 HE3 LYS 16 -0.661 -23.875 -7.018 123 HZ1 LYS 16 HZ1 LYS 16 0.317 -23.714 -9.184 124 HZ2 LYS 16 HZ2 LYS 16 -0.821 -24.721 -9.841 125 HZ3 LYS 16 HZ3 LYS 16 -1.255 -23.240 -9.259 126 H GLN 17 H GLN 17 2.288 -27.698 -2.459 127 HA GLN 17 HA GLN 17 3.485 -30.318 -2.942 128 HB2 GLN 17 HB2 GLN 17 3.977 -28.218 -0.834 129 HB3 GLN 17 HB3 GLN 17 4.865 -29.746 -0.974 130 HG2 GLN 17 HG2 GLN 17 5.346 -29.088 -3.417 131 HG3 GLN 17 HG3 GLN 17 4.788 -27.469 -2.970 132 HE21 GLN 17 HE22 GLN 17 5.713 -27.011 -0.491 133 HE22 GLN 17 HE21 GLN 17 7.453 -27.120 -0.446 134 H GLY 18 H GLY 18 0.815 -29.147 -1.036 135 HA2 GLY 18 HA2 GLY 18 -0.703 -30.550 0.055 136 HA3 GLY 18 HA3 GLY 18 0.507 -31.839 0.131 137 H LEU 19 H LEU 19 1.246 -28.531 1.135 138 HA LEU 19 HA LEU 19 1.005 -29.268 3.995 139 HB2 LEU 19 HB2 LEU 19 3.242 -28.113 4.350 140 HB3 LEU 19 HB3 LEU 19 3.237 -29.734 3.662 141 HG LEU 19 HG LEU 19 3.600 -28.843 1.398 142 HD11 LEU 19 HD11 LEU 19 3.801 -26.150 2.803 143 HD12 LEU 19 HD12 LEU 19 4.237 -26.475 1.110 144 HD13 LEU 19 HD13 LEU 19 2.547 -26.625 1.636 145 HD21 LEU 19 HD21 LEU 19 5.485 -29.462 2.857 146 HD22 LEU 19 HD22 LEU 19 5.924 -28.102 1.796 147 HD23 LEU 19 HD23 LEU 19 5.537 -27.805 3.507 148 H TYR 20 H TYR 20 -0.917 -28.011 2.818 149 HA TYR 20 HA TYR 20 -1.000 -25.443 2.065 150 HB2 TYR 20 HB2 TYR 20 -3.011 -26.676 3.944 151 HB3 TYR 20 HB3 TYR 20 -3.330 -25.482 2.700 152 HD1 TYR 20 HD1 TYR 20 -2.001 -26.583 0.316 153 HD2 TYR 20 HD2 TYR 20 -4.142 -28.602 3.455 154 HE1 TYR 20 HE1 TYR 20 -2.546 -28.426 -1.238 155 HE2 TYR 20 HE2 TYR 20 -4.711 -30.433 1.893 156 HH TYR 20 HH TYR 20 -3.586 -30.451 -1.519 157 H ARG 21 H ARG 21 -0.441 -26.362 5.473 158 HA ARG 21 HA ARG 21 -1.455 -23.989 6.623 159 HB2 ARG 21 HB2 ARG 21 -0.165 -26.359 7.492 160 HB3 ARG 21 HB3 ARG 21 0.871 -25.030 8.049 161 HG2 ARG 21 HG2 ARG 21 -2.118 -25.311 8.544 162 HG3 ARG 21 HG3 ARG 21 -0.841 -25.619 9.736 163 HD2 ARG 21 HD2 ARG 21 -0.144 -23.268 9.643 164 HD3 ARG 21 HD3 ARG 21 -1.337 -22.929 8.383 165 HE ARG 21 HE ARG 21 -1.840 -23.237 11.244 166 HH11 ARG 21 HH11 ARG 21 -3.241 -23.260 8.004 167 HH12 ARG 21 HH12 ARG 21 -4.867 -22.966 8.571 168 HH21 ARG 21 HH21 ARG 21 -3.984 -22.798 11.960 169 HH22 ARG 21 HH22 ARG 21 -5.283 -22.697 10.784 170 H GLU 22 H GLU 22 1.560 -24.601 4.921 171 HA GLU 22 HA GLU 22 2.873 -22.152 5.802 172 HB2 GLU 22 HB2 GLU 22 3.295 -23.867 3.322 173 HB3 GLU 22 HB3 GLU 22 4.448 -22.707 4.004 174 HG2 GLU 22 HG2 GLU 22 3.443 -25.201 5.460 175 HG3 GLU 22 HG3 GLU 22 4.890 -25.122 4.473 176 H ALA 23 H ALA 23 0.927 -23.302 3.109 177 HA ALA 23 HA ALA 23 1.240 -21.053 1.394 178 HB1 ALA 23 HB1 ALA 23 -0.917 -23.182 1.483 179 HB2 ALA 23 HB2 ALA 23 -0.566 -22.099 0.123 180 HB3 ALA 23 HB3 ALA 23 0.648 -23.298 0.643 181 H VAL 24 H VAL 24 -0.771 -21.426 4.242 182 HA VAL 24 HA VAL 24 -2.836 -19.500 3.423 183 HB VAL 24 HB VAL 24 -1.782 -20.353 6.168 184 HG11 VAL 24 HG11 VAL 24 -4.371 -18.933 5.367 185 HG12 VAL 24 HG12 VAL 24 -3.979 -19.524 6.998 186 HG13 VAL 24 HG13 VAL 24 -3.017 -18.227 6.278 187 HG21 VAL 24 HG21 VAL 24 -4.221 -21.318 4.577 188 HG22 VAL 24 HG22 VAL 24 -2.761 -22.264 4.908 189 HG23 VAL 24 HG23 VAL 24 -3.829 -21.799 6.246 190 H HIS 25 H HIS 25 0.076 -19.713 5.216 191 HA HIS 25 HA HIS 25 0.461 -17.026 6.081 192 HB2 HIS 25 HB2 HIS 25 1.479 -19.743 6.330 193 HB3 HIS 25 HB3 HIS 25 2.788 -18.673 6.077 194 HD2 HIS 25 HD2 HIS 25 3.480 -17.196 8.273 195 HE1 HIS 25 HE1 HIS 25 0.190 -18.291 10.746 196 HE2 HIS 25 HE2 HIS 25 2.425 -17.052 10.672 197 H CYS 26 H CYS 26 0.409 -18.011 3.023 198 HA CYS 26 HA CYS 26 2.749 -16.375 2.156 199 HB2 CYS 26 HB2 CYS 26 1.508 -18.883 0.967 200 HB3 CYS 26 HB3 CYS 26 2.546 -17.782 0.061 201 HG CYS 26 HG CYS 26 3.188 -19.321 2.915 202 H TYR 27 H TYR 27 -0.573 -16.432 2.353 203 HA TYR 27 HA TYR 27 -0.804 -14.549 0.033 204 HB2 TYR 27 HB2 TYR 27 -2.993 -16.304 1.161 205 HB3 TYR 27 HB3 TYR 27 -3.076 -15.308 -0.293 206 HD1 TYR 27 HD2 TYR 27 -0.458 -16.122 -1.608 207 HD2 TYR 27 HD1 TYR 27 -3.477 -18.409 0.415 208 HE1 TYR 27 HE2 TYR 27 0.168 -18.116 -2.946 209 HE2 TYR 27 HE1 TYR 27 -2.847 -20.421 -0.900 210 HH TYR 27 HH TYR 27 -1.510 -21.266 -2.550 211 H ASP 28 H ASP 28 -1.089 -15.006 3.426 212 HA ASP 28 HA ASP 28 -3.281 -13.205 3.958 213 HB2 ASP 28 HB2 ASP 28 -2.333 -15.021 5.434 214 HB3 ASP 28 HB3 ASP 28 -0.920 -14.012 5.724 215 H GLN 29 H GLN 29 0.138 -12.731 3.236 216 HA GLN 29 HA GLN 29 0.388 -10.219 4.608 217 HB2 GLN 29 HB2 GLN 29 2.492 -10.040 3.619 218 HB3 GLN 29 HB3 GLN 29 2.274 -11.763 3.944 219 HG2 GLN 29 HG2 GLN 29 1.734 -10.414 1.289 220 HG3 GLN 29 HG3 GLN 29 3.275 -11.171 1.691 221 HE21 GLN 29 HE22 GLN 29 1.669 -11.849 -0.528 222 HE22 GLN 29 HE21 GLN 29 1.150 -13.508 -0.373 223 H LEU 30 H LEU 30 -1.379 -11.080 1.860 224 HA LEU 30 HA LEU 30 -1.074 -8.526 0.438 225 HB2 LEU 30 HB2 LEU 30 -3.022 -10.840 0.073 226 HB3 LEU 30 HB3 LEU 30 -2.667 -9.553 -1.103 227 HG LEU 30 HG LEU 30 -0.808 -11.737 -0.082 228 HD11 LEU 30 HD11 LEU 30 -2.404 -12.540 -1.692 229 HD12 LEU 30 HD12 LEU 30 -2.082 -11.156 -2.767 230 HD13 LEU 30 HD13 LEU 30 -0.826 -12.363 -2.476 231 HD21 LEU 30 HD21 LEU 30 0.830 -10.839 -1.730 232 HD22 LEU 30 HD22 LEU 30 -0.235 -9.460 -2.013 233 HD23 LEU 30 HD23 LEU 30 0.507 -9.687 -0.425 234 H ILE 31 H ILE 31 -3.380 -10.179 2.542 235 HA ILE 31 HA ILE 31 -5.446 -8.193 2.263 236 HB ILE 31 HB ILE 31 -4.877 -10.347 4.346 237 HG12 ILE 31 HG12 ILE 31 -6.962 -10.520 2.162 238 HG13 ILE 31 HG13 ILE 31 -5.293 -10.868 1.776 239 HG21 ILE 31 HG21 ILE 31 -7.315 -10.231 4.853 240 HG22 ILE 31 HG22 ILE 31 -6.459 -8.744 5.293 241 HG23 ILE 31 HG23 ILE 31 -7.446 -8.797 3.813 242 HD11 ILE 31 HD11 ILE 31 -6.416 -12.917 2.341 243 HD12 ILE 31 HD12 ILE 31 -5.171 -12.514 3.552 244 HD13 ILE 31 HD13 ILE 31 -6.894 -12.247 3.928 245 H THR 32 H THR 32 -2.450 -8.343 3.839 246 HA THR 32 HA THR 32 -3.157 -6.114 5.705 247 HB THR 32 HB THR 32 -0.695 -7.892 5.656 248 HG1 THR 32 HG1 THR 32 -2.549 -9.036 6.203 249 HG21 THR 32 HG21 THR 32 -1.755 -5.880 7.687 250 HG22 THR 32 HG22 THR 32 -0.413 -7.020 7.979 251 HG23 THR 32 HG23 THR 32 -0.247 -5.753 6.752 252 H ALA 33 H ALA 33 -1.191 -6.889 2.821 253 HA ALA 33 HA ALA 33 0.377 -4.428 3.057 254 HB1 ALA 33 HB1 ALA 33 1.198 -5.084 0.814 255 HB2 ALA 33 HB2 ALA 33 1.342 -6.412 1.982 256 HB3 ALA 33 HB3 ALA 33 0.024 -6.418 0.780 257 H GLN 34 H GLN 34 -2.496 -5.554 1.276 258 HA GLN 34 HA GLN 34 -3.560 -2.976 0.863 259 HB2 GLN 34 HB2 GLN 34 -3.291 -2.856 -1.644 260 HB3 GLN 34 HB3 GLN 34 -1.889 -2.432 -0.664 261 HG2 GLN 34 HG2 GLN 34 -1.246 -4.981 -1.040 262 HG3 GLN 34 HG3 GLN 34 -2.309 -4.802 -2.451 263 HE21 GLN 34 HE22 GLN 34 0.526 -3.445 -0.747 264 HE22 GLN 34 HE21 GLN 34 1.303 -2.781 -2.167 265 HA PRO 35 HA PRO 35 -6.239 -6.702 0.591 266 HB2 PRO 35 HB2 PRO 35 -8.308 -5.649 2.082 267 HB3 PRO 35 HB3 PRO 35 -6.855 -6.432 2.779 268 HG2 PRO 35 HG2 PRO 35 -7.387 -3.481 2.374 269 HG3 PRO 35 HG3 PRO 35 -6.748 -4.306 3.840 270 HD2 PRO 35 HD2 PRO 35 -5.105 -3.083 2.075 271 HD3 PRO 35 HD3 PRO 35 -4.630 -4.633 2.847 272 H GLN 36 H GLN 36 -6.345 -3.607 -0.746 273 HA GLN 36 HA GLN 36 -8.998 -3.533 -1.788 274 HB2 GLN 36 HB2 GLN 36 -8.160 -1.730 -3.185 275 HB3 GLN 36 HB3 GLN 36 -7.563 -1.565 -1.520 276 HG2 GLN 36 HG2 GLN 36 -5.428 -2.656 -2.210 277 HG3 GLN 36 HG3 GLN 36 -6.010 -2.722 -3.871 278 HE21 GLN 36 HE22 GLN 36 -3.632 -1.455 -3.431 279 HE22 GLN 36 HE21 GLN 36 -3.833 0.279 -3.581 280 H ASN 37 H ASN 37 -7.216 -6.070 -2.301 281 HA ASN 37 HA ASN 37 -7.811 -6.246 -5.210 282 HB2 ASN 37 HB2 ASN 37 -5.240 -6.997 -3.756 283 HB3 ASN 37 HB3 ASN 37 -5.630 -7.522 -5.411 284 HD21 ASN 37 HD22 ASN 37 -4.013 -5.223 -3.604 285 HD22 ASN 37 HD21 ASN 37 -3.902 -3.963 -4.812 286 HA PRO 38 HA PRO 38 -9.897 -9.855 -3.618 287 HB2 PRO 38 HB2 PRO 38 -10.729 -10.935 -5.941 288 HB3 PRO 38 HB3 PRO 38 -11.314 -9.334 -5.387 289 HG2 PRO 38 HG2 PRO 38 -9.033 -9.841 -7.317 290 HG3 PRO 38 HG3 PRO 38 -10.504 -8.833 -7.578 291 HD2 PRO 38 HD2 PRO 38 -8.266 -7.647 -6.678 292 HD3 PRO 38 HD3 PRO 38 -9.818 -7.262 -5.974 293 H VAL 39 H VAL 39 -7.018 -10.045 -5.666 294 HA VAL 39 HA VAL 39 -6.966 -12.893 -5.937 295 HB VAL 39 HB VAL 39 -5.664 -11.249 -7.283 296 HG11 VAL 39 HG11 VAL 39 -3.547 -10.389 -6.442 297 HG12 VAL 39 HG12 VAL 39 -4.879 -9.798 -5.433 298 HG13 VAL 39 HG13 VAL 39 -3.837 -11.117 -4.849 299 HG21 VAL 39 HG21 VAL 39 -4.003 -13.399 -5.899 300 HG22 VAL 39 HG22 VAL 39 -5.109 -13.653 -7.266 301 HG23 VAL 39 HG23 VAL 39 -3.655 -12.655 -7.474 302 H GLY 40 H GLY 40 -5.985 -10.680 -3.371 303 HA2 GLY 40 HA2 GLY 40 -4.519 -12.461 -1.710 304 HA3 GLY 40 HA3 GLY 40 -5.404 -11.018 -1.188 305 H TYR 41 H TYR 41 -7.861 -12.367 -2.542 306 HA TYR 41 HA TYR 41 -8.523 -14.273 -0.368 307 HB2 TYR 41 HB2 TYR 41 -10.593 -12.685 -1.858 308 HB3 TYR 41 HB3 TYR 41 -10.726 -13.455 -0.357 309 HD1 TYR 41 HD1 TYR 41 -9.083 -10.519 -1.954 310 HD2 TYR 41 HD2 TYR 41 -10.370 -12.372 1.698 311 HE1 TYR 41 HE1 TYR 41 -8.745 -8.383 -0.764 312 HE2 TYR 41 HE2 TYR 41 -10.009 -10.228 2.914 313 HH TYR 41 HH TYR 41 -8.914 -7.273 1.223 314 H SER 42 H SER 42 -7.325 -14.640 -3.152 315 HA SER 42 HA SER 42 -9.446 -16.463 -4.208 316 HB2 SER 42 HB2 SER 42 -9.035 -14.443 -5.624 317 HB3 SER 42 HB3 SER 42 -7.345 -14.974 -5.817 318 HG SER 42 HG SER 42 -8.184 -16.937 -6.695 319 H ASN 43 H ASN 43 -6.617 -16.367 -2.543 320 HA ASN 43 HA ASN 43 -5.928 -19.095 -3.480 321 HB2 ASN 43 HB2 ASN 43 -4.006 -16.817 -2.823 322 HB3 ASN 43 HB3 ASN 43 -3.549 -18.506 -3.054 323 HD21 ASN 43 HD22 ASN 43 -4.260 -19.531 -5.177 324 HD22 ASN 43 HD21 ASN 43 -4.117 -18.526 -6.605 325 H LYS 44 H LYS 44 -5.859 -16.642 -0.791 326 HA LYS 44 HA LYS 44 -5.345 -18.637 1.244 327 HB2 LYS 44 HB2 LYS 44 -5.040 -16.154 1.465 328 HB3 LYS 44 HB3 LYS 44 -6.766 -15.944 1.360 329 HG2 LYS 44 HG2 LYS 44 -7.072 -17.360 3.395 330 HG3 LYS 44 HG3 LYS 44 -5.305 -17.534 3.512 331 HD2 LYS 44 HD2 LYS 44 -5.059 -15.103 3.798 332 HD3 LYS 44 HD3 LYS 44 -6.817 -14.891 3.600 333 HE2 LYS 44 HE2 LYS 44 -7.200 -16.344 5.578 334 HE3 LYS 44 HE3 LYS 44 -5.438 -16.448 5.820 335 HZ1 LYS 44 HZ1 LYS 44 -6.462 -14.748 7.187 336 HZ2 LYS 44 HZ2 LYS 44 -5.403 -14.069 6.125 337 HZ3 LYS 44 HZ3 LYS 44 -7.032 -13.962 5.860 338 H ALA 45 H ALA 45 -8.189 -17.122 -0.197 339 HA ALA 45 HA ALA 45 -10.193 -18.533 1.270 340 HB1 ALA 45 HB1 ALA 45 -10.503 -16.382 -0.045 341 HB2 ALA 45 HB2 ALA 45 -10.344 -17.357 -1.524 342 HB3 ALA 45 HB3 ALA 45 -11.697 -17.644 -0.426 343 H MET 46 H MET 46 -7.886 -19.900 -0.642 344 HA MET 46 HA MET 46 -9.664 -22.137 -1.473 345 HB2 MET 46 HB2 MET 46 -8.958 -20.431 -3.337 346 HB3 MET 46 HB3 MET 46 -7.355 -21.180 -3.187 347 HG2 MET 46 HG2 MET 46 -8.449 -23.409 -3.606 348 HG3 MET 46 HG3 MET 46 -9.981 -22.567 -3.854 349 HE1 MET 46 HE1 MET 46 -10.546 -21.010 -5.854 350 HE2 MET 46 HE2 MET 46 -9.157 -19.957 -5.491 351 HE3 MET 46 HE3 MET 46 -9.406 -20.569 -7.143 352 H ALA 47 H ALA 47 -7.250 -21.176 0.518 353 HA ALA 47 HA ALA 47 -6.002 -23.882 0.437 354 HB1 ALA 47 HB1 ALA 47 -3.972 -22.887 1.362 355 HB2 ALA 47 HB2 ALA 47 -4.391 -22.132 -0.196 356 HB3 ALA 47 HB3 ALA 47 -4.724 -21.276 1.325 357 H LEU 48 H LEU 48 -7.684 -21.425 2.334 358 HA LEU 48 HA LEU 48 -7.315 -22.739 4.897 359 HB2 LEU 48 HB2 LEU 48 -9.398 -20.842 3.742 360 HB3 LEU 48 HB3 LEU 48 -9.475 -21.434 5.409 361 HG LEU 48 HG LEU 48 -7.105 -19.905 4.255 362 HD11 LEU 48 HD11 LEU 48 -9.096 -18.495 4.332 363 HD12 LEU 48 HD12 LEU 48 -9.441 -19.029 5.994 364 HD13 LEU 48 HD13 LEU 48 -8.003 -18.049 5.663 365 HD21 LEU 48 HD21 LEU 48 -6.498 -21.353 6.163 366 HD22 LEU 48 HD22 LEU 48 -6.523 -19.653 6.671 367 HD23 LEU 48 HD23 LEU 48 -7.876 -20.725 7.088 368 H ILE 49 H ILE 49 -9.601 -22.995 2.164 369 HA ILE 49 HA ILE 49 -11.420 -24.814 3.361 370 HB ILE 49 HB ILE 49 -11.928 -25.481 1.024 371 HG12 ILE 49 HG12 ILE 49 -9.911 -23.396 0.235 372 HG13 ILE 49 HG13 ILE 49 -9.411 -25.056 0.360 373 HG21 ILE 49 HG21 ILE 49 -11.673 -22.477 1.490 374 HG22 ILE 49 HG22 ILE 49 -12.754 -23.261 0.323 375 HG23 ILE 49 HG23 ILE 49 -13.004 -23.504 2.061 376 HD11 ILE 49 HD11 ILE 49 -9.956 -24.624 -1.931 377 HD12 ILE 49 HD12 ILE 49 -11.004 -25.853 -1.200 378 HD13 ILE 49 HD13 ILE 49 -11.630 -24.185 -1.472 379 H LYS 50 H LYS 50 -8.183 -25.140 2.150 380 HA LYS 50 HA LYS 50 -8.443 -27.896 1.357 381 HB2 LYS 50 HB2 LYS 50 -6.749 -25.791 0.764 382 HB3 LYS 50 HB3 LYS 50 -5.723 -26.803 1.772 383 HG2 LYS 50 HG2 LYS 50 -5.305 -27.625 -0.343 384 HG3 LYS 50 HG3 LYS 50 -6.561 -28.741 0.184 385 HD2 LYS 50 HD2 LYS 50 -6.950 -26.224 -1.501 386 HD3 LYS 50 HD3 LYS 50 -6.817 -27.853 -2.178 387 HE2 LYS 50 HE2 LYS 50 -8.952 -26.977 -0.202 388 HE3 LYS 50 HE3 LYS 50 -9.158 -26.945 -1.960 389 HZ1 LYS 50 HZ1 LYS 50 -8.564 -29.365 -0.377 390 HZ2 LYS 50 HZ2 LYS 50 -10.033 -28.976 -1.000 391 HZ3 LYS 50 HZ3 LYS 50 -8.772 -29.309 -2.007 392 H LEU 51 H LEU 51 -8.305 -26.459 4.348 393 HA LEU 51 HA LEU 51 -6.804 -28.692 5.631 394 HB2 LEU 51 HB2 LEU 51 -6.897 -25.718 6.254 395 HB3 LEU 51 HB3 LEU 51 -6.291 -26.915 7.407 396 HG LEU 51 HG LEU 51 -5.155 -26.607 4.611 397 HD11 LEU 51 HD11 LEU 51 -4.221 -25.427 7.262 398 HD12 LEU 51 HD12 LEU 51 -3.322 -25.367 5.727 399 HD13 LEU 51 HD13 LEU 51 -4.866 -24.515 5.879 400 HD21 LEU 51 HD21 LEU 51 -4.726 -28.787 5.708 401 HD22 LEU 51 HD22 LEU 51 -3.240 -27.830 5.688 402 HD23 LEU 51 HD23 LEU 51 -4.182 -27.955 7.182 403 H GLY 52 H GLY 52 -9.815 -27.143 5.265 404 HA2 GLY 52 HA2 GLY 52 -11.773 -28.025 6.295 405 HA3 GLY 52 HA3 GLY 52 -10.831 -28.446 7.739 406 H GLU 53 H GLU 53 -9.779 -25.405 6.858 407 HA GLU 53 HA GLU 53 -11.295 -24.156 9.018 408 HB2 GLU 53 HB2 GLU 53 -9.138 -23.055 7.159 409 HB3 GLU 53 HB3 GLU 53 -9.770 -22.263 8.614 410 HG2 GLU 53 HG2 GLU 53 -9.011 -24.160 10.003 411 HG3 GLU 53 HG3 GLU 53 -8.361 -24.977 8.568 412 H TYR 54 H TYR 54 -13.062 -24.890 6.990 413 HA TYR 54 HA TYR 54 -13.554 -23.021 4.948 414 HB2 TYR 54 HB2 TYR 54 -15.499 -24.667 6.611 415 HB3 TYR 54 HB3 TYR 54 -15.907 -23.847 5.101 416 HD1 TYR 54 HD1 TYR 54 -14.870 -24.590 2.950 417 HD2 TYR 54 HD2 TYR 54 -14.420 -26.795 6.608 418 HE1 TYR 54 HE1 TYR 54 -14.218 -26.605 1.655 419 HE2 TYR 54 HE2 TYR 54 -13.770 -28.815 5.330 420 HH TYR 54 HH TYR 54 -13.590 -28.823 1.742 421 H THR 55 H THR 55 -14.335 -22.930 8.426 422 HA THR 55 HA THR 55 -16.252 -20.853 8.379 423 HB THR 55 HB THR 55 -14.150 -21.543 10.467 424 HG1 THR 55 HG1 THR 55 -15.818 -22.818 11.311 425 HG21 THR 55 HG21 THR 55 -16.836 -20.083 10.680 426 HG22 THR 55 HG22 THR 55 -15.828 -20.576 12.060 427 HG23 THR 55 HG23 THR 55 -15.236 -19.352 10.916 428 H GLN 56 H GLN 56 -12.693 -20.784 8.179 429 HA GLN 56 HA GLN 56 -12.605 -17.858 8.441 430 HB2 GLN 56 HB2 GLN 56 -10.548 -20.036 8.060 431 HB3 GLN 56 HB3 GLN 56 -10.162 -18.307 7.969 432 HG2 GLN 56 HG2 GLN 56 -9.714 -19.089 10.178 433 HG3 GLN 56 HG3 GLN 56 -11.068 -17.951 10.224 434 HE21 GLN 56 HE22 GLN 56 -10.254 -21.462 10.206 435 HE22 GLN 56 HE21 GLN 56 -11.655 -21.953 11.137 436 H ALA 57 H ALA 57 -12.951 -20.267 5.911 437 HA ALA 57 HA ALA 57 -11.602 -18.703 3.862 438 HB1 ALA 57 HB1 ALA 57 -13.504 -21.070 3.666 439 HB2 ALA 57 HB2 ALA 57 -12.469 -20.450 2.364 440 HB3 ALA 57 HB3 ALA 57 -11.742 -21.184 3.812 441 H ILE 58 H ILE 58 -15.003 -19.308 4.832 442 HA ILE 58 HA ILE 58 -16.237 -17.878 2.659 443 HB ILE 58 HB ILE 58 -17.141 -18.362 5.548 444 HG12 ILE 58 HG12 ILE 58 -17.715 -20.050 3.079 445 HG13 ILE 58 HG13 ILE 58 -16.475 -20.453 4.276 446 HG21 ILE 58 HG21 ILE 58 -18.852 -18.033 3.060 447 HG22 ILE 58 HG22 ILE 58 -19.407 -18.121 4.740 448 HG23 ILE 58 HG23 ILE 58 -18.502 -16.704 4.192 449 HD11 ILE 58 HD11 ILE 58 -18.237 -20.407 6.060 450 HD12 ILE 58 HD12 ILE 58 -19.464 -20.247 4.768 451 HD13 ILE 58 HD13 ILE 58 -18.452 -21.696 4.862 452 H GLN 59 H GLN 59 -14.969 -16.909 5.876 453 HA GLN 59 HA GLN 59 -16.007 -14.225 5.739 454 HB2 GLN 59 HB2 GLN 59 -13.763 -15.486 7.373 455 HB3 GLN 59 HB3 GLN 59 -14.358 -13.825 7.588 456 HG2 GLN 59 HG2 GLN 59 -16.649 -14.723 7.996 457 HG3 GLN 59 HG3 GLN 59 -16.010 -16.371 7.886 458 HE21 GLN 59 HE22 GLN 59 -15.183 -17.309 9.710 459 HE22 GLN 59 HE21 GLN 59 -14.867 -16.455 11.210 460 H MET 60 H MET 60 -13.565 -15.730 3.923 461 HA MET 60 HA MET 60 -12.220 -13.135 3.401 462 HB2 MET 60 HB2 MET 60 -11.440 -15.989 2.692 463 HB3 MET 60 HB3 MET 60 -10.476 -14.561 2.305 464 HG2 MET 60 HG2 MET 60 -11.228 -15.112 5.180 465 HG3 MET 60 HG3 MET 60 -9.974 -16.076 4.412 466 HE1 MET 60 HE1 MET 60 -9.685 -11.518 5.154 467 HE2 MET 60 HE2 MET 60 -10.576 -12.137 3.764 468 HE3 MET 60 HE3 MET 60 -11.146 -12.527 5.401 469 H CYS 61 H CYS 61 -14.238 -15.716 2.037 470 HA CYS 61 HA CYS 61 -13.869 -14.965 -0.700 471 HB2 CYS 61 HB2 CYS 61 -16.176 -16.360 0.772 472 HB3 CYS 61 HB3 CYS 61 -16.091 -16.187 -0.972 473 HG CYS 61 HG CYS 61 -13.823 -17.551 0.987 474 H GLN 62 H GLN 62 -16.317 -13.964 1.786 475 HA GLN 62 HA GLN 62 -17.711 -12.225 -0.039 476 HB2 GLN 62 HB2 GLN 62 -17.564 -12.180 3.001 477 HB3 GLN 62 HB3 GLN 62 -18.812 -11.413 1.991 478 HG2 GLN 62 HG2 GLN 62 -19.585 -13.585 1.194 479 HG3 GLN 62 HG3 GLN 62 -18.269 -14.402 2.042 480 HE21 GLN 62 HE22 GLN 62 -19.812 -15.672 3.105 481 HE22 GLN 62 HE21 GLN 62 -20.769 -15.020 4.400 482 H GLN 63 H GLN 63 -14.631 -11.903 1.500 483 HA GLN 63 HA GLN 63 -14.812 -8.959 1.628 484 HB2 GLN 63 HB2 GLN 63 -12.602 -10.956 2.258 485 HB3 GLN 63 HB3 GLN 63 -12.433 -9.203 2.452 486 HG2 GLN 63 HG2 GLN 63 -14.603 -10.809 3.867 487 HG3 GLN 63 HG3 GLN 63 -12.990 -10.555 4.539 488 HE21 GLN 63 HE22 GLN 63 -14.056 -9.507 6.335 489 HE22 GLN 63 HE21 GLN 63 -14.521 -7.821 6.190 490 H GLY 64 H GLY 64 -13.486 -11.543 -0.444 491 HA2 GLY 64 HA2 GLY 64 -11.776 -9.693 -1.922 492 HA3 GLY 64 HA3 GLY 64 -12.142 -11.373 -2.330 493 H LEU 65 H LEU 65 -15.066 -11.001 -2.186 494 HA LEU 65 HA LEU 65 -15.588 -10.196 -4.877 495 HB2 LEU 65 HB2 LEU 65 -17.274 -10.749 -2.408 496 HB3 LEU 65 HB3 LEU 65 -18.016 -10.287 -3.944 497 HG LEU 65 HG LEU 65 -16.112 -12.664 -3.703 498 HD11 LEU 65 HD11 LEU 65 -19.158 -12.579 -3.639 499 HD12 LEU 65 HD12 LEU 65 -18.148 -14.041 -3.700 500 HD13 LEU 65 HD13 LEU 65 -18.106 -12.994 -2.268 501 HD21 LEU 65 HD21 LEU 65 -16.389 -11.743 -5.974 502 HD22 LEU 65 HD22 LEU 65 -17.177 -13.324 -5.812 503 HD23 LEU 65 HD23 LEU 65 -18.154 -11.838 -5.803 504 H ARG 66 H ARG 66 -14.912 -8.276 -2.157 505 HA ARG 66 HA ARG 66 -16.544 -5.970 -2.946 506 HB2 ARG 66 HB2 ARG 66 -14.212 -6.221 -0.995 507 HB3 ARG 66 HB3 ARG 66 -15.359 -4.882 -1.106 508 HG2 ARG 66 HG2 ARG 66 -17.197 -6.388 -0.408 509 HG3 ARG 66 HG3 ARG 66 -16.079 -7.760 -0.380 510 HD2 ARG 66 HD2 ARG 66 -16.391 -6.929 1.886 511 HD3 ARG 66 HD3 ARG 66 -14.728 -6.623 1.359 512 HE ARG 66 HE ARG 66 -16.430 -4.357 0.809 513 HH11 ARG 66 HH11 ARG 66 -14.727 -6.017 3.423 514 HH12 ARG 66 HH12 ARG 66 -14.555 -4.561 4.383 515 HH21 ARG 66 HH21 ARG 66 -16.187 -2.478 2.087 516 HH22 ARG 66 HH22 ARG 66 -15.377 -2.571 3.634 517 H TYR 67 H TYR 67 -13.920 -7.435 -4.327 518 HA TYR 67 HA TYR 67 -12.590 -4.887 -5.119 519 HB2 TYR 67 HB2 TYR 67 -11.280 -7.413 -4.094 520 HB3 TYR 67 HB3 TYR 67 -10.408 -6.018 -4.706 521 HD1 TYR 67 HD2 TYR 67 -11.353 -3.684 -3.538 522 HD2 TYR 67 HD1 TYR 67 -11.313 -7.616 -1.801 523 HE1 TYR 67 HE2 TYR 67 -11.482 -2.681 -1.274 524 HE2 TYR 67 HE1 TYR 67 -11.443 -6.628 0.466 525 HH TYR 67 HH TYR 67 -11.540 -4.702 1.698 526 H THR 68 H THR 68 -14.243 -7.568 -6.160 527 HA THR 68 HA THR 68 -12.632 -7.959 -8.609 528 HB THR 68 HB THR 68 -14.368 -9.702 -9.077 529 HG1 THR 68 HG1 THR 68 -15.731 -10.205 -7.281 530 HG21 THR 68 HG21 THR 68 -13.585 -11.288 -7.440 531 HG22 THR 68 HG22 THR 68 -12.241 -10.208 -7.861 532 HG23 THR 68 HG23 THR 68 -13.120 -9.983 -6.332 533 H SER 69 H SER 69 -14.963 -5.807 -7.537 534 HA SER 69 HA SER 69 -16.848 -5.829 -9.688 535 HB2 SER 69 HB2 SER 69 -16.075 -3.700 -7.663 536 HB3 SER 69 HB3 SER 69 -17.494 -3.612 -8.731 537 HG SER 69 HG SER 69 -17.960 -4.508 -6.649 538 H THR 70 H THR 70 -13.588 -4.919 -9.788 539 HA THR 70 HA THR 70 -13.884 -2.605 -11.531 540 HB THR 70 HB THR 70 -11.472 -2.742 -11.746 541 HG1 THR 70 HG1 THR 70 -10.378 -4.510 -10.878 542 HG21 THR 70 HG21 THR 70 -12.309 -3.475 -8.901 543 HG22 THR 70 HG22 THR 70 -10.804 -2.649 -9.388 544 HG23 THR 70 HG23 THR 70 -12.383 -1.844 -9.613 545 H ALA 71 H ALA 71 -14.531 -5.815 -12.000 546 HA ALA 71 HA ALA 71 -14.872 -7.151 -13.759 547 HB1 ALA 71 HB1 ALA 71 -14.187 -4.796 -15.553 548 HB2 ALA 71 HB2 ALA 71 -15.074 -6.262 -15.997 549 HB3 ALA 71 HB3 ALA 71 -15.797 -5.111 -14.848 550 H GLU 72 H GLU 72 -11.861 -5.863 -13.010 551 HA GLU 72 HA GLU 72 -10.366 -7.226 -15.094 552 HB2 GLU 72 HB2 GLU 72 -9.514 -6.067 -12.437 553 HB3 GLU 72 HB3 GLU 72 -8.406 -6.650 -13.679 554 HG2 GLU 72 HG2 GLU 72 -10.360 -4.330 -13.968 555 HG3 GLU 72 HG3 GLU 72 -8.616 -4.203 -13.727 556 H HIS 73 H HIS 73 -12.245 -8.443 -12.744 557 HA HIS 73 HA HIS 73 -10.503 -10.783 -12.209 558 HB2 HIS 73 HB2 HIS 73 -12.137 -9.415 -10.058 559 HB3 HIS 73 HB3 HIS 73 -10.920 -10.657 -9.838 560 HD2 HIS 73 HD2 HIS 73 -11.422 -6.925 -10.034 561 HE1 HIS 73 HE1 HIS 73 -7.233 -7.460 -9.670 562 HE2 HIS 73 HE2 HIS 73 -9.123 -5.767 -9.602 563 H VAL 74 H VAL 74 -12.868 -10.297 -13.961 564 HA VAL 74 HA VAL 74 -15.310 -11.025 -12.869 565 HB VAL 74 HB VAL 74 -14.857 -10.191 -15.160 566 HG11 VAL 74 HG11 VAL 74 -14.118 -13.070 -15.785 567 HG12 VAL 74 HG12 VAL 74 -14.279 -11.749 -16.957 568 HG13 VAL 74 HG13 VAL 74 -12.980 -11.696 -15.745 569 HG21 VAL 74 HG21 VAL 74 -17.057 -11.176 -14.543 570 HG22 VAL 74 HG22 VAL 74 -16.653 -11.428 -16.253 571 HG23 VAL 74 HG23 VAL 74 -16.478 -12.764 -15.100 572 H ALA 75 H ALA 75 -12.560 -13.146 -13.558 573 HA ALA 75 HA ALA 75 -14.107 -15.600 -13.286 574 HB1 ALA 75 HB1 ALA 75 -11.874 -16.660 -13.160 575 HB2 ALA 75 HB2 ALA 75 -11.972 -15.510 -14.519 576 HB3 ALA 75 HB3 ALA 75 -11.117 -15.055 -13.027 577 H ILE 76 H ILE 76 -11.899 -13.742 -11.089 578 HA ILE 76 HA ILE 76 -12.205 -15.506 -8.866 579 HB ILE 76 HB ILE 76 -11.583 -12.525 -8.976 580 HG12 ILE 76 HG12 ILE 76 -9.760 -14.964 -8.889 581 HG13 ILE 76 HG13 ILE 76 -9.973 -13.871 -10.253 582 HG21 ILE 76 HG21 ILE 76 -12.310 -13.237 -6.719 583 HG22 ILE 76 HG22 ILE 76 -11.091 -14.546 -6.761 584 HG23 ILE 76 HG23 ILE 76 -10.593 -12.846 -6.732 585 HD11 ILE 76 HD11 ILE 76 -9.099 -11.986 -8.874 586 HD12 ILE 76 HD12 ILE 76 -8.717 -13.162 -7.586 587 HD13 ILE 76 HD13 ILE 76 -7.922 -13.287 -9.162 588 H ARG 77 H ARG 77 -14.193 -12.876 -10.161 589 HA ARG 77 HA ARG 77 -15.817 -12.379 -7.899 590 HB2 ARG 77 HB2 ARG 77 -15.630 -11.056 -10.042 591 HB3 ARG 77 HB3 ARG 77 -16.628 -12.290 -10.828 592 HG2 ARG 77 HG2 ARG 77 -18.473 -11.813 -9.252 593 HG3 ARG 77 HG3 ARG 77 -17.439 -10.643 -8.395 594 HD2 ARG 77 HD2 ARG 77 -17.181 -9.379 -10.545 595 HD3 ARG 77 HD3 ARG 77 -18.306 -10.520 -11.303 596 HE ARG 77 HE ARG 77 -20.091 -9.436 -10.275 597 HH11 ARG 77 HH11 ARG 77 -17.095 -8.440 -8.648 598 HH12 ARG 77 HH12 ARG 77 -17.870 -7.143 -7.783 599 HH21 ARG 77 HH21 ARG 77 -21.066 -7.753 -9.085 600 HH22 ARG 77 HH22 ARG 77 -20.108 -6.787 -8.000 601 H SER 78 H SER 78 -15.763 -15.044 -10.159 602 HA SER 78 HA SER 78 -18.331 -16.109 -9.065 603 HB2 SER 78 HB2 SER 78 -17.850 -16.116 -11.543 604 HB3 SER 78 HB3 SER 78 -16.477 -17.213 -11.224 605 HG SER 78 HG SER 78 -18.424 -18.319 -11.792 606 H LYS 79 H LYS 79 -14.779 -16.560 -8.814 607 HA LYS 79 HA LYS 79 -15.065 -19.248 -7.803 608 HB2 LYS 79 HB2 LYS 79 -12.774 -17.242 -7.669 609 HB3 LYS 79 HB3 LYS 79 -12.674 -18.883 -7.068 610 HG2 LYS 79 HG2 LYS 79 -13.058 -18.018 -9.947 611 HG3 LYS 79 HG3 LYS 79 -11.689 -18.869 -9.243 612 HD2 LYS 79 HD2 LYS 79 -14.467 -19.931 -9.838 613 HD3 LYS 79 HD3 LYS 79 -12.905 -20.502 -10.448 614 HE2 LYS 79 HE2 LYS 79 -12.338 -21.097 -8.002 615 HE3 LYS 79 HE3 LYS 79 -14.063 -20.804 -7.655 616 HZ1 LYS 79 HZ1 LYS 79 -13.606 -23.123 -8.130 617 HZ2 LYS 79 HZ2 LYS 79 -14.616 -22.483 -9.263 618 HZ3 LYS 79 HZ3 LYS 79 -13.032 -22.742 -9.623 619 H LEU 80 H LEU 80 -14.913 -15.981 -6.269 620 HA LEU 80 HA LEU 80 -14.797 -17.151 -3.595 621 HB2 LEU 80 HB2 LEU 80 -15.090 -14.386 -4.800 622 HB3 LEU 80 HB3 LEU 80 -15.373 -14.651 -3.075 623 HG LEU 80 HG LEU 80 -13.148 -15.436 -2.704 624 HD11 LEU 80 HD11 LEU 80 -12.793 -15.318 -5.714 625 HD12 LEU 80 HD12 LEU 80 -11.459 -15.473 -4.561 626 HD13 LEU 80 HD13 LEU 80 -12.673 -16.753 -4.670 627 HD21 LEU 80 HD21 LEU 80 -13.460 -13.022 -2.776 628 HD22 LEU 80 HD22 LEU 80 -11.861 -13.434 -3.430 629 HD23 LEU 80 HD23 LEU 80 -13.182 -13.002 -4.531 630 H GLN 81 H GLN 81 -17.125 -17.229 -5.900 631 HA GLN 81 HA GLN 81 -19.324 -17.067 -3.897 632 HB2 GLN 81 HB2 GLN 81 -19.039 -16.502 -6.829 633 HB3 GLN 81 HB3 GLN 81 -20.506 -17.317 -6.365 634 HG2 GLN 81 HG2 GLN 81 -19.541 -14.617 -5.411 635 HG3 GLN 81 HG3 GLN 81 -21.034 -15.002 -6.279 636 HE21 GLN 81 HE22 GLN 81 -21.905 -17.286 -4.720 637 HE22 GLN 81 HE21 GLN 81 -22.252 -16.720 -3.092 638 H TYR 82 H TYR 82 -17.729 -19.009 -6.439 639 HA TYR 82 HA TYR 82 -19.489 -21.256 -6.358 640 HB2 TYR 82 HB2 TYR 82 -17.836 -20.860 -8.166 641 HB3 TYR 82 HB3 TYR 82 -16.533 -20.828 -6.999 642 HD1 TYR 82 HD1 TYR 82 -18.985 -23.032 -8.699 643 HD2 TYR 82 HD2 TYR 82 -15.500 -22.828 -6.196 644 HE1 TYR 82 HE1 TYR 82 -18.625 -25.470 -9.008 645 HE2 TYR 82 HE2 TYR 82 -15.126 -25.263 -6.495 646 HH TYR 82 HH TYR 82 -17.311 -27.284 -8.517 647 H ARG 83 H ARG 83 -16.361 -20.585 -4.581 648 HA ARG 83 HA ARG 83 -16.677 -23.160 -3.271 649 HB2 ARG 83 HB2 ARG 83 -14.459 -22.063 -3.867 650 HB3 ARG 83 HB3 ARG 83 -14.736 -20.937 -2.528 651 HG2 ARG 83 HG2 ARG 83 -13.295 -22.831 -1.865 652 HG3 ARG 83 HG3 ARG 83 -14.811 -22.847 -0.944 653 HD2 ARG 83 HD2 ARG 83 -15.723 -24.586 -2.444 654 HD3 ARG 83 HD3 ARG 83 -14.249 -24.504 -3.440 655 HE ARG 83 HE ARG 83 -13.557 -25.097 -0.735 656 HH11 ARG 83 HH11 ARG 83 -15.149 -26.559 -3.538 657 HH12 ARG 83 HH12 ARG 83 -14.692 -28.185 -3.101 658 HH21 ARG 83 HH21 ARG 83 -12.958 -27.257 -0.205 659 HH22 ARG 83 HH22 ARG 83 -13.485 -28.573 -1.217 660 H LEU 84 H LEU 84 -17.555 -19.838 -2.578 661 HA LEU 84 HA LEU 84 -18.169 -20.156 0.207 662 HB2 LEU 84 HB2 LEU 84 -17.925 -18.057 -1.212 663 HB3 LEU 84 HB3 LEU 84 -19.519 -18.371 -1.872 664 HG LEU 84 HG LEU 84 -18.850 -17.893 1.038 665 HD11 LEU 84 HD11 LEU 84 -18.499 -15.912 -0.332 666 HD12 LEU 84 HD12 LEU 84 -20.121 -16.097 -1.047 667 HD13 LEU 84 HD13 LEU 84 -19.932 -15.708 0.682 668 HD21 LEU 84 HD21 LEU 84 -20.879 -19.163 1.035 669 HD22 LEU 84 HD22 LEU 84 -21.335 -17.478 1.264 670 HD23 LEU 84 HD23 LEU 84 -21.532 -18.229 -0.339 671 H GLU 85 H GLU 85 -19.897 -20.691 -2.851 672 HA GLU 85 HA GLU 85 -22.411 -21.532 -1.790 673 HB2 GLU 85 HB2 GLU 85 -20.984 -21.567 -4.433 674 HB3 GLU 85 HB3 GLU 85 -22.426 -22.542 -4.275 675 HG2 GLU 85 HG2 GLU 85 -23.756 -20.635 -3.582 676 HG3 GLU 85 HG3 GLU 85 -22.324 -19.617 -3.447 677 H LEU 86 H LEU 86 -19.437 -23.155 -1.564 678 HA LEU 86 HA LEU 86 -20.925 -25.712 -1.136 679 HB2 LEU 86 HB2 LEU 86 -18.202 -25.243 -2.388 680 HB3 LEU 86 HB3 LEU 86 -18.572 -26.737 -1.541 681 HG LEU 86 HG LEU 86 -18.893 -27.224 -3.789 682 HD11 LEU 86 HD11 LEU 86 -21.690 -26.678 -2.739 683 HD12 LEU 86 HD12 LEU 86 -21.215 -27.873 -3.948 684 HD13 LEU 86 HD13 LEU 86 -20.679 -28.065 -2.265 685 HD21 LEU 86 HD21 LEU 86 -19.012 -24.985 -4.718 686 HD22 LEU 86 HD22 LEU 86 -20.340 -25.998 -5.319 687 HD23 LEU 86 HD23 LEU 86 -20.657 -24.778 -4.071 688 H ALA 87 H ALA 87 -18.853 -23.239 0.177 689 HA ALA 87 HA ALA 87 -17.733 -24.791 2.315 690 HB1 ALA 87 HB1 ALA 87 -16.888 -22.571 1.592 691 HB2 ALA 87 HB2 ALA 87 -18.391 -21.815 2.165 692 HB3 ALA 87 HB3 ALA 87 -17.284 -22.602 3.321 693 H GLN 88 H GLN 88 -20.838 -23.166 1.774 694 HA GLN 88 HA GLN 88 -21.800 -23.392 4.475 695 HB2 GLN 88 HB2 GLN 88 -23.153 -23.024 1.772 696 HB3 GLN 88 HB3 GLN 88 -24.003 -22.931 3.320 697 HG2 GLN 88 HG2 GLN 88 -21.654 -21.159 2.552 698 HG3 GLN 88 HG3 GLN 88 -23.344 -20.700 2.383 699 HE21 GLN 88 HE22 GLN 88 -21.795 -19.057 3.862 700 HE22 GLN 88 HE21 GLN 88 -22.163 -19.226 5.566 701 H GLY 89 H GLY 89 -20.831 -25.809 2.573 702 HA2 GLY 89 HA2 GLY 89 -22.848 -27.708 3.651 703 HA3 GLY 89 HA3 GLY 89 -22.325 -27.790 1.946 704 H ALA 90 H ALA 90 -19.943 -26.725 4.238 705 HA ALA 90 HA ALA 90 -18.916 -29.431 4.775 706 HB1 ALA 90 HB1 ALA 90 -17.323 -27.334 3.249 707 HB2 ALA 90 HB2 ALA 90 -16.707 -28.902 3.824 708 HB3 ALA 90 HB3 ALA 90 -17.967 -28.848 2.570 709 H VAL 91 H VAL 91 -19.371 -26.152 5.651 710 HA VAL 91 HA VAL 91 -17.120 -25.781 7.370 711 HB VAL 91 HB VAL 91 -18.595 -24.049 6.365 712 HG11 VAL 91 HG11 VAL 91 -20.541 -24.810 8.574 713 HG12 VAL 91 HG12 VAL 91 -20.691 -23.431 7.468 714 HG13 VAL 91 HG13 VAL 91 -20.791 -25.084 6.833 715 HG21 VAL 91 HG21 VAL 91 -17.056 -23.530 8.220 716 HG22 VAL 91 HG22 VAL 91 -18.500 -22.500 8.228 717 HG23 VAL 91 HG23 VAL 91 -18.369 -23.843 9.381 718 H GLY 92 H GLY 92 -19.950 -27.686 7.719 719 HA2 GLY 92 HA2 GLY 92 -19.218 -28.299 10.520 720 HA3 GLY 92 HA3 GLY 92 -20.847 -27.647 10.245 721 H SER 93 H SER 93 -19.711 -29.547 7.604 722 HA SER 93 HA SER 93 -21.690 -31.579 8.001 723 HB2 SER 93 HB2 SER 93 -19.301 -31.439 6.122 724 HB3 SER 93 HB3 SER 93 -20.667 -32.580 5.995 725 HG SER 93 HG SER 93 -20.958 -30.702 4.688 726 H VAL 94 H VAL 94 -20.847 -33.979 7.579 727 HA VAL 94 HA VAL 94 -18.790 -34.605 9.625 728 HB VAL 94 HB VAL 94 -21.419 -36.062 9.391 729 HG11 VAL 94 HG11 VAL 94 -19.201 -36.015 11.487 730 HG12 VAL 94 HG12 VAL 94 -20.727 -36.928 11.625 731 HG13 VAL 94 HG13 VAL 94 -19.540 -37.351 10.374 732 HG21 VAL 94 HG21 VAL 94 -21.876 -33.780 10.163 733 HG22 VAL 94 HG22 VAL 94 -22.011 -34.910 11.521 734 HG23 VAL 94 HG23 VAL 94 -20.557 -33.899 11.355 735 H GLN 95 H GLN 95 -18.083 -34.426 7.132 736 HA GLN 95 HA GLN 95 -18.388 -36.733 5.493 737 HB2 GLN 95 HB2 GLN 95 -16.504 -35.822 4.233 738 HB3 GLN 95 HB3 GLN 95 -17.670 -34.545 4.644 739 HG2 GLN 95 HG2 GLN 95 -15.276 -34.982 6.420 740 HG3 GLN 95 HG3 GLN 95 -15.123 -34.074 4.906 741 HE21 GLN 95 HE22 GLN 95 -16.011 -33.861 8.204 742 HE22 GLN 95 HE21 GLN 95 -16.856 -32.329 8.118 743 H ILE 96 H ILE 96 -16.907 -36.583 8.481 744 HA ILE 96 HA ILE 96 -15.462 -39.107 7.969 745 HB ILE 96 HB ILE 96 -13.579 -38.280 9.427 746 HG12 ILE 96 HG12 ILE 96 -14.785 -35.540 8.890 747 HG13 ILE 96 HG13 ILE 96 -14.788 -36.381 10.449 748 HG21 ILE 96 HG21 ILE 96 -13.448 -38.432 6.938 749 HG22 ILE 96 HG22 ILE 96 -13.908 -36.718 6.841 750 HG23 ILE 96 HG23 ILE 96 -12.388 -37.184 7.630 751 HD11 ILE 96 HD11 ILE 96 -12.332 -35.445 8.907 752 HD12 ILE 96 HD12 ILE 96 -12.979 -34.753 10.404 753 HD13 ILE 96 HD13 ILE 96 -12.288 -36.392 10.415 754 HA PRO 97 HA PRO 97 -17.546 -40.146 11.682 755 HB2 PRO 97 HB2 PRO 97 -15.941 -42.060 12.804 756 HB3 PRO 97 HB3 PRO 97 -16.866 -42.322 11.289 757 HG2 PRO 97 HG2 PRO 97 -13.955 -41.521 11.586 758 HG3 PRO 97 HG3 PRO 97 -14.647 -42.808 10.542 759 HD2 PRO 97 HD2 PRO 97 -14.051 -40.330 9.579 760 HD3 PRO 97 HD3 PRO 97 -15.491 -41.229 9.008 761 H VAL 98 H VAL 98 -17.576 -39.942 13.933 762 HA VAL 98 HA VAL 98 -15.257 -38.725 15.281 763 HB VAL 98 HB VAL 98 -16.644 -36.851 16.137 764 HG11 VAL 98 HG11 VAL 98 -16.553 -36.893 13.093 765 HG12 VAL 98 HG12 VAL 98 -16.612 -35.462 14.141 766 HG13 VAL 98 HG13 VAL 98 -15.177 -36.510 14.157 767 HG21 VAL 98 HG21 VAL 98 -18.768 -36.288 15.038 768 HG22 VAL 98 HG22 VAL 98 -18.683 -37.767 14.061 769 HG23 VAL 98 HG23 VAL 98 -18.879 -37.872 15.825 770 H VAL 99 H VAL 99 -17.431 -41.094 15.275 771 HA VAL 99 HA VAL 99 -18.763 -40.879 17.801 772 HB VAL 99 HB VAL 99 -18.137 -43.307 16.104 773 HG11 VAL 99 HG11 VAL 99 -20.219 -42.842 18.279 774 HG12 VAL 99 HG12 VAL 99 -20.184 -44.246 17.188 775 HG13 VAL 99 HG13 VAL 99 -18.868 -43.992 18.339 776 HG21 VAL 99 HG21 VAL 99 -19.379 -41.594 14.834 777 HG22 VAL 99 HG22 VAL 99 -20.435 -42.965 15.215 778 HG23 VAL 99 HG23 VAL 99 -20.561 -41.456 16.158 779 H GLU 100 H GLU 100 -15.478 -41.638 16.989 780 HA GLU 100 HA GLU 100 -14.853 -43.491 19.036 781 HB2 GLU 100 HB2 GLU 100 -12.534 -42.787 18.669 782 HB3 GLU 100 HB3 GLU 100 -13.387 -43.018 17.134 783 HG2 GLU 100 HG2 GLU 100 -13.748 -40.562 16.967 784 HG3 GLU 100 HG3 GLU 100 -12.879 -40.339 18.497 785 H VAL 101 H VAL 101 -13.739 -43.192 21.054 786 HA VAL 101 HA VAL 101 -13.894 -40.555 22.317 787 HB VAL 101 HB VAL 101 -16.095 -41.817 22.454 788 HG11 VAL 101 HG11 VAL 101 -14.574 -43.524 24.460 789 HG12 VAL 101 HG12 VAL 101 -16.320 -43.575 24.128 790 HG13 VAL 101 HG13 VAL 101 -15.170 -44.068 22.868 791 HG21 VAL 101 HG21 VAL 101 -15.471 -39.947 23.980 792 HG22 VAL 101 HG22 VAL 101 -16.527 -41.142 24.755 793 HG23 VAL 101 HG23 VAL 101 -14.793 -41.125 25.120 794 H ASP 102 H ASP 102 -12.957 -40.663 24.576 795 HA ASP 102 HA ASP 102 -11.187 -42.947 25.138 796 HB2 ASP 102 HB2 ASP 102 -9.954 -41.368 23.627 797 HB3 ASP 102 HB3 ASP 102 -10.179 -40.102 24.841 798 H GLU 103 H GLU 103 -10.167 -42.673 27.341 799 HA GLU 103 HA GLU 103 -11.748 -40.911 29.140 800 HB2 GLU 103 HB2 GLU 103 -11.377 -43.893 29.495 801 HB3 GLU 103 HB3 GLU 103 -12.122 -42.810 30.661 802 HG2 GLU 103 HG2 GLU 103 -13.195 -43.343 27.859 803 HG3 GLU 103 HG3 GLU 103 -13.795 -44.059 29.360 804 H LEU 104 H LEU 104 -10.885 -41.697 31.503 805 HA LEU 104 HA LEU 104 -8.209 -40.619 31.632 806 HB2 LEU 104 HB2 LEU 104 -9.741 -41.966 33.867 807 HB3 LEU 104 HB3 LEU 104 -8.532 -40.706 34.012 808 HG LEU 104 HG LEU 104 -11.286 -40.349 32.809 809 HD11 LEU 104 HD11 LEU 104 -11.256 -40.572 35.265 810 HD12 LEU 104 HD12 LEU 104 -10.031 -39.285 35.366 811 HD13 LEU 104 HD13 LEU 104 -11.662 -38.911 34.770 812 HD21 LEU 104 HD21 LEU 104 -9.640 -38.901 31.677 813 HD22 LEU 104 HD22 LEU 104 -10.688 -37.943 32.741 814 HD23 LEU 104 HD23 LEU 104 -9.038 -38.345 33.268 815 HA PRO 105 HA PRO 105 -5.905 -44.351 31.646 816 HB2 PRO 105 HB2 PRO 105 -3.757 -43.848 33.220 817 HB3 PRO 105 HB3 PRO 105 -4.102 -42.870 31.757 818 HG2 PRO 105 HG2 PRO 105 -4.750 -42.204 34.633 819 HG3 PRO 105 HG3 PRO 105 -4.001 -41.152 33.392 820 HD2 PRO 105 HD2 PRO 105 -6.681 -41.164 34.026 821 HD3 PRO 105 HD3 PRO 105 -6.097 -40.704 32.409 822 H GLU 106 H GLU 106 -7.993 -43.898 34.033 823 HA GLU 106 HA GLU 106 -8.681 -44.963 35.888 824 HB2 GLU 106 HB2 GLU 106 -8.628 -46.769 34.088 825 HB3 GLU 106 HB3 GLU 106 -7.178 -47.393 34.882 826 HG2 GLU 106 HG2 GLU 106 -8.478 -47.677 36.987 827 HG3 GLU 106 HG3 GLU 106 -9.898 -46.985 36.203 828 H GLY 107 H GLY 107 -6.077 -43.549 35.988 829 HA2 GLY 107 HA2 GLY 107 -5.206 -44.578 38.610 830 HA3 GLY 107 HA3 GLY 107 -3.975 -44.447 37.330 831 H TYR 108 H TYR 108 -6.575 -42.172 37.174 832 HA TYR 108 HA TYR 108 -4.861 -39.906 37.510 833 HB2 TYR 108 HB2 TYR 108 -6.824 -38.620 37.102 834 HB3 TYR 108 HB3 TYR 108 -6.819 -40.012 36.017 835 HD1 TYR 108 HD2 TYR 108 -8.321 -42.012 36.585 836 HD2 TYR 108 HD1 TYR 108 -8.570 -38.226 38.567 837 HE1 TYR 108 HE2 TYR 108 -10.604 -42.590 37.392 838 HE2 TYR 108 HE1 TYR 108 -10.847 -38.771 39.384 839 HH TYR 108 HH TYR 108 -12.536 -40.341 39.408 840 H ASP 109 H ASP 109 -6.179 -38.032 39.017 841 HA ASP 109 HA ASP 109 -6.094 -39.179 41.757 842 HB2 ASP 109 HB2 ASP 109 -3.825 -38.460 40.946 843 HB3 ASP 109 HB3 ASP 109 -4.437 -36.809 40.831 844 H ARG 110 H ARG 110 -8.450 -38.243 40.400 845 HA ARG 110 HA ARG 110 -9.175 -36.128 42.324 846 HB2 ARG 110 HB2 ARG 110 -10.279 -34.755 40.824 847 HB3 ARG 110 HB3 ARG 110 -8.582 -34.896 40.369 848 HG2 ARG 110 HG2 ARG 110 -9.074 -36.240 38.482 849 HG3 ARG 110 HG3 ARG 110 -10.739 -36.590 39.040 850 HD2 ARG 110 HD2 ARG 110 -9.746 -33.782 38.665 851 HD3 ARG 110 HD3 ARG 110 -10.393 -34.703 37.266 852 HE ARG 110 HE ARG 110 -12.251 -34.897 39.404 853 HH11 ARG 110 HH11 ARG 110 -11.001 -32.417 37.205 854 HH12 ARG 110 HH12 ARG 110 -12.464 -31.462 37.288 855 HH21 ARG 110 HH21 ARG 110 -14.089 -33.662 39.501 856 HH22 ARG 110 HH22 ARG 110 -14.225 -32.162 38.595 857 H SER 111 H SER 111 -11.743 -35.648 41.575 858 HA SER 111 HA SER 111 -13.169 -38.205 41.318 859 HB2 SER 111 HB2 SER 111 -14.468 -37.787 43.393 860 HB3 SER 111 HB3 SER 111 -12.744 -38.087 43.720 861 HG SER 111 HG SER 111 -13.578 -36.268 44.875 Start of MODEL 3 1 H1 SER 2 H1 SER 2 5.082 -2.976 -2.223 2 H2 SER 2 H2 SER 2 3.737 -3.377 -3.075 3 H3 SER 2 H3 SER 2 4.521 -1.966 -3.393 4 HA SER 2 HA SER 2 4.954 -3.573 -5.084 5 HB2 SER 2 HB2 SER 2 7.369 -2.983 -3.321 6 HB3 SER 2 HB3 SER 2 7.401 -3.423 -5.044 7 HG SER 2 HG SER 2 7.494 -1.161 -4.732 8 H GLN 3 H GLN 3 6.455 -5.474 -5.580 9 HA GLN 3 HA GLN 3 6.739 -7.701 -5.507 10 HB2 GLN 3 HB2 GLN 3 7.382 -7.188 -2.577 11 HB3 GLN 3 HB3 GLN 3 7.905 -8.572 -3.545 12 HG2 GLN 3 HG2 GLN 3 8.675 -5.666 -4.014 13 HG3 GLN 3 HG3 GLN 3 9.707 -6.924 -3.325 14 HE21 GLN 3 HE22 GLN 3 10.208 -5.297 -5.723 15 HE22 GLN 3 HE21 GLN 3 10.346 -6.426 -7.058 16 H PHE 4 H PHE 4 3.963 -6.649 -4.720 17 HA PHE 4 HA PHE 4 2.749 -8.324 -2.823 18 HB2 PHE 4 HB2 PHE 4 1.688 -6.385 -3.828 19 HB3 PHE 4 HB3 PHE 4 1.759 -7.095 -5.418 20 HD1 PHE 4 HD2 PHE 4 0.415 -9.344 -5.785 21 HD2 PHE 4 HD1 PHE 4 -0.279 -6.562 -2.582 22 HE1 PHE 4 HE2 PHE 4 -1.863 -10.275 -5.477 23 HE2 PHE 4 HE1 PHE 4 -2.575 -7.466 -2.303 24 HZ PHE 4 HZ PHE 4 -3.371 -9.324 -3.735 25 H GLU 5 H GLU 5 3.228 -8.840 -6.359 26 HA GLU 5 HA GLU 5 1.887 -11.414 -6.273 27 HB2 GLU 5 HB2 GLU 5 3.603 -10.077 -8.395 28 HB3 GLU 5 HB3 GLU 5 2.714 -11.596 -8.624 29 HG2 GLU 5 HG2 GLU 5 0.594 -10.434 -8.074 30 HG3 GLU 5 HG3 GLU 5 1.473 -8.906 -7.903 31 H LYS 6 H LYS 6 5.171 -10.397 -5.615 32 HA LYS 6 HA LYS 6 6.505 -12.800 -6.465 33 HB2 LYS 6 HB2 LYS 6 7.613 -10.660 -6.187 34 HB3 LYS 6 HB3 LYS 6 7.345 -10.758 -4.437 35 HG2 LYS 6 HG2 LYS 6 8.735 -12.710 -4.233 36 HG3 LYS 6 HG3 LYS 6 8.742 -12.962 -5.994 37 HD2 LYS 6 HD2 LYS 6 9.945 -10.869 -6.327 38 HD3 LYS 6 HD3 LYS 6 9.939 -10.552 -4.575 39 HE2 LYS 6 HE2 LYS 6 11.229 -12.651 -4.219 40 HE3 LYS 6 HE3 LYS 6 11.247 -12.930 -5.968 41 HZ1 LYS 6 HZ1 LYS 6 13.275 -11.884 -5.227 42 HZ2 LYS 6 HZ2 LYS 6 12.453 -10.867 -6.220 43 HZ3 LYS 6 HZ3 LYS 6 12.451 -10.615 -4.595 44 H GLN 7 H GLN 7 5.544 -11.648 -3.150 45 HA GLN 7 HA GLN 7 6.395 -14.041 -1.888 46 HB2 GLN 7 HB2 GLN 7 5.479 -11.538 -1.109 47 HB3 GLN 7 HB3 GLN 7 4.141 -12.588 -0.630 48 HG2 GLN 7 HG2 GLN 7 7.069 -12.919 0.123 49 HG3 GLN 7 HG3 GLN 7 5.770 -12.365 1.193 50 HE21 GLN 7 HE22 GLN 7 3.808 -14.011 1.314 51 HE22 GLN 7 HE21 GLN 7 4.282 -15.683 1.469 52 H LYS 8 H LYS 8 3.362 -13.093 -3.438 53 HA LYS 8 HA LYS 8 1.730 -15.208 -2.334 54 HB2 LYS 8 HB2 LYS 8 0.997 -12.972 -3.254 55 HB3 LYS 8 HB3 LYS 8 1.424 -13.551 -4.841 56 HG2 LYS 8 HG2 LYS 8 -0.248 -15.517 -4.343 57 HG3 LYS 8 HG3 LYS 8 -0.811 -14.493 -3.022 58 HD2 LYS 8 HD2 LYS 8 -2.219 -13.979 -4.900 59 HD3 LYS 8 HD3 LYS 8 -1.068 -12.623 -4.798 60 HE2 LYS 8 HE2 LYS 8 0.347 -13.567 -6.517 61 HE3 LYS 8 HE3 LYS 8 -0.526 -15.105 -6.480 62 HZ1 LYS 8 HZ1 LYS 8 -1.163 -13.766 -8.358 63 HZ2 LYS 8 HZ2 LYS 8 -2.450 -13.963 -7.351 64 HZ3 LYS 8 HZ3 LYS 8 -1.638 -12.529 -7.387 65 H GLU 9 H GLU 9 3.672 -14.840 -5.377 66 HA GLU 9 HA GLU 9 2.690 -17.340 -6.463 67 HB2 GLU 9 HB2 GLU 9 3.402 -15.349 -7.797 68 HB3 GLU 9 HB3 GLU 9 5.071 -15.587 -7.221 69 HG2 GLU 9 HG2 GLU 9 5.114 -17.818 -8.234 70 HG3 GLU 9 HG3 GLU 9 3.416 -17.626 -8.736 71 H GLN 10 H GLN 10 5.487 -16.284 -4.515 72 HA GLN 10 HA GLN 10 7.050 -18.665 -4.914 73 HB2 GLN 10 HB2 GLN 10 7.051 -16.458 -2.830 74 HB3 GLN 10 HB3 GLN 10 8.198 -17.816 -2.789 75 HG2 GLN 10 HG2 GLN 10 8.967 -17.283 -5.056 76 HG3 GLN 10 HG3 GLN 10 7.863 -15.914 -5.149 77 HE21 GLN 10 HE22 GLN 10 10.906 -16.124 -5.214 78 HE22 GLN 10 HE21 GLN 10 11.440 -15.034 -3.959 79 H GLY 11 H GLY 11 4.046 -18.495 -3.559 80 HA2 GLY 11 HA2 GLY 11 4.650 -20.823 -1.778 81 HA3 GLY 11 HA3 GLY 11 3.443 -19.601 -1.362 82 H ASN 12 H ASN 12 3.229 -19.888 -4.704 83 HA ASN 12 HA ASN 12 0.772 -21.325 -4.584 84 HB2 ASN 12 HB2 ASN 12 0.610 -20.854 -6.797 85 HB3 ASN 12 HB3 ASN 12 1.902 -19.715 -6.434 86 HD21 ASN 12 HD22 ASN 12 4.092 -20.354 -7.027 87 HD22 ASN 12 HD21 ASN 12 4.331 -21.536 -8.300 88 H SER 13 H SER 13 4.113 -22.317 -4.939 89 HA SER 13 HA SER 13 3.449 -25.026 -5.806 90 HB2 SER 13 HB2 SER 13 5.605 -23.926 -6.395 91 HB3 SER 13 HB3 SER 13 6.027 -23.847 -4.667 92 HG SER 13 HG SER 13 6.929 -25.684 -5.722 93 H LEU 14 H LEU 14 4.249 -23.364 -2.713 94 HA LEU 14 HA LEU 14 4.493 -25.681 -1.097 95 HB2 LEU 14 HB2 LEU 14 3.822 -22.762 -0.682 96 HB3 LEU 14 HB3 LEU 14 3.603 -23.887 0.640 97 HG LEU 14 HG LEU 14 5.939 -24.576 0.544 98 HD11 LEU 14 HD11 LEU 14 6.197 -22.508 -1.680 99 HD12 LEU 14 HD12 LEU 14 7.553 -23.309 -0.861 100 HD13 LEU 14 HD13 LEU 14 6.438 -24.273 -1.838 101 HD21 LEU 14 HD21 LEU 14 5.242 -22.638 1.924 102 HD22 LEU 14 HD22 LEU 14 6.910 -22.454 1.334 103 HD23 LEU 14 HD23 LEU 14 5.579 -21.553 0.560 104 H PHE 15 H PHE 15 1.669 -23.802 -2.219 105 HA PHE 15 HA PHE 15 -0.296 -25.069 -0.592 106 HB2 PHE 15 HB2 PHE 15 -0.765 -23.028 -1.773 107 HB3 PHE 15 HB3 PHE 15 -0.311 -23.747 -3.315 108 HD1 PHE 15 HD2 PHE 15 -2.626 -24.805 -0.538 109 HD2 PHE 15 HD1 PHE 15 -2.078 -24.022 -4.722 110 HE1 PHE 15 HE2 PHE 15 -4.998 -25.433 -0.954 111 HE2 PHE 15 HE1 PHE 15 -4.464 -24.604 -5.148 112 HZ PHE 15 HZ PHE 15 -5.908 -25.315 -3.276 113 H LYS 16 H LYS 16 1.525 -26.194 -3.326 114 HA LYS 16 HA LYS 16 -0.421 -28.371 -3.840 115 HB2 LYS 16 HB2 LYS 16 1.892 -27.331 -5.512 116 HB3 LYS 16 HB3 LYS 16 0.730 -28.586 -6.006 117 HG2 LYS 16 HG2 LYS 16 -1.124 -27.000 -5.848 118 HG3 LYS 16 HG3 LYS 16 -0.049 -25.753 -5.190 119 HD2 LYS 16 HD2 LYS 16 1.285 -25.874 -7.334 120 HD3 LYS 16 HD3 LYS 16 -0.005 -26.898 -7.998 121 HE2 LYS 16 HE2 LYS 16 -1.656 -25.090 -7.377 122 HE3 LYS 16 HE3 LYS 16 -0.293 -24.078 -6.860 123 HZ1 LYS 16 HZ1 LYS 16 0.580 -24.156 -9.082 124 HZ2 LYS 16 HZ2 LYS 16 -0.672 -25.114 -9.586 125 HZ3 LYS 16 HZ3 LYS 16 -0.957 -23.566 -9.107 126 H GLN 17 H GLN 17 2.431 -27.803 -2.092 127 HA GLN 17 HA GLN 17 3.655 -30.417 -2.485 128 HB2 GLN 17 HB2 GLN 17 4.065 -28.254 -0.432 129 HB3 GLN 17 HB3 GLN 17 4.955 -29.794 -0.464 130 HG2 GLN 17 HG2 GLN 17 5.532 -29.260 -2.909 131 HG3 GLN 17 HG3 GLN 17 4.958 -27.622 -2.563 132 HE21 GLN 17 HE22 GLN 17 5.809 -27.060 -0.062 133 HE22 GLN 17 HE21 GLN 17 7.552 -27.157 0.028 134 H GLY 18 H GLY 18 0.898 -29.290 -0.685 135 HA2 GLY 18 HA2 GLY 18 -0.603 -30.737 0.374 136 HA3 GLY 18 HA3 GLY 18 0.655 -31.970 0.531 137 H LEU 19 H LEU 19 1.261 -28.622 1.469 138 HA LEU 19 HA LEU 19 0.942 -29.286 4.336 139 HB2 LEU 19 HB2 LEU 19 3.147 -28.090 4.738 140 HB3 LEU 19 HB3 LEU 19 3.193 -29.724 4.086 141 HG LEU 19 HG LEU 19 3.609 -28.868 1.824 142 HD11 LEU 19 HD11 LEU 19 3.761 -26.144 3.191 143 HD12 LEU 19 HD12 LEU 19 4.245 -26.494 1.518 144 HD13 LEU 19 HD13 LEU 19 2.550 -26.649 1.993 145 HD21 LEU 19 HD21 LEU 19 5.490 -27.790 3.962 146 HD22 LEU 19 HD22 LEU 19 5.451 -29.456 3.349 147 HD23 LEU 19 HD23 LEU 19 5.916 -28.123 2.268 148 H TYR 20 H TYR 20 -0.965 -28.082 3.076 149 HA TYR 20 HA TYR 20 -1.042 -25.524 2.248 150 HB2 TYR 20 HB2 TYR 20 -3.120 -26.693 4.106 151 HB3 TYR 20 HB3 TYR 20 -3.384 -25.555 2.802 152 HD1 TYR 20 HD2 TYR 20 -1.893 -26.824 0.549 153 HD2 TYR 20 HD1 TYR 20 -4.347 -28.570 3.613 154 HE1 TYR 20 HE2 TYR 20 -2.408 -28.727 -0.942 155 HE2 TYR 20 HE1 TYR 20 -4.891 -30.456 2.121 156 HH TYR 20 HH TYR 20 -4.529 -31.435 0.069 157 H ARG 21 H ARG 21 -0.615 -26.366 5.694 158 HA ARG 21 HA ARG 21 -1.674 -23.983 6.766 159 HB2 ARG 21 HB2 ARG 21 -0.340 -26.315 7.704 160 HB3 ARG 21 HB3 ARG 21 0.623 -24.950 8.283 161 HG2 ARG 21 HG2 ARG 21 -2.365 -25.350 8.700 162 HG3 ARG 21 HG3 ARG 21 -1.099 -25.577 9.920 163 HD2 ARG 21 HD2 ARG 21 -0.505 -23.179 9.751 164 HD3 ARG 21 HD3 ARG 21 -1.764 -22.943 8.528 165 HE ARG 21 HE ARG 21 -2.124 -23.241 11.421 166 HH11 ARG 21 HH11 ARG 21 -3.693 -23.349 8.249 167 HH12 ARG 21 HH12 ARG 21 -5.302 -23.154 8.924 168 HH21 ARG 21 HH21 ARG 21 -4.253 -22.976 12.232 169 HH22 ARG 21 HH22 ARG 21 -5.607 -22.927 11.119 170 H GLU 22 H GLU 22 1.380 -24.574 5.138 171 HA GLU 22 HA GLU 22 2.632 -22.072 6.022 172 HB2 GLU 22 HB2 GLU 22 3.206 -23.874 3.643 173 HB3 GLU 22 HB3 GLU 22 4.310 -22.678 4.334 174 HG2 GLU 22 HG2 GLU 22 3.273 -25.127 5.841 175 HG3 GLU 22 HG3 GLU 22 4.761 -25.061 4.922 176 H ALA 23 H ALA 23 0.862 -23.372 3.262 177 HA ALA 23 HA ALA 23 1.227 -21.161 1.484 178 HB1 ALA 23 HB1 ALA 23 0.731 -23.457 0.791 179 HB2 ALA 23 HB2 ALA 23 -0.887 -23.343 1.527 180 HB3 ALA 23 HB3 ALA 23 -0.461 -22.296 0.148 181 H VAL 24 H VAL 24 -0.934 -21.512 4.219 182 HA VAL 24 HA VAL 24 -2.987 -19.651 3.241 183 HB VAL 24 HB VAL 24 -2.054 -20.472 6.037 184 HG11 VAL 24 HG11 VAL 24 -3.284 -18.333 6.092 185 HG12 VAL 24 HG12 VAL 24 -4.624 -19.056 5.166 186 HG13 VAL 24 HG13 VAL 24 -4.253 -19.623 6.813 187 HG21 VAL 24 HG21 VAL 24 -3.024 -22.359 4.698 188 HG22 VAL 24 HG22 VAL 24 -4.090 -21.916 6.049 189 HG23 VAL 24 HG23 VAL 24 -4.473 -21.395 4.393 190 H HIS 25 H HIS 25 -0.140 -19.775 5.157 191 HA HIS 25 HA HIS 25 0.124 -17.040 5.977 192 HB2 HIS 25 HB2 HIS 25 1.154 -19.742 6.400 193 HB3 HIS 25 HB3 HIS 25 2.459 -18.656 6.220 194 HD2 HIS 25 HD2 HIS 25 2.961 -17.105 8.408 195 HE1 HIS 25 HE1 HIS 25 -0.511 -18.144 10.644 196 HE2 HIS 25 HE2 HIS 25 1.721 -16.898 10.711 197 H CYS 26 H CYS 26 0.326 -18.218 2.966 198 HA CYS 26 HA CYS 26 2.674 -16.532 2.204 199 HB2 CYS 26 HB2 CYS 26 1.502 -19.056 0.978 200 HB3 CYS 26 HB3 CYS 26 2.579 -17.963 0.113 201 HG CYS 26 HG CYS 26 3.094 -19.431 3.031 202 H TYR 27 H TYR 27 -0.621 -16.601 2.290 203 HA TYR 27 HA TYR 27 -0.817 -14.744 -0.031 204 HB2 TYR 27 HB2 TYR 27 -3.020 -16.495 1.049 205 HB3 TYR 27 HB3 TYR 27 -3.101 -15.472 -0.389 206 HD1 TYR 27 HD1 TYR 27 -0.508 -16.260 -1.740 207 HD2 TYR 27 HD2 TYR 27 -3.500 -18.558 0.288 208 HE1 TYR 27 HE1 TYR 27 0.089 -18.232 -3.127 209 HE2 TYR 27 HE2 TYR 27 -2.906 -20.565 -1.084 210 HH TYR 27 HH TYR 27 -0.352 -20.418 -3.590 211 H ASP 28 H ASP 28 -0.811 -14.937 3.300 212 HA ASP 28 HA ASP 28 -3.105 -13.254 3.886 213 HB2 ASP 28 HB2 ASP 28 -1.976 -14.974 5.381 214 HB3 ASP 28 HB3 ASP 28 -0.627 -13.858 5.560 215 H GLN 29 H GLN 29 0.232 -12.721 2.907 216 HA GLN 29 HA GLN 29 0.418 -10.128 4.152 217 HB2 GLN 29 HB2 GLN 29 2.541 -9.960 3.250 218 HB3 GLN 29 HB3 GLN 29 2.352 -11.668 3.661 219 HG2 GLN 29 HG2 GLN 29 1.926 -10.462 0.923 220 HG3 GLN 29 HG3 GLN 29 3.435 -11.211 1.429 221 HE21 GLN 29 HE22 GLN 29 1.857 -11.960 -0.834 222 HE22 GLN 29 HE21 GLN 29 1.304 -13.602 -0.599 223 H LEU 30 H LEU 30 -1.171 -11.233 1.297 224 HA LEU 30 HA LEU 30 -1.037 -8.697 -0.143 225 HB2 LEU 30 HB2 LEU 30 -2.968 -11.052 -0.282 226 HB3 LEU 30 HB3 LEU 30 -2.919 -9.707 -1.420 227 HG LEU 30 HG LEU 30 -1.700 -11.199 -2.615 228 HD11 LEU 30 HD11 LEU 30 -0.029 -9.437 -2.075 229 HD12 LEU 30 HD12 LEU 30 0.526 -10.402 -0.698 230 HD13 LEU 30 HD13 LEU 30 0.707 -11.016 -2.343 231 HD21 LEU 30 HD21 LEU 30 -2.125 -13.022 -1.117 232 HD22 LEU 30 HD22 LEU 30 -0.431 -13.060 -1.622 233 HD23 LEU 30 HD23 LEU 30 -0.844 -12.463 -0.010 234 H ILE 31 H ILE 31 -3.180 -10.269 2.205 235 HA ILE 31 HA ILE 31 -5.197 -8.202 2.093 236 HB ILE 31 HB ILE 31 -4.543 -10.367 4.124 237 HG12 ILE 31 HG12 ILE 31 -6.783 -10.543 2.105 238 HG13 ILE 31 HG13 ILE 31 -5.163 -10.971 1.621 239 HG21 ILE 31 HG21 ILE 31 -7.078 -8.741 3.763 240 HG22 ILE 31 HG22 ILE 31 -6.946 -10.174 4.803 241 HG23 ILE 31 HG23 ILE 31 -5.998 -8.731 5.172 242 HD11 ILE 31 HD11 ILE 31 -4.963 -12.565 3.448 243 HD12 ILE 31 HD12 ILE 31 -6.640 -12.214 3.944 244 HD13 ILE 31 HD13 ILE 31 -6.314 -12.951 2.353 245 H THR 32 H THR 32 -2.097 -8.533 3.450 246 HA THR 32 HA THR 32 -2.561 -6.475 5.554 247 HB THR 32 HB THR 32 -0.147 -8.241 4.969 248 HG1 THR 32 HG1 THR 32 -1.922 -9.437 5.672 249 HG21 THR 32 HG21 THR 32 -0.831 -6.407 7.306 250 HG22 THR 32 HG22 THR 32 0.461 -7.632 7.336 251 HG23 THR 32 HG23 THR 32 0.556 -6.280 6.200 252 H ALA 33 H ALA 33 -1.342 -6.784 2.306 253 HA ALA 33 HA ALA 33 0.293 -4.320 2.695 254 HB1 ALA 33 HB1 ALA 33 1.553 -6.299 1.921 255 HB2 ALA 33 HB2 ALA 33 0.464 -6.444 0.515 256 HB3 ALA 33 HB3 ALA 33 1.517 -5.026 0.677 257 H GLN 34 H GLN 34 -2.090 -5.900 0.511 258 HA GLN 34 HA GLN 34 -2.992 -3.253 -0.392 259 HB2 GLN 34 HB2 GLN 34 -2.137 -5.359 -2.386 260 HB3 GLN 34 HB3 GLN 34 -2.742 -3.763 -2.757 261 HG2 GLN 34 HG2 GLN 34 -0.102 -4.354 -1.364 262 HG3 GLN 34 HG3 GLN 34 -0.286 -4.006 -3.082 263 HE21 GLN 34 HE22 GLN 34 1.395 -2.448 -1.482 264 HE22 GLN 34 HE21 GLN 34 0.711 -0.844 -1.340 265 HA PRO 35 HA PRO 35 -6.063 -6.676 0.386 266 HB2 PRO 35 HB2 PRO 35 -7.697 -5.342 2.120 267 HB3 PRO 35 HB3 PRO 35 -6.151 -6.106 2.606 268 HG2 PRO 35 HG2 PRO 35 -6.625 -3.201 1.899 269 HG3 PRO 35 HG3 PRO 35 -5.827 -3.859 3.371 270 HD2 PRO 35 HD2 PRO 35 -4.384 -3.047 1.215 271 HD3 PRO 35 HD3 PRO 35 -3.911 -4.510 2.135 272 H GLN 36 H GLN 36 -6.079 -3.743 -1.282 273 HA GLN 36 HA GLN 36 -8.930 -3.432 -1.629 274 HB2 GLN 36 HB2 GLN 36 -7.067 -2.215 -3.619 275 HB3 GLN 36 HB3 GLN 36 -8.467 -1.532 -2.793 276 HG2 GLN 36 HG2 GLN 36 -6.687 -0.343 -1.874 277 HG3 GLN 36 HG3 GLN 36 -6.956 -1.604 -0.656 278 HE21 GLN 36 HE22 GLN 36 -4.519 -0.486 -0.516 279 HE22 GLN 36 HE21 GLN 36 -3.283 -1.493 -1.274 280 H ASN 37 H ASN 37 -7.147 -5.935 -2.584 281 HA ASN 37 HA ASN 37 -8.556 -6.187 -5.186 282 HB2 ASN 37 HB2 ASN 37 -5.667 -6.916 -4.551 283 HB3 ASN 37 HB3 ASN 37 -6.520 -7.364 -6.045 284 HD21 ASN 37 HD22 ASN 37 -5.070 -4.729 -4.207 285 HD22 ASN 37 HD21 ASN 37 -5.100 -3.551 -5.504 286 HA PRO 38 HA PRO 38 -10.011 -9.884 -3.309 287 HB2 PRO 38 HB2 PRO 38 -11.051 -11.164 -5.445 288 HB3 PRO 38 HB3 PRO 38 -11.668 -9.578 -4.918 289 HG2 PRO 38 HG2 PRO 38 -9.568 -10.050 -7.075 290 HG3 PRO 38 HG3 PRO 38 -11.124 -9.163 -7.237 291 HD2 PRO 38 HD2 PRO 38 -8.897 -7.780 -6.645 292 HD3 PRO 38 HD3 PRO 38 -10.392 -7.456 -5.798 293 H VAL 39 H VAL 39 -7.269 -9.831 -5.361 294 HA VAL 39 HA VAL 39 -6.885 -12.572 -6.005 295 HB VAL 39 HB VAL 39 -4.785 -10.441 -5.376 296 HG11 VAL 39 HG11 VAL 39 -3.898 -12.731 -5.607 297 HG12 VAL 39 HG12 VAL 39 -4.733 -12.908 -7.173 298 HG13 VAL 39 HG13 VAL 39 -3.420 -11.715 -6.987 299 HG21 VAL 39 HG21 VAL 39 -4.838 -9.948 -7.800 300 HG22 VAL 39 HG22 VAL 39 -6.243 -11.027 -7.983 301 HG23 VAL 39 HG23 VAL 39 -6.363 -9.538 -7.011 302 H GLY 40 H GLY 40 -5.790 -10.627 -3.191 303 HA2 GLY 40 HA2 GLY 40 -4.483 -12.667 -1.745 304 HA3 GLY 40 HA3 GLY 40 -5.203 -11.190 -1.073 305 H TYR 41 H TYR 41 -7.837 -12.334 -2.459 306 HA TYR 41 HA TYR 41 -8.517 -14.272 -0.305 307 HB2 TYR 41 HB2 TYR 41 -10.642 -12.621 -1.620 308 HB3 TYR 41 HB3 TYR 41 -10.633 -13.386 -0.095 309 HD1 TYR 41 HD2 TYR 41 -8.707 -10.581 -1.751 310 HD2 TYR 41 HD1 TYR 41 -10.572 -12.115 1.806 311 HE1 TYR 41 HE2 TYR 41 -8.204 -8.457 -0.574 312 HE2 TYR 41 HE1 TYR 41 -10.040 -10.002 2.990 313 HH TYR 41 HH TYR 41 -9.135 -7.909 2.841 314 H SER 42 H SER 42 -7.428 -14.580 -3.133 315 HA SER 42 HA SER 42 -9.595 -16.377 -4.116 316 HB2 SER 42 HB2 SER 42 -9.343 -14.308 -5.518 317 HB3 SER 42 HB3 SER 42 -7.660 -14.773 -5.840 318 HG SER 42 HG SER 42 -8.486 -16.762 -6.694 319 H ASN 43 H ASN 43 -6.630 -16.179 -2.697 320 HA ASN 43 HA ASN 43 -5.895 -18.876 -3.727 321 HB2 ASN 43 HB2 ASN 43 -4.065 -16.559 -2.955 322 HB3 ASN 43 HB3 ASN 43 -3.532 -18.212 -3.268 323 HD21 ASN 43 HD22 ASN 43 -4.078 -19.148 -5.438 324 HD22 ASN 43 HD21 ASN 43 -4.053 -18.067 -6.814 325 H LYS 44 H LYS 44 -5.799 -16.549 -0.928 326 HA LYS 44 HA LYS 44 -5.284 -18.654 0.996 327 HB2 LYS 44 HB2 LYS 44 -5.005 -16.136 1.286 328 HB3 LYS 44 HB3 LYS 44 -6.738 -16.014 1.351 329 HG2 LYS 44 HG2 LYS 44 -6.800 -17.515 3.322 330 HG3 LYS 44 HG3 LYS 44 -5.030 -17.708 3.231 331 HD2 LYS 44 HD2 LYS 44 -4.692 -15.349 3.712 332 HD3 LYS 44 HD3 LYS 44 -6.439 -15.036 3.589 333 HE2 LYS 44 HE2 LYS 44 -6.808 -16.627 5.498 334 HE3 LYS 44 HE3 LYS 44 -5.045 -16.747 5.683 335 HZ1 LYS 44 HZ1 LYS 44 -5.997 -15.115 7.163 336 HZ2 LYS 44 HZ2 LYS 44 -4.999 -14.365 6.093 337 HZ3 LYS 44 HZ3 LYS 44 -6.632 -14.268 5.905 338 H ALA 45 H ALA 45 -8.125 -17.136 -0.403 339 HA ALA 45 HA ALA 45 -10.099 -18.605 1.054 340 HB1 ALA 45 HB1 ALA 45 -10.478 -16.453 -0.198 341 HB2 ALA 45 HB2 ALA 45 -10.288 -17.365 -1.724 342 HB3 ALA 45 HB3 ALA 45 -11.633 -17.738 -0.635 343 H MET 46 H MET 46 -7.763 -19.936 -0.823 344 HA MET 46 HA MET 46 -9.500 -22.190 -1.642 345 HB2 MET 46 HB2 MET 46 -8.773 -20.442 -3.521 346 HB3 MET 46 HB3 MET 46 -7.225 -21.304 -3.430 347 HG2 MET 46 HG2 MET 46 -8.609 -22.275 -5.174 348 HG3 MET 46 HG3 MET 46 -8.412 -23.437 -3.860 349 HE1 MET 46 HE1 MET 46 -10.706 -20.936 -5.715 350 HE2 MET 46 HE2 MET 46 -12.257 -21.043 -4.846 351 HE3 MET 46 HE3 MET 46 -10.860 -20.279 -4.066 352 H ALA 47 H ALA 47 -6.969 -21.188 0.222 353 HA ALA 47 HA ALA 47 -5.821 -23.937 0.191 354 HB1 ALA 47 HB1 ALA 47 -4.378 -21.338 0.834 355 HB2 ALA 47 HB2 ALA 47 -3.680 -22.964 0.908 356 HB3 ALA 47 HB3 ALA 47 -4.185 -22.291 -0.657 357 H LEU 48 H LEU 48 -7.193 -21.279 2.051 358 HA LEU 48 HA LEU 48 -6.625 -22.520 4.617 359 HB2 LEU 48 HB2 LEU 48 -6.894 -20.089 4.261 360 HB3 LEU 48 HB3 LEU 48 -8.565 -20.337 3.739 361 HG LEU 48 HG LEU 48 -9.215 -21.079 5.956 362 HD11 LEU 48 HD11 LEU 48 -6.274 -20.747 6.678 363 HD12 LEU 48 HD12 LEU 48 -7.587 -21.028 7.841 364 HD13 LEU 48 HD13 LEU 48 -7.186 -22.275 6.667 365 HD21 LEU 48 HD21 LEU 48 -9.125 -18.658 5.471 366 HD22 LEU 48 HD22 LEU 48 -8.723 -18.969 7.174 367 HD23 LEU 48 HD23 LEU 48 -7.429 -18.605 6.019 368 H ILE 49 H ILE 49 -9.068 -22.724 2.091 369 HA ILE 49 HA ILE 49 -11.066 -24.156 3.589 370 HB ILE 49 HB ILE 49 -11.778 -24.990 1.361 371 HG12 ILE 49 HG12 ILE 49 -9.608 -23.212 0.260 372 HG13 ILE 49 HG13 ILE 49 -9.328 -24.923 0.466 373 HG21 ILE 49 HG21 ILE 49 -12.584 -22.829 2.275 374 HG22 ILE 49 HG22 ILE 49 -11.220 -21.997 1.492 375 HG23 ILE 49 HG23 ILE 49 -12.467 -22.788 0.509 376 HD11 ILE 49 HD11 ILE 49 -11.546 -23.824 -1.242 377 HD12 ILE 49 HD12 ILE 49 -10.023 -24.570 -1.797 378 HD13 ILE 49 HD13 ILE 49 -11.188 -25.552 -0.900 379 H LYS 50 H LYS 50 -7.983 -24.950 2.172 380 HA LYS 50 HA LYS 50 -8.570 -27.664 1.550 381 HB2 LYS 50 HB2 LYS 50 -6.670 -25.835 0.810 382 HB3 LYS 50 HB3 LYS 50 -5.737 -26.815 1.932 383 HG2 LYS 50 HG2 LYS 50 -5.357 -27.887 -0.075 384 HG3 LYS 50 HG3 LYS 50 -6.709 -28.849 0.533 385 HD2 LYS 50 HD2 LYS 50 -6.847 -26.500 -1.418 386 HD3 LYS 50 HD3 LYS 50 -6.888 -28.199 -1.894 387 HE2 LYS 50 HE2 LYS 50 -8.928 -26.885 -0.076 388 HE3 LYS 50 HE3 LYS 50 -9.122 -27.041 -1.828 389 HZ1 LYS 50 HZ1 LYS 50 -10.204 -28.840 -0.637 390 HZ2 LYS 50 HZ2 LYS 50 -9.001 -29.417 -1.598 391 HZ3 LYS 50 HZ3 LYS 50 -8.770 -29.318 0.026 392 H LEU 51 H LEU 51 -8.308 -26.279 4.509 393 HA LEU 51 HA LEU 51 -6.954 -28.598 5.798 394 HB2 LEU 51 HB2 LEU 51 -6.999 -25.645 6.505 395 HB3 LEU 51 HB3 LEU 51 -6.401 -26.902 7.612 396 HG LEU 51 HG LEU 51 -5.285 -26.551 4.815 397 HD11 LEU 51 HD11 LEU 51 -4.968 -24.474 6.104 398 HD12 LEU 51 HD12 LEU 51 -4.298 -25.422 7.463 399 HD13 LEU 51 HD13 LEU 51 -3.433 -25.334 5.908 400 HD21 LEU 51 HD21 LEU 51 -4.877 -28.744 5.872 401 HD22 LEU 51 HD22 LEU 51 -3.377 -27.802 5.859 402 HD23 LEU 51 HD23 LEU 51 -4.318 -27.943 7.356 403 H GLY 52 H GLY 52 -9.932 -27.176 5.229 404 HA2 GLY 52 HA2 GLY 52 -11.927 -28.044 6.102 405 HA3 GLY 52 HA3 GLY 52 -11.082 -28.559 7.569 406 H GLU 53 H GLU 53 -9.965 -25.475 7.216 407 HA GLU 53 HA GLU 53 -11.882 -24.509 9.201 408 HB2 GLU 53 HB2 GLU 53 -9.543 -22.926 8.087 409 HB3 GLU 53 HB3 GLU 53 -10.418 -22.718 9.593 410 HG2 GLU 53 HG2 GLU 53 -9.630 -24.943 10.376 411 HG3 GLU 53 HG3 GLU 53 -8.677 -25.122 8.894 412 H TYR 54 H TYR 54 -13.310 -24.881 6.919 413 HA TYR 54 HA TYR 54 -13.439 -22.799 5.059 414 HB2 TYR 54 HB2 TYR 54 -15.670 -24.477 6.255 415 HB3 TYR 54 HB3 TYR 54 -15.843 -23.471 4.823 416 HD1 TYR 54 HD2 TYR 54 -14.666 -24.028 2.731 417 HD2 TYR 54 HD1 TYR 54 -14.575 -26.634 6.148 418 HE1 TYR 54 HE2 TYR 54 -13.880 -25.892 1.289 419 HE2 TYR 54 HE1 TYR 54 -13.784 -28.501 4.703 420 HH TYR 54 HH TYR 54 -13.226 -29.166 2.591 421 H THR 55 H THR 55 -14.517 -22.884 8.425 422 HA THR 55 HA THR 55 -16.315 -20.723 8.441 423 HB THR 55 HB THR 55 -14.225 -21.593 10.496 424 HG1 THR 55 HG1 THR 55 -16.973 -22.283 10.207 425 HG21 THR 55 HG21 THR 55 -15.116 -19.377 11.067 426 HG22 THR 55 HG22 THR 55 -16.780 -19.936 10.783 427 HG23 THR 55 HG23 THR 55 -15.836 -20.580 12.149 428 H GLN 56 H GLN 56 -12.826 -20.809 8.063 429 HA GLN 56 HA GLN 56 -12.559 -17.908 8.595 430 HB2 GLN 56 HB2 GLN 56 -10.471 -20.072 8.099 431 HB3 GLN 56 HB3 GLN 56 -10.168 -18.426 8.704 432 HG2 GLN 56 HG2 GLN 56 -11.379 -18.931 10.767 433 HG3 GLN 56 HG3 GLN 56 -11.896 -20.492 10.149 434 HE21 GLN 56 HE22 GLN 56 -11.015 -21.531 11.956 435 HE22 GLN 56 HE21 GLN 56 -9.300 -21.859 12.018 436 H ALA 57 H ALA 57 -13.380 -19.823 6.036 437 HA ALA 57 HA ALA 57 -11.716 -18.314 4.064 438 HB1 ALA 57 HB1 ALA 57 -13.061 -21.036 3.859 439 HB2 ALA 57 HB2 ALA 57 -12.084 -20.250 2.594 440 HB3 ALA 57 HB3 ALA 57 -11.329 -20.755 4.126 441 H ILE 58 H ILE 58 -15.009 -19.393 4.950 442 HA ILE 58 HA ILE 58 -16.434 -18.182 2.728 443 HB ILE 58 HB ILE 58 -17.048 -18.684 5.723 444 HG12 ILE 58 HG12 ILE 58 -17.911 -20.306 3.323 445 HG13 ILE 58 HG13 ILE 58 -16.501 -20.701 4.298 446 HG21 ILE 58 HG21 ILE 58 -18.645 -17.025 4.523 447 HG22 ILE 58 HG22 ILE 58 -19.189 -18.472 3.626 448 HG23 ILE 58 HG23 ILE 58 -19.355 -18.408 5.378 449 HD11 ILE 58 HD11 ILE 58 -18.390 -22.033 5.059 450 HD12 ILE 58 HD12 ILE 58 -17.954 -20.859 6.322 451 HD13 ILE 58 HD13 ILE 58 -19.378 -20.580 5.285 452 H GLN 59 H GLN 59 -15.218 -16.929 5.914 453 HA GLN 59 HA GLN 59 -16.424 -14.334 5.507 454 HB2 GLN 59 HB2 GLN 59 -14.038 -15.213 7.197 455 HB3 GLN 59 HB3 GLN 59 -14.837 -13.634 7.302 456 HG2 GLN 59 HG2 GLN 59 -16.978 -14.783 7.893 457 HG3 GLN 59 HG3 GLN 59 -16.133 -16.338 7.860 458 HE21 GLN 59 HE22 GLN 59 -15.320 -17.052 9.777 459 HE22 GLN 59 HE21 GLN 59 -14.974 -16.035 11.164 460 H MET 60 H MET 60 -13.337 -15.893 4.625 461 HA MET 60 HA MET 60 -12.072 -13.505 3.666 462 HB2 MET 60 HB2 MET 60 -11.067 -15.838 4.300 463 HB3 MET 60 HB3 MET 60 -11.581 -16.327 2.681 464 HG2 MET 60 HG2 MET 60 -9.445 -15.682 2.229 465 HG3 MET 60 HG3 MET 60 -10.259 -14.143 1.957 466 HE1 MET 60 HE1 MET 60 -10.256 -12.146 3.850 467 HE2 MET 60 HE2 MET 60 -10.754 -13.247 5.176 468 HE3 MET 60 HE3 MET 60 -9.304 -12.228 5.342 469 H CYS 61 H CYS 61 -14.293 -15.891 2.225 470 HA CYS 61 HA CYS 61 -13.880 -15.013 -0.471 471 HB2 CYS 61 HB2 CYS 61 -16.130 -16.530 0.932 472 HB3 CYS 61 HB3 CYS 61 -16.147 -16.191 -0.801 473 HG CYS 61 HG CYS 61 -13.771 -17.701 0.910 474 H GLN 62 H GLN 62 -16.337 -14.148 2.058 475 HA GLN 62 HA GLN 62 -17.663 -12.272 0.296 476 HB2 GLN 62 HB2 GLN 62 -17.726 -12.618 3.322 477 HB3 GLN 62 HB3 GLN 62 -18.873 -11.642 2.359 478 HG2 GLN 62 HG2 GLN 62 -19.643 -13.637 1.164 479 HG3 GLN 62 HG3 GLN 62 -18.394 -14.615 1.924 480 HE21 GLN 62 HE22 GLN 62 -19.949 -16.031 2.658 481 HE22 GLN 62 HE21 GLN 62 -21.023 -15.636 3.960 482 H GLN 63 H GLN 63 -14.780 -12.104 2.273 483 HA GLN 63 HA GLN 63 -14.802 -9.172 2.441 484 HB2 GLN 63 HB2 GLN 63 -12.828 -11.377 3.115 485 HB3 GLN 63 HB3 GLN 63 -12.363 -9.679 3.186 486 HG2 GLN 63 HG2 GLN 63 -14.836 -10.598 4.658 487 HG3 GLN 63 HG3 GLN 63 -13.222 -10.865 5.345 488 HE21 GLN 63 HE22 GLN 63 -12.781 -9.382 6.847 489 HE22 GLN 63 HE21 GLN 63 -13.099 -7.672 6.700 490 H GLY 64 H GLY 64 -14.065 -11.498 0.011 491 HA2 GLY 64 HA2 GLY 64 -12.070 -9.692 -1.260 492 HA3 GLY 64 HA3 GLY 64 -12.354 -11.388 -1.659 493 H LEU 65 H LEU 65 -15.337 -11.084 -1.652 494 HA LEU 65 HA LEU 65 -15.736 -10.195 -4.342 495 HB2 LEU 65 HB2 LEU 65 -17.548 -10.890 -2.018 496 HB3 LEU 65 HB3 LEU 65 -18.216 -10.317 -3.546 497 HG LEU 65 HG LEU 65 -16.323 -12.703 -3.409 498 HD11 LEU 65 HD11 LEU 65 -18.361 -13.152 -2.068 499 HD12 LEU 65 HD12 LEU 65 -19.366 -12.633 -3.439 500 HD13 LEU 65 HD13 LEU 65 -18.358 -14.087 -3.577 501 HD21 LEU 65 HD21 LEU 65 -18.286 -11.720 -5.514 502 HD22 LEU 65 HD22 LEU 65 -16.522 -11.633 -5.622 503 HD23 LEU 65 HD23 LEU 65 -17.327 -13.209 -5.607 504 H ARG 66 H ARG 66 -15.176 -8.405 -1.534 505 HA ARG 66 HA ARG 66 -16.745 -6.048 -2.160 506 HB2 ARG 66 HB2 ARG 66 -14.221 -6.373 -0.480 507 HB3 ARG 66 HB3 ARG 66 -15.358 -5.014 -0.431 508 HG2 ARG 66 HG2 ARG 66 -17.136 -6.555 0.393 509 HG3 ARG 66 HG3 ARG 66 -15.970 -7.894 0.345 510 HD2 ARG 66 HD2 ARG 66 -16.144 -7.051 2.614 511 HD3 ARG 66 HD3 ARG 66 -14.531 -6.695 1.967 512 HE ARG 66 HE ARG 66 -16.245 -4.473 1.466 513 HH11 ARG 66 HH11 ARG 66 -14.656 -6.124 4.159 514 HH12 ARG 66 HH12 ARG 66 -14.557 -4.675 5.134 515 HH21 ARG 66 HH21 ARG 66 -16.069 -2.593 2.753 516 HH22 ARG 66 HH22 ARG 66 -15.344 -2.693 4.339 517 H TYR 67 H TYR 67 -14.311 -7.495 -3.854 518 HA TYR 67 HA TYR 67 -13.012 -4.956 -4.703 519 HB2 TYR 67 HB2 TYR 67 -11.664 -7.516 -3.820 520 HB3 TYR 67 HB3 TYR 67 -10.820 -6.139 -4.507 521 HD1 TYR 67 HD1 TYR 67 -11.611 -3.785 -3.285 522 HD2 TYR 67 HD2 TYR 67 -11.469 -7.700 -1.516 523 HE1 TYR 67 HE1 TYR 67 -11.500 -2.762 -1.033 524 HE2 TYR 67 HE2 TYR 67 -11.355 -6.684 0.739 525 HH TYR 67 HH TYR 67 -11.365 -3.122 1.233 526 H THR 68 H THR 68 -15.012 -7.170 -5.761 527 HA THR 68 HA THR 68 -13.562 -7.659 -8.327 528 HB THR 68 HB THR 68 -15.209 -9.542 -8.601 529 HG1 THR 68 HG1 THR 68 -16.758 -8.804 -7.107 530 HG21 THR 68 HG21 THR 68 -14.067 -11.038 -7.011 531 HG22 THR 68 HG22 THR 68 -12.929 -9.940 -7.825 532 HG23 THR 68 HG23 THR 68 -13.432 -9.617 -6.144 533 H SER 69 H SER 69 -15.211 -5.289 -7.325 534 HA SER 69 HA SER 69 -17.673 -5.253 -8.784 535 HB2 SER 69 HB2 SER 69 -17.053 -3.923 -6.730 536 HB3 SER 69 HB3 SER 69 -16.055 -2.913 -7.796 537 HG SER 69 HG SER 69 -18.182 -2.078 -7.488 538 H THR 70 H THR 70 -14.784 -5.595 -10.214 539 HA THR 70 HA THR 70 -15.609 -3.978 -12.549 540 HB THR 70 HB THR 70 -14.124 -2.481 -11.370 541 HG1 THR 70 HG1 THR 70 -12.571 -2.256 -12.967 542 HG21 THR 70 HG21 THR 70 -12.119 -4.778 -11.414 543 HG22 THR 70 HG22 THR 70 -11.762 -3.111 -10.918 544 HG23 THR 70 HG23 THR 70 -12.894 -4.088 -9.968 545 H ALA 71 H ALA 71 -14.289 -4.478 -14.464 546 HA ALA 71 HA ALA 71 -14.399 -7.264 -14.994 547 HB1 ALA 71 HB1 ALA 71 -14.853 -5.486 -16.626 548 HB2 ALA 71 HB2 ALA 71 -13.164 -4.951 -16.528 549 HB3 ALA 71 HB3 ALA 71 -13.557 -6.556 -17.211 550 H GLU 72 H GLU 72 -11.847 -5.389 -13.566 551 HA GLU 72 HA GLU 72 -9.589 -6.805 -14.593 552 HB2 GLU 72 HB2 GLU 72 -9.979 -5.452 -11.916 553 HB3 GLU 72 HB3 GLU 72 -8.431 -5.920 -12.609 554 HG2 GLU 72 HG2 GLU 72 -10.365 -3.870 -13.759 555 HG3 GLU 72 HG3 GLU 72 -8.839 -3.530 -12.928 556 H HIS 73 H HIS 73 -12.157 -7.960 -12.739 557 HA HIS 73 HA HIS 73 -10.550 -10.245 -11.747 558 HB2 HIS 73 HB2 HIS 73 -12.615 -8.811 -10.042 559 HB3 HIS 73 HB3 HIS 73 -11.494 -10.074 -9.548 560 HD2 HIS 73 HD2 HIS 73 -11.905 -6.407 -9.541 561 HE1 HIS 73 HE1 HIS 73 -7.740 -6.963 -8.967 562 HE2 HIS 73 HE2 HIS 73 -9.639 -5.272 -8.872 563 H VAL 74 H VAL 74 -12.497 -9.759 -13.983 564 HA VAL 74 HA VAL 74 -15.107 -10.475 -13.449 565 HB VAL 74 HB VAL 74 -14.135 -9.631 -15.568 566 HG11 VAL 74 HG11 VAL 74 -13.363 -12.534 -16.055 567 HG12 VAL 74 HG12 VAL 74 -13.242 -11.194 -17.213 568 HG13 VAL 74 HG13 VAL 74 -12.226 -11.192 -15.758 569 HG21 VAL 74 HG21 VAL 74 -16.448 -10.534 -15.450 570 HG22 VAL 74 HG22 VAL 74 -15.697 -10.799 -17.043 571 HG23 VAL 74 HG23 VAL 74 -15.829 -12.144 -15.896 572 H ALA 75 H ALA 75 -12.324 -12.637 -13.474 573 HA ALA 75 HA ALA 75 -14.102 -15.012 -13.440 574 HB1 ALA 75 HB1 ALA 75 -11.068 -14.752 -13.301 575 HB2 ALA 75 HB2 ALA 75 -11.984 -16.270 -13.456 576 HB3 ALA 75 HB3 ALA 75 -12.025 -15.071 -14.770 577 H ILE 76 H ILE 76 -11.796 -13.275 -11.253 578 HA ILE 76 HA ILE 76 -12.098 -15.079 -9.053 579 HB ILE 76 HB ILE 76 -11.366 -12.131 -9.217 580 HG12 ILE 76 HG12 ILE 76 -9.686 -14.654 -8.908 581 HG13 ILE 76 HG13 ILE 76 -9.805 -13.668 -10.364 582 HG21 ILE 76 HG21 ILE 76 -11.120 -14.060 -6.882 583 HG22 ILE 76 HG22 ILE 76 -10.446 -12.422 -6.933 584 HG23 ILE 76 HG23 ILE 76 -12.189 -12.638 -6.955 585 HD11 ILE 76 HD11 ILE 76 -8.585 -12.798 -7.729 586 HD12 ILE 76 HD12 ILE 76 -7.755 -13.094 -9.260 587 HD13 ILE 76 HD13 ILE 76 -8.870 -11.717 -9.114 588 H ARG 77 H ARG 77 -14.071 -12.433 -10.301 589 HA ARG 77 HA ARG 77 -15.793 -11.893 -8.156 590 HB2 ARG 77 HB2 ARG 77 -15.613 -10.694 -10.341 591 HB3 ARG 77 HB3 ARG 77 -16.363 -12.087 -11.140 592 HG2 ARG 77 HG2 ARG 77 -18.411 -11.758 -9.773 593 HG3 ARG 77 HG3 ARG 77 -17.647 -10.349 -9.001 594 HD2 ARG 77 HD2 ARG 77 -17.465 -9.246 -11.196 595 HD3 ARG 77 HD3 ARG 77 -18.070 -10.712 -11.992 596 HE ARG 77 HE ARG 77 -20.254 -10.207 -11.307 597 HH11 ARG 77 HH11 ARG 77 -17.964 -7.895 -9.888 598 HH12 ARG 77 HH12 ARG 77 -19.233 -6.818 -9.354 599 HH21 ARG 77 HH21 ARG 77 -21.857 -8.767 -10.604 600 HH22 ARG 77 HH22 ARG 77 -21.421 -7.305 -9.759 601 H SER 78 H SER 78 -15.453 -14.778 -10.059 602 HA SER 78 HA SER 78 -18.067 -15.816 -9.051 603 HB2 SER 78 HB2 SER 78 -16.379 -16.626 -11.454 604 HB3 SER 78 HB3 SER 78 -17.884 -17.425 -10.930 605 HG SER 78 HG SER 78 -18.245 -15.848 -12.552 606 H LYS 79 H LYS 79 -14.632 -16.071 -8.560 607 HA LYS 79 HA LYS 79 -14.799 -18.903 -7.850 608 HB2 LYS 79 HB2 LYS 79 -12.582 -16.843 -7.546 609 HB3 LYS 79 HB3 LYS 79 -12.446 -18.542 -7.109 610 HG2 LYS 79 HG2 LYS 79 -12.819 -17.381 -9.879 611 HG3 LYS 79 HG3 LYS 79 -11.446 -18.287 -9.251 612 HD2 LYS 79 HD2 LYS 79 -14.215 -19.341 -9.930 613 HD3 LYS 79 HD3 LYS 79 -12.673 -19.761 -10.677 614 HE2 LYS 79 HE2 LYS 79 -11.943 -20.692 -8.423 615 HE3 LYS 79 HE3 LYS 79 -13.610 -20.425 -7.857 616 HZ1 LYS 79 HZ1 LYS 79 -12.828 -22.132 -10.129 617 HZ2 LYS 79 HZ2 LYS 79 -13.295 -22.664 -8.643 618 HZ3 LYS 79 HZ3 LYS 79 -14.374 -21.881 -9.609 619 H LEU 80 H LEU 80 -14.828 -15.721 -6.149 620 HA LEU 80 HA LEU 80 -14.748 -17.016 -3.543 621 HB2 LEU 80 HB2 LEU 80 -15.182 -14.199 -4.585 622 HB3 LEU 80 HB3 LEU 80 -15.394 -14.613 -2.872 623 HG LEU 80 HG LEU 80 -13.082 -15.305 -2.667 624 HD11 LEU 80 HD11 LEU 80 -12.863 -14.713 -5.640 625 HD12 LEU 80 HD12 LEU 80 -11.476 -14.907 -4.555 626 HD13 LEU 80 HD13 LEU 80 -12.571 -16.272 -4.826 627 HD21 LEU 80 HD21 LEU 80 -12.012 -13.111 -3.170 628 HD22 LEU 80 HD22 LEU 80 -13.418 -12.668 -4.162 629 HD23 LEU 80 HD23 LEU 80 -13.605 -12.937 -2.412 630 H GLN 81 H GLN 81 -17.018 -16.728 -6.015 631 HA GLN 81 HA GLN 81 -19.324 -16.917 -4.162 632 HB2 GLN 81 HB2 GLN 81 -18.876 -16.378 -7.081 633 HB3 GLN 81 HB3 GLN 81 -20.325 -17.264 -6.658 634 HG2 GLN 81 HG2 GLN 81 -19.541 -14.546 -5.579 635 HG3 GLN 81 HG3 GLN 81 -20.836 -14.892 -6.737 636 HE21 GLN 81 HE22 GLN 81 -21.960 -17.250 -5.512 637 HE22 GLN 81 HE21 GLN 81 -22.684 -16.764 -3.996 638 H TYR 82 H TYR 82 -17.453 -18.752 -6.630 639 HA TYR 82 HA TYR 82 -19.028 -21.126 -6.591 640 HB2 TYR 82 HB2 TYR 82 -17.352 -20.734 -8.321 641 HB3 TYR 82 HB3 TYR 82 -16.104 -20.482 -7.127 642 HD1 TYR 82 HD1 TYR 82 -18.264 -23.083 -8.675 643 HD2 TYR 82 HD2 TYR 82 -14.856 -22.246 -6.178 644 HE1 TYR 82 HE1 TYR 82 -17.604 -25.484 -8.761 645 HE2 TYR 82 HE2 TYR 82 -14.202 -24.639 -6.250 646 HH TYR 82 HH TYR 82 -16.103 -27.070 -8.085 647 H ARG 83 H ARG 83 -16.005 -20.299 -4.707 648 HA ARG 83 HA ARG 83 -16.188 -22.838 -3.338 649 HB2 ARG 83 HB2 ARG 83 -14.061 -21.635 -3.697 650 HB3 ARG 83 HB3 ARG 83 -14.610 -20.324 -2.639 651 HG2 ARG 83 HG2 ARG 83 -13.085 -21.935 -1.503 652 HG3 ARG 83 HG3 ARG 83 -14.671 -21.836 -0.725 653 HD2 ARG 83 HD2 ARG 83 -13.962 -24.155 -0.849 654 HD3 ARG 83 HD3 ARG 83 -15.357 -23.933 -1.909 655 HE ARG 83 HE ARG 83 -12.915 -23.554 -3.377 656 HH11 ARG 83 HH11 ARG 83 -14.932 -26.080 -1.946 657 HH12 ARG 83 HH12 ARG 83 -14.359 -27.313 -3.037 658 HH21 ARG 83 HH21 ARG 83 -12.162 -25.198 -4.769 659 HH22 ARG 83 HH22 ARG 83 -12.805 -26.813 -4.636 660 H LEU 84 H LEU 84 -17.453 -19.590 -2.748 661 HA LEU 84 HA LEU 84 -18.276 -20.079 -0.038 662 HB2 LEU 84 HB2 LEU 84 -17.857 -17.859 -1.067 663 HB3 LEU 84 HB3 LEU 84 -19.220 -18.110 -2.163 664 HG LEU 84 HG LEU 84 -20.741 -18.201 -0.181 665 HD11 LEU 84 HD11 LEU 84 -19.054 -18.928 1.478 666 HD12 LEU 84 HD12 LEU 84 -18.287 -17.326 1.356 667 HD13 LEU 84 HD13 LEU 84 -19.959 -17.485 1.959 668 HD21 LEU 84 HD21 LEU 84 -20.384 -16.098 -1.428 669 HD22 LEU 84 HD22 LEU 84 -20.650 -15.795 0.300 670 HD23 LEU 84 HD23 LEU 84 -19.004 -15.718 -0.382 671 H GLU 85 H GLU 85 -19.432 -21.050 -3.160 672 HA GLU 85 HA GLU 85 -22.184 -21.556 -2.284 673 HB2 GLU 85 HB2 GLU 85 -20.629 -21.565 -4.850 674 HB3 GLU 85 HB3 GLU 85 -22.018 -22.625 -4.769 675 HG2 GLU 85 HG2 GLU 85 -23.495 -20.795 -4.155 676 HG3 GLU 85 HG3 GLU 85 -22.126 -19.687 -3.985 677 H LEU 86 H LEU 86 -19.243 -23.118 -1.842 678 HA LEU 86 HA LEU 86 -20.649 -25.741 -1.535 679 HB2 LEU 86 HB2 LEU 86 -17.823 -25.157 -2.501 680 HB3 LEU 86 HB3 LEU 86 -18.272 -26.693 -1.781 681 HG LEU 86 HG LEU 86 -18.308 -27.048 -4.072 682 HD11 LEU 86 HD11 LEU 86 -21.224 -26.597 -3.335 683 HD12 LEU 86 HD12 LEU 86 -20.591 -27.710 -4.555 684 HD13 LEU 86 HD13 LEU 86 -20.245 -28.001 -2.838 685 HD21 LEU 86 HD21 LEU 86 -19.584 -25.752 -5.706 686 HD22 LEU 86 HD22 LEU 86 -20.093 -24.622 -4.449 687 HD23 LEU 86 HD23 LEU 86 -18.370 -24.760 -4.877 688 H ALA 87 H ALA 87 -18.640 -23.225 -0.116 689 HA ALA 87 HA ALA 87 -17.604 -24.749 2.058 690 HB1 ALA 87 HB1 ALA 87 -18.312 -21.786 1.883 691 HB2 ALA 87 HB2 ALA 87 -17.255 -22.547 3.095 692 HB3 ALA 87 HB3 ALA 87 -16.763 -22.524 1.389 693 H GLN 88 H GLN 88 -20.762 -23.250 1.446 694 HA GLN 88 HA GLN 88 -21.736 -23.397 4.145 695 HB2 GLN 88 HB2 GLN 88 -23.122 -23.186 1.442 696 HB3 GLN 88 HB3 GLN 88 -23.916 -22.996 3.013 697 HG2 GLN 88 HG2 GLN 88 -22.424 -21.102 3.558 698 HG3 GLN 88 HG3 GLN 88 -21.623 -21.279 1.988 699 HE21 GLN 88 HE22 GLN 88 -22.355 -19.962 0.392 700 HE22 GLN 88 HE21 GLN 88 -23.960 -19.255 0.334 701 H GLY 89 H GLY 89 -20.732 -25.878 2.276 702 HA2 GLY 89 HA2 GLY 89 -22.719 -27.766 3.437 703 HA3 GLY 89 HA3 GLY 89 -22.211 -27.889 1.735 704 H ALA 90 H ALA 90 -19.762 -26.719 3.867 705 HA ALA 90 HA ALA 90 -18.684 -29.427 4.392 706 HB1 ALA 90 HB1 ALA 90 -17.173 -27.185 2.993 707 HB2 ALA 90 HB2 ALA 90 -16.483 -28.747 3.503 708 HB3 ALA 90 HB3 ALA 90 -17.730 -28.698 2.238 709 H VAL 91 H VAL 91 -19.188 -26.131 5.324 710 HA VAL 91 HA VAL 91 -17.134 -25.958 7.338 711 HB VAL 91 HB VAL 91 -18.348 -24.093 6.191 712 HG11 VAL 91 HG11 VAL 91 -20.529 -23.369 7.037 713 HG12 VAL 91 HG12 VAL 91 -20.647 -25.001 6.352 714 HG13 VAL 91 HG13 VAL 91 -20.605 -24.780 8.116 715 HG21 VAL 91 HG21 VAL 91 -18.405 -22.618 8.134 716 HG22 VAL 91 HG22 VAL 91 -18.485 -24.019 9.226 717 HG23 VAL 91 HG23 VAL 91 -17.030 -23.732 8.246 718 H GLY 92 H GLY 92 -19.987 -27.737 7.080 719 HA2 GLY 92 HA2 GLY 92 -20.123 -28.217 10.028 720 HA3 GLY 92 HA3 GLY 92 -21.566 -28.150 8.994 721 H SER 93 H SER 93 -18.545 -29.576 7.886 722 HA SER 93 HA SER 93 -19.584 -32.334 8.243 723 HB2 SER 93 HB2 SER 93 -18.617 -31.158 5.608 724 HB3 SER 93 HB3 SER 93 -19.149 -32.830 5.889 725 HG SER 93 HG SER 93 -20.805 -31.516 4.981 726 H VAL 94 H VAL 94 -17.703 -33.805 7.048 727 HA VAL 94 HA VAL 94 -15.077 -32.824 7.793 728 HB VAL 94 HB VAL 94 -16.066 -33.778 9.846 729 HG11 VAL 94 HG11 VAL 94 -16.523 -36.154 10.069 730 HG12 VAL 94 HG12 VAL 94 -17.574 -35.463 8.812 731 HG13 VAL 94 HG13 VAL 94 -16.148 -36.426 8.359 732 HG21 VAL 94 HG21 VAL 94 -13.854 -35.495 8.642 733 HG22 VAL 94 HG22 VAL 94 -13.630 -33.908 9.420 734 HG23 VAL 94 HG23 VAL 94 -14.200 -35.294 10.373 735 H GLN 95 H GLN 95 -13.703 -33.436 6.430 736 HA GLN 95 HA GLN 95 -14.023 -35.848 4.753 737 HB2 GLN 95 HB2 GLN 95 -13.533 -34.596 2.734 738 HB3 GLN 95 HB3 GLN 95 -14.980 -33.950 3.514 739 HG2 GLN 95 HG2 GLN 95 -12.196 -32.744 3.760 740 HG3 GLN 95 HG3 GLN 95 -13.432 -32.204 2.621 741 HE21 GLN 95 HE22 GLN 95 -15.503 -31.360 3.526 742 HE22 GLN 95 HE21 GLN 95 -15.453 -30.552 5.075 743 H ILE 96 H ILE 96 -12.266 -34.775 7.063 744 HA ILE 96 HA ILE 96 -9.683 -35.633 5.888 745 HB ILE 96 HB ILE 96 -8.543 -33.841 7.203 746 HG12 ILE 96 HG12 ILE 96 -11.349 -32.697 7.541 747 HG13 ILE 96 HG13 ILE 96 -10.358 -33.408 8.835 748 HG21 ILE 96 HG21 ILE 96 -8.915 -32.085 5.583 749 HG22 ILE 96 HG22 ILE 96 -9.046 -33.643 4.760 750 HG23 ILE 96 HG23 ILE 96 -10.511 -32.732 5.172 751 HD11 ILE 96 HD11 ILE 96 -10.179 -30.991 8.918 752 HD12 ILE 96 HD12 ILE 96 -8.618 -31.669 8.407 753 HD13 ILE 96 HD13 ILE 96 -9.704 -30.910 7.213 754 HA PRO 97 HA PRO 97 -9.547 -37.994 9.626 755 HB2 PRO 97 HB2 PRO 97 -6.867 -38.296 10.060 756 HB3 PRO 97 HB3 PRO 97 -7.711 -39.056 8.665 757 HG2 PRO 97 HG2 PRO 97 -6.150 -36.452 8.710 758 HG3 PRO 97 HG3 PRO 97 -6.003 -37.812 7.544 759 HD2 PRO 97 HD2 PRO 97 -7.506 -35.616 6.999 760 HD3 PRO 97 HD3 PRO 97 -8.034 -37.246 6.484 761 H VAL 98 H VAL 98 -8.840 -37.957 11.895 762 HA VAL 98 HA VAL 98 -7.958 -35.332 12.899 763 HB VAL 98 HB VAL 98 -9.796 -35.308 14.567 764 HG11 VAL 98 HG11 VAL 98 -10.808 -35.379 11.696 765 HG12 VAL 98 HG12 VAL 98 -11.559 -34.546 13.070 766 HG13 VAL 98 HG13 VAL 98 -9.980 -34.005 12.470 767 HG21 VAL 98 HG21 VAL 98 -10.337 -37.736 14.543 768 HG22 VAL 98 HG22 VAL 98 -11.772 -36.733 14.237 769 HG23 VAL 98 HG23 VAL 98 -10.971 -37.571 12.892 770 H VAL 99 H VAL 99 -7.382 -38.517 12.801 771 HA VAL 99 HA VAL 99 -7.085 -39.153 15.619 772 HB VAL 99 HB VAL 99 -5.963 -41.185 14.762 773 HG11 VAL 99 HG11 VAL 99 -8.490 -40.474 13.211 774 HG12 VAL 99 HG12 VAL 99 -7.881 -42.106 13.551 775 HG13 VAL 99 HG13 VAL 99 -8.436 -41.076 14.883 776 HG21 VAL 99 HG21 VAL 99 -4.783 -40.194 12.823 777 HG22 VAL 99 HG22 VAL 99 -5.781 -41.579 12.339 778 HG23 VAL 99 HG23 VAL 99 -6.345 -39.930 12.005 779 H GLU 100 H GLU 100 -5.398 -37.012 13.728 780 HA GLU 100 HA GLU 100 -2.677 -37.647 14.302 781 HB2 GLU 100 HB2 GLU 100 -2.255 -35.337 13.602 782 HB3 GLU 100 HB3 GLU 100 -3.394 -36.136 12.503 783 HG2 GLU 100 HG2 GLU 100 -5.286 -35.022 13.638 784 HG3 GLU 100 HG3 GLU 100 -4.162 -34.246 14.766 785 H VAL 101 H VAL 101 -1.263 -36.016 15.543 786 HA VAL 101 HA VAL 101 -2.486 -35.182 18.086 787 HB VAL 101 HB VAL 101 -1.575 -37.519 18.175 788 HG11 VAL 101 HG11 VAL 101 1.123 -36.150 17.908 789 HG12 VAL 101 HG12 VAL 101 0.838 -37.866 18.271 790 HG13 VAL 101 HG13 VAL 101 0.369 -37.213 16.689 791 HG21 VAL 101 HG21 VAL 101 -0.128 -35.532 19.977 792 HG22 VAL 101 HG22 VAL 101 -1.809 -36.081 20.202 793 HG23 VAL 101 HG23 VAL 101 -0.464 -37.238 20.331 794 H ASP 102 H ASP 102 -1.011 -33.733 19.332 795 HA ASP 102 HA ASP 102 1.162 -32.462 17.824 796 HB2 ASP 102 HB2 ASP 102 -1.022 -31.452 17.064 797 HB3 ASP 102 HB3 ASP 102 -1.274 -30.905 18.720 798 H GLU 103 H GLU 103 2.036 -30.545 19.222 799 HA GLU 103 HA GLU 103 1.849 -31.210 22.113 800 HB2 GLU 103 HB2 GLU 103 4.420 -30.522 20.673 801 HB3 GLU 103 HB3 GLU 103 4.198 -31.113 22.329 802 HG2 GLU 103 HG2 GLU 103 3.205 -33.228 21.338 803 HG3 GLU 103 HG3 GLU 103 3.744 -32.658 19.751 804 H LEU 104 H LEU 104 3.403 -29.380 23.218 805 HA LEU 104 HA LEU 104 2.320 -26.757 22.312 806 HB2 LEU 104 HB2 LEU 104 2.756 -27.684 25.165 807 HB3 LEU 104 HB3 LEU 104 1.908 -26.255 24.636 808 HG LEU 104 HG LEU 104 0.956 -29.078 24.144 809 HD11 LEU 104 HD11 LEU 104 -0.029 -26.947 26.076 810 HD12 LEU 104 HD12 LEU 104 -0.763 -28.546 25.812 811 HD13 LEU 104 HD13 LEU 104 0.864 -28.420 26.518 812 HD21 LEU 104 HD21 LEU 104 0.178 -27.469 22.409 813 HD22 LEU 104 HD22 LEU 104 -1.154 -27.973 23.466 814 HD23 LEU 104 HD23 LEU 104 -0.391 -26.379 23.693 815 HA PRO 105 HA PRO 105 6.473 -25.366 22.716 816 HB2 PRO 105 HB2 PRO 105 6.262 -22.743 23.338 817 HB3 PRO 105 HB3 PRO 105 5.539 -23.396 21.834 818 HG2 PRO 105 HG2 PRO 105 4.166 -22.837 24.476 819 HG3 PRO 105 HG3 PRO 105 3.615 -22.396 22.818 820 HD2 PRO 105 HD2 PRO 105 2.789 -24.617 24.230 821 HD3 PRO 105 HD3 PRO 105 2.811 -24.576 22.446 822 H GLU 106 H GLU 106 5.010 -26.370 25.350 823 HA GLU 106 HA GLU 106 5.513 -26.592 27.547 824 HB2 GLU 106 HB2 GLU 106 8.305 -26.048 26.473 825 HB3 GLU 106 HB3 GLU 106 7.954 -26.697 28.092 826 HG2 GLU 106 HG2 GLU 106 6.774 -28.613 27.059 827 HG3 GLU 106 HG3 GLU 106 7.166 -27.983 25.448 828 H GLY 107 H GLY 107 4.828 -23.873 26.537 829 HA2 GLY 107 HA2 GLY 107 5.429 -22.414 29.017 830 HA3 GLY 107 HA3 GLY 107 6.013 -21.673 27.506 831 H TYR 108 H TYR 108 3.157 -23.635 27.340 832 HA TYR 108 HA TYR 108 1.513 -21.580 26.298 833 HB2 TYR 108 HB2 TYR 108 -0.245 -23.299 26.427 834 HB3 TYR 108 HB3 TYR 108 1.240 -23.872 25.671 835 HD1 TYR 108 HD2 TYR 108 2.784 -25.381 26.900 836 HD2 TYR 108 HD1 TYR 108 -1.069 -24.280 28.447 837 HE1 TYR 108 HE2 TYR 108 2.899 -27.276 28.502 838 HE2 TYR 108 HE1 TYR 108 -0.967 -26.162 30.067 839 HH TYR 108 HH TYR 108 0.257 -27.947 30.842 840 H ASP 109 H ASP 109 -0.823 -21.328 27.249 841 HA ASP 109 HA ASP 109 -0.379 -19.657 29.526 842 HB2 ASP 109 HB2 ASP 109 -2.925 -20.366 28.060 843 HB3 ASP 109 HB3 ASP 109 -2.750 -19.023 29.195 844 H ARG 110 H ARG 110 -0.459 -22.741 29.787 845 HA ARG 110 HA ARG 110 -1.823 -22.736 32.403 846 HB2 ARG 110 HB2 ARG 110 -2.443 -24.700 30.167 847 HB3 ARG 110 HB3 ARG 110 -2.872 -24.945 31.864 848 HG2 ARG 110 HG2 ARG 110 -4.199 -22.845 31.824 849 HG3 ARG 110 HG3 ARG 110 -3.811 -22.658 30.099 850 HD2 ARG 110 HD2 ARG 110 -4.872 -24.834 29.614 851 HD3 ARG 110 HD3 ARG 110 -5.260 -25.028 31.342 852 HE ARG 110 HE ARG 110 -6.322 -22.549 30.461 853 HH11 ARG 110 HH11 ARG 110 -6.836 -26.011 29.969 854 HH12 ARG 110 HH12 ARG 110 -8.533 -25.826 29.606 855 HH21 ARG 110 HH21 ARG 110 -8.536 -22.330 29.978 856 HH22 ARG 110 HH22 ARG 110 -9.498 -23.746 29.615 857 H SER 111 H SER 111 0.964 -23.070 30.882 858 HA SER 111 HA SER 111 2.000 -25.612 31.580 859 HB2 SER 111 HB2 SER 111 3.034 -24.007 30.000 860 HB3 SER 111 HB3 SER 111 3.423 -22.930 31.354 861 HG SER 111 HG SER 111 4.693 -24.614 32.228 Start of MODEL 4 1 H1 SER 2 H1 SER 2 8.451 -4.438 -6.492 2 H2 SER 2 H2 SER 2 8.972 -3.852 -5.049 3 H3 SER 2 H3 SER 2 8.015 -2.928 -6.008 4 HA SER 2 HA SER 2 6.744 -3.801 -4.189 5 HB2 SER 2 HB2 SER 2 4.937 -4.827 -5.506 6 HB3 SER 2 HB3 SER 2 5.625 -3.426 -6.352 7 HG SER 2 HG SER 2 5.380 -5.209 -7.747 8 H GLN 3 H GLN 3 5.635 -5.777 -3.334 9 HA GLN 3 HA GLN 3 7.201 -8.276 -3.739 10 HB2 GLN 3 HB2 GLN 3 6.527 -6.982 -1.066 11 HB3 GLN 3 HB3 GLN 3 7.161 -8.629 -1.258 12 HG2 GLN 3 HG2 GLN 3 8.596 -6.096 -2.137 13 HG3 GLN 3 HG3 GLN 3 8.924 -6.988 -0.663 14 HE21 GLN 3 HE22 GLN 3 10.866 -6.459 -2.701 15 HE22 GLN 3 HE21 GLN 3 11.356 -8.001 -3.378 16 H PHE 4 H PHE 4 4.185 -6.730 -3.628 17 HA PHE 4 HA PHE 4 2.528 -8.642 -2.368 18 HB2 PHE 4 HB2 PHE 4 1.882 -6.356 -3.034 19 HB3 PHE 4 HB3 PHE 4 2.050 -6.774 -4.717 20 HD1 PHE 4 HD2 PHE 4 0.529 -8.829 -5.544 21 HD2 PHE 4 HD1 PHE 4 -0.233 -6.412 -2.079 22 HE1 PHE 4 HE2 PHE 4 -1.839 -9.526 -5.580 23 HE2 PHE 4 HE1 PHE 4 -2.629 -7.044 -2.159 24 HZ PHE 4 HZ PHE 4 -3.428 -8.613 -3.908 25 H GLU 5 H GLU 5 3.766 -8.411 -5.712 26 HA GLU 5 HA GLU 5 2.305 -10.851 -6.471 27 HB2 GLU 5 HB2 GLU 5 4.089 -8.948 -8.032 28 HB3 GLU 5 HB3 GLU 5 3.281 -10.372 -8.721 29 HG2 GLU 5 HG2 GLU 5 1.082 -9.470 -7.980 30 HG3 GLU 5 HG3 GLU 5 1.894 -8.012 -7.388 31 H LYS 6 H LYS 6 5.060 -10.428 -4.722 32 HA LYS 6 HA LYS 6 6.569 -12.588 -6.127 33 HB2 LYS 6 HB2 LYS 6 7.292 -10.467 -4.075 34 HB3 LYS 6 HB3 LYS 6 8.295 -11.878 -4.362 35 HG2 LYS 6 HG2 LYS 6 9.157 -10.021 -5.629 36 HG3 LYS 6 HG3 LYS 6 8.555 -11.267 -6.732 37 HD2 LYS 6 HD2 LYS 6 6.555 -9.969 -7.206 38 HD3 LYS 6 HD3 LYS 6 6.971 -8.786 -5.935 39 HE2 LYS 6 HE2 LYS 6 9.034 -8.204 -7.184 40 HE3 LYS 6 HE3 LYS 6 8.608 -9.378 -8.437 41 HZ1 LYS 6 HZ1 LYS 6 6.616 -8.103 -8.876 42 HZ2 LYS 6 HZ2 LYS 6 7.013 -7.004 -7.710 43 HZ3 LYS 6 HZ3 LYS 6 7.953 -7.168 -9.053 44 H GLN 7 H GLN 7 5.726 -11.607 -2.714 45 HA GLN 7 HA GLN 7 6.362 -14.155 -1.668 46 HB2 GLN 7 HB2 GLN 7 5.653 -11.663 -0.687 47 HB3 GLN 7 HB3 GLN 7 4.236 -12.633 -0.273 48 HG2 GLN 7 HG2 GLN 7 7.137 -13.251 0.421 49 HG3 GLN 7 HG3 GLN 7 5.878 -12.701 1.548 50 HE21 GLN 7 HE22 GLN 7 3.795 -14.191 1.482 51 HE22 GLN 7 HE21 GLN 7 4.123 -15.910 1.481 52 H LYS 8 H LYS 8 3.407 -12.843 -3.085 53 HA LYS 8 HA LYS 8 1.553 -14.842 -2.211 54 HB2 LYS 8 HB2 LYS 8 1.074 -12.529 -3.003 55 HB3 LYS 8 HB3 LYS 8 1.603 -13.002 -4.588 56 HG2 LYS 8 HG2 LYS 8 -0.308 -14.815 -4.436 57 HG3 LYS 8 HG3 LYS 8 -0.900 -13.849 -3.093 58 HD2 LYS 8 HD2 LYS 8 -1.989 -13.177 -5.172 59 HD3 LYS 8 HD3 LYS 8 -0.952 -11.851 -4.618 60 HE2 LYS 8 HE2 LYS 8 0.758 -12.386 -6.204 61 HE3 LYS 8 HE3 LYS 8 0.051 -13.967 -6.556 62 HZ1 LYS 8 HZ1 LYS 8 -0.408 -12.357 -8.297 63 HZ2 LYS 8 HZ2 LYS 8 -1.806 -12.834 -7.587 64 HZ3 LYS 8 HZ3 LYS 8 -1.174 -11.359 -7.229 65 H GLU 9 H GLU 9 3.976 -14.810 -4.797 66 HA GLU 9 HA GLU 9 2.688 -17.156 -6.081 67 HB2 GLU 9 HB2 GLU 9 3.274 -15.200 -7.474 68 HB3 GLU 9 HB3 GLU 9 4.961 -15.304 -6.934 69 HG2 GLU 9 HG2 GLU 9 5.172 -17.517 -7.914 70 HG3 GLU 9 HG3 GLU 9 3.452 -17.507 -8.365 71 H GLN 10 H GLN 10 5.496 -16.116 -4.173 72 HA GLN 10 HA GLN 10 7.114 -18.436 -4.632 73 HB2 GLN 10 HB2 GLN 10 7.022 -16.314 -2.472 74 HB3 GLN 10 HB3 GLN 10 8.217 -17.626 -2.463 75 HG2 GLN 10 HG2 GLN 10 9.066 -16.957 -4.636 76 HG3 GLN 10 HG3 GLN 10 7.822 -15.723 -4.811 77 HE21 GLN 10 HE22 GLN 10 10.410 -14.934 -5.102 78 HE22 GLN 10 HE21 GLN 10 10.922 -13.994 -3.720 79 H GLY 11 H GLY 11 4.093 -18.381 -3.305 80 HA2 GLY 11 HA2 GLY 11 4.724 -20.782 -1.647 81 HA3 GLY 11 HA3 GLY 11 3.512 -19.605 -1.144 82 H ASN 12 H ASN 12 3.325 -19.758 -4.520 83 HA ASN 12 HA ASN 12 0.865 -21.213 -4.471 84 HB2 ASN 12 HB2 ASN 12 0.714 -20.677 -6.677 85 HB3 ASN 12 HB3 ASN 12 1.976 -19.522 -6.248 86 HD21 ASN 12 HD22 ASN 12 4.181 -20.075 -6.857 87 HD22 ASN 12 HD21 ASN 12 4.462 -21.208 -8.159 88 H SER 13 H SER 13 4.226 -22.136 -4.846 89 HA SER 13 HA SER 13 3.604 -24.828 -5.772 90 HB2 SER 13 HB2 SER 13 5.734 -23.704 -6.344 91 HB3 SER 13 HB3 SER 13 6.162 -23.641 -4.618 92 HG SER 13 HG SER 13 7.092 -25.439 -5.706 93 H LEU 14 H LEU 14 4.355 -23.225 -2.643 94 HA LEU 14 HA LEU 14 4.591 -25.552 -1.050 95 HB2 LEU 14 HB2 LEU 14 3.525 -22.754 -0.424 96 HB3 LEU 14 HB3 LEU 14 4.014 -23.937 0.768 97 HG LEU 14 HG LEU 14 5.833 -22.643 -1.285 98 HD11 LEU 14 HD11 LEU 14 5.678 -22.428 1.755 99 HD12 LEU 14 HD12 LEU 14 6.846 -21.597 0.699 100 HD13 LEU 14 HD13 LEU 14 5.123 -21.191 0.604 101 HD21 LEU 14 HD21 LEU 14 6.440 -24.684 0.899 102 HD22 LEU 14 HD22 LEU 14 6.595 -24.928 -0.861 103 HD23 LEU 14 HD23 LEU 14 7.654 -23.785 -0.033 104 H PHE 15 H PHE 15 1.780 -23.697 -2.212 105 HA PHE 15 HA PHE 15 -0.225 -25.007 -0.663 106 HB2 PHE 15 HB2 PHE 15 -0.643 -22.929 -1.831 107 HB3 PHE 15 HB3 PHE 15 -0.164 -23.632 -3.365 108 HD1 PHE 15 HD2 PHE 15 -2.561 -24.676 -0.655 109 HD2 PHE 15 HD1 PHE 15 -1.890 -23.891 -4.816 110 HE1 PHE 15 HE2 PHE 15 -4.912 -25.296 -1.129 111 HE2 PHE 15 HE1 PHE 15 -4.279 -24.427 -5.302 112 HZ PHE 15 HZ PHE 15 -5.773 -25.145 -3.467 113 H LYS 16 H LYS 16 1.684 -26.070 -3.363 114 HA LYS 16 HA LYS 16 -0.247 -28.244 -3.976 115 HB2 LYS 16 HB2 LYS 16 2.099 -27.161 -5.571 116 HB3 LYS 16 HB3 LYS 16 0.962 -28.418 -6.111 117 HG2 LYS 16 HG2 LYS 16 -0.905 -26.853 -5.994 118 HG3 LYS 16 HG3 LYS 16 0.119 -25.614 -5.260 119 HD2 LYS 16 HD2 LYS 16 1.538 -25.634 -7.362 120 HD3 LYS 16 HD3 LYS 16 0.292 -26.676 -8.100 121 HE2 LYS 16 HE2 LYS 16 -1.425 -24.925 -7.525 122 HE3 LYS 16 HE3 LYS 16 -0.121 -23.903 -6.871 123 HZ1 LYS 16 HZ1 LYS 16 -0.292 -24.824 -9.665 124 HZ2 LYS 16 HZ2 LYS 16 -0.672 -23.313 -9.136 125 HZ3 LYS 16 HZ3 LYS 16 0.881 -23.847 -9.033 126 H GLN 17 H GLN 17 2.538 -27.695 -2.139 127 HA GLN 17 HA GLN 17 3.768 -30.322 -2.547 128 HB2 GLN 17 HB2 GLN 17 4.191 -28.155 -0.482 129 HB3 GLN 17 HB3 GLN 17 5.057 -29.703 -0.503 130 HG2 GLN 17 HG2 GLN 17 5.624 -29.136 -2.975 131 HG3 GLN 17 HG3 GLN 17 5.163 -27.486 -2.539 132 HE21 GLN 17 HE22 GLN 17 6.063 -27.188 0.027 133 HE22 GLN 17 HE21 GLN 17 7.790 -27.361 0.076 134 H GLY 18 H GLY 18 1.011 -29.171 -0.758 135 HA2 GLY 18 HA2 GLY 18 -0.510 -30.621 0.284 136 HA3 GLY 18 HA3 GLY 18 0.743 -31.860 0.445 137 H LEU 19 H LEU 19 1.385 -28.530 1.403 138 HA LEU 19 HA LEU 19 1.007 -29.207 4.257 139 HB2 LEU 19 HB2 LEU 19 3.203 -28.008 4.702 140 HB3 LEU 19 HB3 LEU 19 3.260 -29.639 4.027 141 HG LEU 19 HG LEU 19 3.707 -28.745 1.781 142 HD11 LEU 19 HD11 LEU 19 4.330 -26.360 1.520 143 HD12 LEU 19 HD12 LEU 19 2.627 -26.534 1.971 144 HD13 LEU 19 HD13 LEU 19 3.823 -26.053 3.195 145 HD21 LEU 19 HD21 LEU 19 5.998 -27.969 2.264 146 HD22 LEU 19 HD22 LEU 19 5.545 -27.691 3.967 147 HD23 LEU 19 HD23 LEU 19 5.550 -29.342 3.305 148 H TYR 20 H TYR 20 -0.873 -28.011 2.936 149 HA TYR 20 HA TYR 20 -0.957 -25.464 2.110 150 HB2 TYR 20 HB2 TYR 20 -3.061 -26.650 3.910 151 HB3 TYR 20 HB3 TYR 20 -3.319 -25.536 2.589 152 HD1 TYR 20 HD2 TYR 20 -1.969 -26.650 0.304 153 HD2 TYR 20 HD1 TYR 20 -3.990 -28.704 3.496 154 HE1 TYR 20 HE2 TYR 20 -2.380 -28.577 -1.189 155 HE2 TYR 20 HE1 TYR 20 -4.399 -30.633 2.009 156 HH TYR 20 HH TYR 20 -4.087 -31.526 -0.083 157 H ARG 21 H ARG 21 -0.612 -26.306 5.569 158 HA ARG 21 HA ARG 21 -1.745 -23.944 6.635 159 HB2 ARG 21 HB2 ARG 21 -0.412 -26.252 7.589 160 HB3 ARG 21 HB3 ARG 21 0.558 -24.891 8.170 161 HG2 ARG 21 HG2 ARG 21 -2.426 -25.302 8.575 162 HG3 ARG 21 HG3 ARG 21 -1.163 -25.483 9.805 163 HD2 ARG 21 HD2 ARG 21 -0.597 -23.073 9.545 164 HD3 ARG 21 HD3 ARG 21 -1.911 -22.897 8.371 165 HE ARG 21 HE ARG 21 -2.134 -23.108 11.276 166 HH11 ARG 21 HH11 ARG 21 -3.876 -23.470 8.198 167 HH12 ARG 21 HH12 ARG 21 -5.447 -23.320 8.965 168 HH21 ARG 21 HH21 ARG 21 -4.229 -22.901 12.193 169 HH22 ARG 21 HH22 ARG 21 -5.636 -23.000 11.158 170 H GLU 22 H GLU 22 1.365 -24.478 5.087 171 HA GLU 22 HA GLU 22 2.551 -21.959 5.987 172 HB2 GLU 22 HB2 GLU 22 3.178 -23.734 3.593 173 HB3 GLU 22 HB3 GLU 22 4.243 -22.504 4.287 174 HG2 GLU 22 HG2 GLU 22 3.274 -24.992 5.775 175 HG3 GLU 22 HG3 GLU 22 4.768 -24.873 4.864 176 H ALA 23 H ALA 23 0.850 -23.250 3.177 177 HA ALA 23 HA ALA 23 1.207 -20.999 1.455 178 HB1 ALA 23 HB1 ALA 23 0.771 -23.282 0.688 179 HB2 ALA 23 HB2 ALA 23 -0.859 -23.225 1.416 180 HB3 ALA 23 HB3 ALA 23 -0.455 -22.142 0.065 181 H VAL 24 H VAL 24 -1.039 -21.477 4.111 182 HA VAL 24 HA VAL 24 -3.124 -19.671 3.119 183 HB VAL 24 HB VAL 24 -2.217 -20.471 5.931 184 HG11 VAL 24 HG11 VAL 24 -4.474 -19.711 6.651 185 HG12 VAL 24 HG12 VAL 24 -3.529 -18.379 5.972 186 HG13 VAL 24 HG13 VAL 24 -4.807 -19.147 4.995 187 HG21 VAL 24 HG21 VAL 24 -4.548 -21.496 4.210 188 HG22 VAL 24 HG22 VAL 24 -3.077 -22.404 4.604 189 HG23 VAL 24 HG23 VAL 24 -4.217 -21.989 5.890 190 H HIS 25 H HIS 25 -0.294 -19.712 5.036 191 HA HIS 25 HA HIS 25 -0.172 -16.982 5.935 192 HB2 HIS 25 HB2 HIS 25 0.935 -19.633 6.355 193 HB3 HIS 25 HB3 HIS 25 2.223 -18.520 6.200 194 HD2 HIS 25 HD2 HIS 25 2.678 -17.015 8.415 195 HE1 HIS 25 HE1 HIS 25 -0.847 -18.071 10.568 196 HE2 HIS 25 HE2 HIS 25 1.382 -16.822 10.695 197 H CYS 26 H CYS 26 0.164 -18.092 2.904 198 HA CYS 26 HA CYS 26 2.461 -16.307 2.246 199 HB2 CYS 26 HB2 CYS 26 1.465 -18.866 0.934 200 HB3 CYS 26 HB3 CYS 26 2.537 -17.712 0.141 201 HG CYS 26 HG CYS 26 2.971 -19.198 3.064 202 H TYR 27 H TYR 27 -0.833 -16.540 2.169 203 HA TYR 27 HA TYR 27 -0.981 -14.596 -0.091 204 HB2 TYR 27 HB2 TYR 27 -3.207 -16.356 0.923 205 HB3 TYR 27 HB3 TYR 27 -3.241 -15.344 -0.526 206 HD1 TYR 27 HD1 TYR 27 -0.684 -16.103 -1.875 207 HD2 TYR 27 HD2 TYR 27 -3.572 -18.468 0.248 208 HE1 TYR 27 HE1 TYR 27 -0.024 -18.100 -3.199 209 HE2 TYR 27 HE2 TYR 27 -2.912 -20.475 -1.073 210 HH TYR 27 HH TYR 27 -0.378 -20.321 -3.599 211 H ASP 28 H ASP 28 -1.086 -14.946 3.240 212 HA ASP 28 HA ASP 28 -3.382 -13.252 3.817 213 HB2 ASP 28 HB2 ASP 28 -2.397 -15.080 5.268 214 HB3 ASP 28 HB3 ASP 28 -0.992 -14.062 5.546 215 H GLN 29 H GLN 29 0.055 -12.753 3.104 216 HA GLN 29 HA GLN 29 0.187 -10.250 4.524 217 HB2 GLN 29 HB2 GLN 29 2.378 -10.074 3.804 218 HB3 GLN 29 HB3 GLN 29 2.121 -11.796 4.096 219 HG2 GLN 29 HG2 GLN 29 1.954 -10.409 1.412 220 HG3 GLN 29 HG3 GLN 29 3.395 -11.248 1.989 221 HE21 GLN 29 HE22 GLN 29 1.992 -11.801 -0.439 222 HE22 GLN 29 HE21 GLN 29 1.352 -13.422 -0.367 223 H LEU 30 H LEU 30 -1.218 -11.123 1.493 224 HA LEU 30 HA LEU 30 -0.904 -8.485 0.272 225 HB2 LEU 30 HB2 LEU 30 -2.867 -10.754 -0.280 226 HB3 LEU 30 HB3 LEU 30 -2.616 -9.324 -1.284 227 HG LEU 30 HG LEU 30 -1.342 -10.806 -2.439 228 HD11 LEU 30 HD11 LEU 30 0.282 -9.112 -1.643 229 HD12 LEU 30 HD12 LEU 30 0.678 -10.142 -0.262 230 HD13 LEU 30 HD13 LEU 30 1.035 -10.697 -1.901 231 HD21 LEU 30 HD21 LEU 30 -1.976 -12.681 -1.062 232 HD22 LEU 30 HD22 LEU 30 -0.250 -12.772 -1.417 233 HD23 LEU 30 HD23 LEU 30 -0.790 -12.223 0.174 234 H ILE 31 H ILE 31 -3.294 -10.220 2.236 235 HA ILE 31 HA ILE 31 -5.290 -8.164 2.087 236 HB ILE 31 HB ILE 31 -4.792 -10.413 4.088 237 HG12 ILE 31 HG12 ILE 31 -6.749 -10.423 1.763 238 HG13 ILE 31 HG13 ILE 31 -5.101 -10.994 1.587 239 HG21 ILE 31 HG21 ILE 31 -7.302 -8.787 3.555 240 HG22 ILE 31 HG22 ILE 31 -7.234 -10.238 4.576 241 HG23 ILE 31 HG23 ILE 31 -6.340 -8.783 5.045 242 HD11 ILE 31 HD11 ILE 31 -5.374 -12.571 3.408 243 HD12 ILE 31 HD12 ILE 31 -7.098 -12.124 3.535 244 HD13 ILE 31 HD13 ILE 31 -6.491 -12.887 2.043 245 H THR 32 H THR 32 -2.344 -8.594 3.767 246 HA THR 32 HA THR 32 -2.987 -6.613 5.882 247 HB THR 32 HB THR 32 -0.498 -8.291 5.414 248 HG1 THR 32 HG1 THR 32 -2.271 -9.584 5.858 249 HG21 THR 32 HG21 THR 32 -0.120 -7.832 7.858 250 HG22 THR 32 HG22 THR 32 0.022 -6.398 6.833 251 HG23 THR 32 HG23 THR 32 -1.448 -6.657 7.800 252 H ALA 33 H ALA 33 -1.477 -6.730 2.728 253 HA ALA 33 HA ALA 33 0.133 -4.327 3.424 254 HB1 ALA 33 HB1 ALA 33 0.370 -6.215 1.049 255 HB2 ALA 33 HB2 ALA 33 1.448 -4.851 1.423 256 HB3 ALA 33 HB3 ALA 33 1.374 -6.248 2.511 257 H GLN 34 H GLN 34 -2.179 -5.588 0.981 258 HA GLN 34 HA GLN 34 -3.486 -3.035 0.869 259 HB2 GLN 34 HB2 GLN 34 -3.364 -2.946 -1.682 260 HB3 GLN 34 HB3 GLN 34 -2.060 -2.229 -0.737 261 HG2 GLN 34 HG2 GLN 34 -1.737 -5.065 -1.637 262 HG3 GLN 34 HG3 GLN 34 -1.677 -3.795 -2.868 263 HE21 GLN 34 HE22 GLN 34 -0.270 -1.801 -2.198 264 HE22 GLN 34 HE21 GLN 34 1.288 -2.203 -1.511 265 HA PRO 35 HA PRO 35 -6.125 -6.726 0.360 266 HB2 PRO 35 HB2 PRO 35 -8.251 -5.722 1.806 267 HB3 PRO 35 HB3 PRO 35 -6.825 -6.519 2.548 268 HG2 PRO 35 HG2 PRO 35 -7.349 -3.568 2.198 269 HG3 PRO 35 HG3 PRO 35 -6.787 -4.428 3.670 270 HD2 PRO 35 HD2 PRO 35 -5.065 -3.148 2.006 271 HD3 PRO 35 HD3 PRO 35 -4.611 -4.707 2.768 272 H GLN 36 H GLN 36 -6.017 -3.675 -0.910 273 HA GLN 36 HA GLN 36 -8.606 -3.147 -1.923 274 HB2 GLN 36 HB2 GLN 36 -5.893 -2.453 -3.112 275 HB3 GLN 36 HB3 GLN 36 -7.431 -1.623 -3.409 276 HG2 GLN 36 HG2 GLN 36 -7.515 -0.888 -1.068 277 HG3 GLN 36 HG3 GLN 36 -6.052 -1.806 -0.700 278 HE21 GLN 36 HE22 GLN 36 -4.397 -0.435 -0.372 279 HE22 GLN 36 HE21 GLN 36 -3.990 0.912 -1.413 280 H ASN 37 H ASN 37 -7.077 -5.958 -2.520 281 HA ASN 37 HA ASN 37 -8.040 -6.126 -5.327 282 HB2 ASN 37 HB2 ASN 37 -5.282 -6.850 -4.264 283 HB3 ASN 37 HB3 ASN 37 -5.905 -7.378 -5.855 284 HD21 ASN 37 HD22 ASN 37 -4.429 -4.805 -4.042 285 HD22 ASN 37 HD21 ASN 37 -4.399 -3.625 -5.336 286 HA PRO 38 HA PRO 38 -9.790 -9.830 -3.575 287 HB2 PRO 38 HB2 PRO 38 -10.799 -10.945 -5.795 288 HB3 PRO 38 HB3 PRO 38 -11.356 -9.331 -5.268 289 HG2 PRO 38 HG2 PRO 38 -9.201 -9.905 -7.326 290 HG3 PRO 38 HG3 PRO 38 -10.696 -8.926 -7.536 291 HD2 PRO 38 HD2 PRO 38 -8.403 -7.679 -6.814 292 HD3 PRO 38 HD3 PRO 38 -9.925 -7.271 -6.077 293 H VAL 39 H VAL 39 -7.146 -9.891 -5.964 294 HA VAL 39 HA VAL 39 -6.930 -12.732 -6.137 295 HB VAL 39 HB VAL 39 -5.876 -11.043 -7.650 296 HG11 VAL 39 HG11 VAL 39 -3.779 -10.850 -5.451 297 HG12 VAL 39 HG12 VAL 39 -3.691 -10.114 -7.069 298 HG13 VAL 39 HG13 VAL 39 -4.913 -9.552 -5.910 299 HG21 VAL 39 HG21 VAL 39 -5.273 -13.441 -7.651 300 HG22 VAL 39 HG22 VAL 39 -3.892 -12.408 -8.083 301 HG23 VAL 39 HG23 VAL 39 -4.000 -13.123 -6.449 302 H GLY 40 H GLY 40 -6.000 -10.385 -3.730 303 HA2 GLY 40 HA2 GLY 40 -4.151 -11.929 -2.191 304 HA3 GLY 40 HA3 GLY 40 -5.136 -10.567 -1.628 305 H TYR 41 H TYR 41 -7.587 -12.234 -2.676 306 HA TYR 41 HA TYR 41 -7.783 -14.016 -0.285 307 HB2 TYR 41 HB2 TYR 41 -10.124 -12.848 -1.855 308 HB3 TYR 41 HB3 TYR 41 -10.150 -13.627 -0.362 309 HD1 TYR 41 HD2 TYR 41 -9.011 -10.454 -1.907 310 HD2 TYR 41 HD1 TYR 41 -9.794 -12.581 1.732 311 HE1 TYR 41 HE2 TYR 41 -8.885 -8.324 -0.655 312 HE2 TYR 41 HE1 TYR 41 -9.651 -10.447 3.001 313 HH TYR 41 HH TYR 41 -9.381 -8.187 2.895 314 H SER 42 H SER 42 -7.753 -13.792 -3.725 315 HA SER 42 HA SER 42 -9.463 -15.966 -4.404 316 HB2 SER 42 HB2 SER 42 -8.739 -14.139 -5.931 317 HB3 SER 42 HB3 SER 42 -7.100 -14.836 -5.949 318 HG SER 42 HG SER 42 -8.337 -15.564 -7.713 319 H ASN 43 H ASN 43 -6.483 -16.104 -2.798 320 HA ASN 43 HA ASN 43 -6.021 -18.886 -3.792 321 HB2 ASN 43 HB2 ASN 43 -4.000 -16.739 -3.005 322 HB3 ASN 43 HB3 ASN 43 -3.609 -18.414 -3.404 323 HD21 ASN 43 HD22 ASN 43 -4.330 -15.262 -4.674 324 HD22 ASN 43 HD21 ASN 43 -4.234 -15.701 -6.362 325 H LYS 44 H LYS 44 -6.028 -16.620 -1.012 326 HA LYS 44 HA LYS 44 -5.437 -18.700 0.926 327 HB2 LYS 44 HB2 LYS 44 -5.206 -16.205 1.235 328 HB3 LYS 44 HB3 LYS 44 -6.931 -16.066 1.227 329 HG2 LYS 44 HG2 LYS 44 -7.077 -17.598 3.196 330 HG3 LYS 44 HG3 LYS 44 -5.306 -17.744 3.184 331 HD2 LYS 44 HD2 LYS 44 -5.092 -15.318 3.624 332 HD3 LYS 44 HD3 LYS 44 -6.858 -15.152 3.558 333 HE2 LYS 44 HE2 LYS 44 -7.037 -16.785 5.453 334 HE3 LYS 44 HE3 LYS 44 -5.264 -16.819 5.553 335 HZ1 LYS 44 HZ1 LYS 44 -5.314 -14.461 6.047 336 HZ2 LYS 44 HZ2 LYS 44 -6.955 -14.433 5.922 337 HZ3 LYS 44 HZ3 LYS 44 -6.235 -15.286 7.130 338 H ALA 45 H ALA 45 -8.331 -17.228 -0.478 339 HA ALA 45 HA ALA 45 -10.260 -18.777 0.971 340 HB1 ALA 45 HB1 ALA 45 -11.837 -17.943 -0.684 341 HB2 ALA 45 HB2 ALA 45 -10.726 -16.620 -0.251 342 HB3 ALA 45 HB3 ALA 45 -10.533 -17.498 -1.788 343 H MET 46 H MET 46 -7.904 -20.005 -0.965 344 HA MET 46 HA MET 46 -9.582 -22.311 -1.764 345 HB2 MET 46 HB2 MET 46 -8.925 -20.519 -3.638 346 HB3 MET 46 HB3 MET 46 -7.383 -21.390 -3.607 347 HG2 MET 46 HG2 MET 46 -8.858 -22.317 -5.312 348 HG3 MET 46 HG3 MET 46 -8.585 -23.506 -4.035 349 HE1 MET 46 HE1 MET 46 -11.069 -20.370 -3.974 350 HE2 MET 46 HE2 MET 46 -11.045 -20.949 -5.659 351 HE3 MET 46 HE3 MET 46 -12.516 -21.123 -4.679 352 H ALA 47 H ALA 47 -7.119 -21.261 0.113 353 HA ALA 47 HA ALA 47 -5.863 -23.968 0.043 354 HB1 ALA 47 HB1 ALA 47 -4.285 -22.245 -0.757 355 HB2 ALA 47 HB2 ALA 47 -4.533 -21.317 0.738 356 HB3 ALA 47 HB3 ALA 47 -3.771 -22.919 0.810 357 H LEU 48 H LEU 48 -7.335 -21.371 1.933 358 HA LEU 48 HA LEU 48 -6.775 -22.597 4.501 359 HB2 LEU 48 HB2 LEU 48 -7.252 -20.187 4.172 360 HB3 LEU 48 HB3 LEU 48 -8.874 -20.580 3.567 361 HG LEU 48 HG LEU 48 -9.507 -21.476 5.753 362 HD11 LEU 48 HD11 LEU 48 -6.681 -20.692 6.583 363 HD12 LEU 48 HD12 LEU 48 -7.973 -21.172 7.699 364 HD13 LEU 48 HD13 LEU 48 -7.332 -22.345 6.539 365 HD21 LEU 48 HD21 LEU 48 -9.416 -19.340 7.002 366 HD22 LEU 48 HD22 LEU 48 -8.129 -18.758 5.923 367 HD23 LEU 48 HD23 LEU 48 -9.764 -19.053 5.284 368 H ILE 49 H ILE 49 -9.195 -22.909 1.937 369 HA ILE 49 HA ILE 49 -11.094 -24.518 3.357 370 HB ILE 49 HB ILE 49 -11.709 -25.315 1.100 371 HG12 ILE 49 HG12 ILE 49 -9.644 -23.380 0.096 372 HG13 ILE 49 HG13 ILE 49 -9.268 -25.071 0.245 373 HG21 ILE 49 HG21 ILE 49 -12.513 -23.145 0.296 374 HG22 ILE 49 HG22 ILE 49 -12.670 -23.243 2.061 375 HG23 ILE 49 HG23 ILE 49 -11.349 -22.302 1.335 376 HD11 ILE 49 HD11 ILE 49 -9.968 -24.677 -2.020 377 HD12 ILE 49 HD12 ILE 49 -11.065 -25.772 -1.160 378 HD13 ILE 49 HD13 ILE 49 -11.534 -24.057 -1.450 379 H LYS 50 H LYS 50 -7.945 -25.099 1.969 380 HA LYS 50 HA LYS 50 -8.391 -27.813 1.242 381 HB2 LYS 50 HB2 LYS 50 -6.574 -25.902 0.553 382 HB3 LYS 50 HB3 LYS 50 -5.611 -26.819 1.713 383 HG2 LYS 50 HG2 LYS 50 -5.141 -27.930 -0.248 384 HG3 LYS 50 HG3 LYS 50 -6.514 -28.896 0.302 385 HD2 LYS 50 HD2 LYS 50 -6.534 -26.604 -1.709 386 HD3 LYS 50 HD3 LYS 50 -6.640 -28.338 -2.097 387 HE2 LYS 50 HE2 LYS 50 -8.792 -28.392 -0.736 388 HE3 LYS 50 HE3 LYS 50 -8.707 -26.608 -0.687 389 HZ1 LYS 50 HZ1 LYS 50 -10.048 -27.396 -2.513 390 HZ2 LYS 50 HZ2 LYS 50 -8.716 -26.615 -3.085 391 HZ3 LYS 50 HZ3 LYS 50 -8.794 -28.256 -3.131 392 H LEU 51 H LEU 51 -8.230 -26.478 4.252 393 HA LEU 51 HA LEU 51 -6.785 -28.769 5.499 394 HB2 LEU 51 HB2 LEU 51 -6.993 -25.839 6.271 395 HB3 LEU 51 HB3 LEU 51 -6.362 -27.074 7.367 396 HG LEU 51 HG LEU 51 -5.205 -26.637 4.595 397 HD11 LEU 51 HD11 LEU 51 -5.058 -24.551 5.893 398 HD12 LEU 51 HD12 LEU 51 -4.333 -25.447 7.251 399 HD13 LEU 51 HD13 LEU 51 -3.468 -25.296 5.699 400 HD21 LEU 51 HD21 LEU 51 -4.199 -27.953 7.160 401 HD22 LEU 51 HD22 LEU 51 -4.684 -28.798 5.675 402 HD23 LEU 51 HD23 LEU 51 -3.240 -27.764 5.680 403 H GLY 52 H GLY 52 -9.833 -27.435 4.993 404 HA2 GLY 52 HA2 GLY 52 -11.767 -28.512 5.879 405 HA3 GLY 52 HA3 GLY 52 -10.901 -28.856 7.375 406 H GLU 53 H GLU 53 -9.970 -25.776 6.850 407 HA GLU 53 HA GLU 53 -11.931 -24.715 8.729 408 HB2 GLU 53 HB2 GLU 53 -9.521 -23.410 7.389 409 HB3 GLU 53 HB3 GLU 53 -10.507 -22.704 8.673 410 HG2 GLU 53 HG2 GLU 53 -9.968 -24.741 10.084 411 HG3 GLU 53 HG3 GLU 53 -8.753 -25.172 8.862 412 H TYR 54 H TYR 54 -13.233 -25.416 6.353 413 HA TYR 54 HA TYR 54 -13.427 -23.473 4.351 414 HB2 TYR 54 HB2 TYR 54 -15.535 -25.304 5.540 415 HB3 TYR 54 HB3 TYR 54 -15.742 -24.415 4.041 416 HD1 TYR 54 HD1 TYR 54 -14.343 -24.908 2.055 417 HD2 TYR 54 HD2 TYR 54 -14.286 -27.367 5.582 418 HE1 TYR 54 HE1 TYR 54 -13.315 -26.746 0.753 419 HE2 TYR 54 HE2 TYR 54 -13.268 -29.217 4.285 420 HH TYR 54 HH TYR 54 -12.530 -28.904 0.781 421 H THR 55 H THR 55 -15.034 -23.579 7.561 422 HA THR 55 HA THR 55 -16.862 -21.451 7.098 423 HB THR 55 HB THR 55 -15.534 -22.524 9.606 424 HG1 THR 55 HG1 THR 55 -17.563 -23.571 9.781 425 HG21 THR 55 HG21 THR 55 -17.936 -20.666 9.279 426 HG22 THR 55 HG22 THR 55 -17.487 -21.494 10.794 427 HG23 THR 55 HG23 THR 55 -16.399 -20.283 10.088 428 H GLN 56 H GLN 56 -13.403 -21.476 8.036 429 HA GLN 56 HA GLN 56 -13.385 -18.596 8.579 430 HB2 GLN 56 HB2 GLN 56 -11.229 -20.705 8.345 431 HB3 GLN 56 HB3 GLN 56 -10.916 -18.985 8.617 432 HG2 GLN 56 HG2 GLN 56 -10.890 -19.927 10.730 433 HG3 GLN 56 HG3 GLN 56 -12.442 -19.099 10.637 434 HE21 GLN 56 HE22 GLN 56 -10.777 -22.227 10.819 435 HE22 GLN 56 HE21 GLN 56 -12.220 -23.177 11.159 436 H ALA 57 H ALA 57 -13.403 -20.580 5.766 437 HA ALA 57 HA ALA 57 -11.580 -18.879 4.218 438 HB1 ALA 57 HB1 ALA 57 -12.089 -20.446 2.409 439 HB2 ALA 57 HB2 ALA 57 -11.689 -21.345 3.888 440 HB3 ALA 57 HB3 ALA 57 -13.384 -21.183 3.373 441 H ILE 58 H ILE 58 -15.061 -19.250 4.755 442 HA ILE 58 HA ILE 58 -15.915 -17.725 2.466 443 HB ILE 58 HB ILE 58 -17.389 -17.800 5.118 444 HG12 ILE 58 HG12 ILE 58 -17.097 -20.074 3.123 445 HG13 ILE 58 HG13 ILE 58 -16.644 -20.076 4.847 446 HG21 ILE 58 HG21 ILE 58 -19.336 -17.795 3.631 447 HG22 ILE 58 HG22 ILE 58 -18.221 -16.520 3.120 448 HG23 ILE 58 HG23 ILE 58 -18.270 -18.056 2.224 449 HD11 ILE 58 HD11 ILE 58 -19.451 -19.880 3.726 450 HD12 ILE 58 HD12 ILE 58 -18.733 -21.216 4.671 451 HD13 ILE 58 HD13 ILE 58 -19.005 -19.637 5.445 452 H GLN 59 H GLN 59 -14.888 -16.992 5.767 453 HA GLN 59 HA GLN 59 -15.658 -14.246 5.843 454 HB2 GLN 59 HB2 GLN 59 -13.453 -15.745 7.314 455 HB3 GLN 59 HB3 GLN 59 -14.083 -14.150 7.765 456 HG2 GLN 59 HG2 GLN 59 -16.333 -15.128 8.113 457 HG3 GLN 59 HG3 GLN 59 -15.731 -16.716 7.621 458 HE21 GLN 59 HE22 GLN 59 -15.774 -17.963 9.409 459 HE22 GLN 59 HE21 GLN 59 -15.058 -17.525 10.953 460 H MET 60 H MET 60 -13.401 -15.782 3.875 461 HA MET 60 HA MET 60 -11.844 -13.277 3.519 462 HB2 MET 60 HB2 MET 60 -11.214 -16.144 2.716 463 HB3 MET 60 HB3 MET 60 -10.154 -14.766 2.406 464 HG2 MET 60 HG2 MET 60 -11.044 -15.426 5.222 465 HG3 MET 60 HG3 MET 60 -9.780 -16.369 4.450 466 HE1 MET 60 HE1 MET 60 -10.869 -12.733 5.410 467 HE2 MET 60 HE2 MET 60 -9.329 -11.826 5.289 468 HE3 MET 60 HE3 MET 60 -10.113 -12.415 3.823 469 H CYS 61 H CYS 61 -14.093 -15.566 2.052 470 HA CYS 61 HA CYS 61 -13.738 -14.593 -0.659 471 HB2 CYS 61 HB2 CYS 61 -16.042 -16.023 0.773 472 HB3 CYS 61 HB3 CYS 61 -15.978 -15.727 -0.968 473 HG CYS 61 HG CYS 61 -15.418 -18.218 -0.500 474 H GLN 62 H GLN 62 -16.031 -13.859 2.059 475 HA GLN 62 HA GLN 62 -17.488 -11.851 0.601 476 HB2 GLN 62 HB2 GLN 62 -17.028 -12.174 3.599 477 HB3 GLN 62 HB3 GLN 62 -18.334 -11.247 2.827 478 HG2 GLN 62 HG2 GLN 62 -19.349 -13.272 1.950 479 HG3 GLN 62 HG3 GLN 62 -17.967 -14.236 2.460 480 HE21 GLN 62 HE22 GLN 62 -19.689 -15.510 3.494 481 HE22 GLN 62 HE21 GLN 62 -20.230 -15.015 5.069 482 H GLN 63 H GLN 63 -14.263 -11.862 1.579 483 HA GLN 63 HA GLN 63 -14.217 -8.907 1.947 484 HB2 GLN 63 HB2 GLN 63 -12.196 -11.071 2.658 485 HB3 GLN 63 HB3 GLN 63 -11.926 -9.340 2.885 486 HG2 GLN 63 HG2 GLN 63 -14.270 -10.793 4.193 487 HG3 GLN 63 HG3 GLN 63 -12.659 -10.698 4.913 488 HE21 GLN 63 HE22 GLN 63 -13.362 -9.518 6.711 489 HE22 GLN 63 HE21 GLN 63 -13.780 -7.828 6.580 490 H GLY 64 H GLY 64 -13.673 -11.387 -0.330 491 HA2 GLY 64 HA2 GLY 64 -11.658 -9.755 -1.805 492 HA3 GLY 64 HA3 GLY 64 -12.059 -11.457 -2.102 493 H LEU 65 H LEU 65 -14.973 -11.096 -1.904 494 HA LEU 65 HA LEU 65 -15.605 -10.264 -4.564 495 HB2 LEU 65 HB2 LEU 65 -17.164 -10.882 -2.035 496 HB3 LEU 65 HB3 LEU 65 -18.006 -10.340 -3.486 497 HG LEU 65 HG LEU 65 -16.096 -12.724 -3.498 498 HD11 LEU 65 HD11 LEU 65 -19.123 -12.679 -3.174 499 HD12 LEU 65 HD12 LEU 65 -18.109 -14.127 -3.370 500 HD13 LEU 65 HD13 LEU 65 -17.960 -13.126 -1.911 501 HD21 LEU 65 HD21 LEU 65 -17.347 -13.303 -5.552 502 HD22 LEU 65 HD22 LEU 65 -18.309 -11.811 -5.384 503 HD23 LEU 65 HD23 LEU 65 -16.563 -11.719 -5.706 504 H ARG 66 H ARG 66 -14.809 -8.398 -1.849 505 HA ARG 66 HA ARG 66 -16.443 -6.057 -2.488 506 HB2 ARG 66 HB2 ARG 66 -13.955 -6.380 -0.746 507 HB3 ARG 66 HB3 ARG 66 -15.069 -5.007 -0.737 508 HG2 ARG 66 HG2 ARG 66 -16.893 -6.511 0.051 509 HG3 ARG 66 HG3 ARG 66 -15.758 -7.875 0.033 510 HD2 ARG 66 HD2 ARG 66 -15.954 -7.007 2.298 511 HD3 ARG 66 HD3 ARG 66 -14.320 -6.697 1.680 512 HE ARG 66 HE ARG 66 -16.024 -4.446 1.158 513 HH11 ARG 66 HH11 ARG 66 -14.339 -6.083 3.805 514 HH12 ARG 66 HH12 ARG 66 -14.159 -4.619 4.742 515 HH21 ARG 66 HH21 ARG 66 -15.799 -2.565 2.414 516 HH22 ARG 66 HH22 ARG 66 -14.995 -2.631 3.956 517 H TYR 67 H TYR 67 -13.963 -7.517 -4.117 518 HA TYR 67 HA TYR 67 -12.713 -4.976 -5.032 519 HB2 TYR 67 HB2 TYR 67 -11.291 -7.466 -4.069 520 HB3 TYR 67 HB3 TYR 67 -10.503 -6.076 -4.798 521 HD1 TYR 67 HD1 TYR 67 -11.160 -3.725 -3.662 522 HD2 TYR 67 HD2 TYR 67 -11.304 -7.577 -1.769 523 HE1 TYR 67 HE1 TYR 67 -11.040 -2.626 -1.439 524 HE2 TYR 67 HE2 TYR 67 -11.189 -6.500 0.459 525 HH TYR 67 HH TYR 67 -11.017 -2.930 0.833 526 H THR 68 H THR 68 -14.621 -7.350 -5.973 527 HA THR 68 HA THR 68 -13.232 -7.840 -8.568 528 HB THR 68 HB THR 68 -14.883 -9.693 -8.802 529 HG1 THR 68 HG1 THR 68 -16.466 -8.927 -7.381 530 HG21 THR 68 HG21 THR 68 -13.223 -9.795 -6.263 531 HG22 THR 68 HG22 THR 68 -13.790 -11.184 -7.214 532 HG23 THR 68 HG23 THR 68 -12.601 -10.056 -7.899 533 H SER 69 H SER 69 -14.678 -5.390 -7.658 534 HA SER 69 HA SER 69 -17.258 -5.199 -8.818 535 HB2 SER 69 HB2 SER 69 -16.907 -2.786 -8.482 536 HB3 SER 69 HB3 SER 69 -16.353 -3.716 -7.071 537 HG SER 69 HG SER 69 -14.833 -2.119 -7.729 538 H THR 70 H THR 70 -14.584 -5.919 -10.573 539 HA THR 70 HA THR 70 -15.530 -4.463 -12.947 540 HB THR 70 HB THR 70 -13.994 -2.869 -12.068 541 HG1 THR 70 HG1 THR 70 -12.414 -2.876 -13.662 542 HG21 THR 70 HG21 THR 70 -12.020 -5.164 -11.742 543 HG22 THR 70 HG22 THR 70 -11.644 -3.444 -11.501 544 HG23 THR 70 HG23 THR 70 -12.805 -4.254 -10.431 545 H ALA 71 H ALA 71 -14.370 -5.155 -14.906 546 HA ALA 71 HA ALA 71 -14.509 -7.969 -15.156 547 HB1 ALA 71 HB1 ALA 71 -13.327 -5.864 -16.997 548 HB2 ALA 71 HB2 ALA 71 -13.814 -7.506 -17.473 549 HB3 ALA 71 HB3 ALA 71 -15.041 -6.337 -16.919 550 H GLU 72 H GLU 72 -11.880 -6.003 -14.063 551 HA GLU 72 HA GLU 72 -9.685 -7.538 -15.048 552 HB2 GLU 72 HB2 GLU 72 -9.957 -5.925 -12.515 553 HB3 GLU 72 HB3 GLU 72 -8.432 -6.484 -13.197 554 HG2 GLU 72 HG2 GLU 72 -10.388 -4.556 -14.523 555 HG3 GLU 72 HG3 GLU 72 -8.854 -4.125 -13.753 556 H HIS 73 H HIS 73 -12.159 -8.452 -12.939 557 HA HIS 73 HA HIS 73 -10.572 -10.738 -11.925 558 HB2 HIS 73 HB2 HIS 73 -12.463 -9.226 -10.110 559 HB3 HIS 73 HB3 HIS 73 -11.230 -10.402 -9.681 560 HD2 HIS 73 HD2 HIS 73 -11.796 -6.714 -10.015 561 HE1 HIS 73 HE1 HIS 73 -7.592 -7.136 -9.518 562 HE2 HIS 73 HE2 HIS 73 -9.529 -5.479 -9.559 563 H VAL 74 H VAL 74 -12.657 -10.318 -14.041 564 HA VAL 74 HA VAL 74 -15.259 -10.855 -13.260 565 HB VAL 74 HB VAL 74 -14.430 -10.205 -15.507 566 HG11 VAL 74 HG11 VAL 74 -13.821 -13.164 -15.853 567 HG12 VAL 74 HG12 VAL 74 -13.723 -11.907 -17.102 568 HG13 VAL 74 HG13 VAL 74 -12.606 -11.869 -15.722 569 HG21 VAL 74 HG21 VAL 74 -16.754 -10.981 -15.159 570 HG22 VAL 74 HG22 VAL 74 -16.136 -11.392 -16.778 571 HG23 VAL 74 HG23 VAL 74 -16.235 -12.647 -15.524 572 H ALA 75 H ALA 75 -12.578 -13.152 -13.372 573 HA ALA 75 HA ALA 75 -14.391 -15.459 -13.127 574 HB1 ALA 75 HB1 ALA 75 -11.361 -15.219 -12.865 575 HB2 ALA 75 HB2 ALA 75 -12.277 -16.741 -12.942 576 HB3 ALA 75 HB3 ALA 75 -12.239 -15.644 -14.347 577 H ILE 76 H ILE 76 -12.094 -13.640 -10.994 578 HA ILE 76 HA ILE 76 -12.548 -15.278 -8.690 579 HB ILE 76 HB ILE 76 -11.727 -12.345 -8.919 580 HG12 ILE 76 HG12 ILE 76 -10.020 -14.841 -8.576 581 HG13 ILE 76 HG13 ILE 76 -10.257 -14.014 -10.104 582 HG21 ILE 76 HG21 ILE 76 -10.734 -12.745 -6.662 583 HG22 ILE 76 HG22 ILE 76 -12.487 -12.865 -6.658 584 HG23 ILE 76 HG23 ILE 76 -11.487 -14.339 -6.630 585 HD11 ILE 76 HD11 ILE 76 -8.931 -12.805 -7.656 586 HD12 ILE 76 HD12 ILE 76 -8.155 -13.289 -9.174 587 HD13 ILE 76 HD13 ILE 76 -9.302 -11.930 -9.166 588 H ARG 77 H ARG 77 -14.313 -12.632 -10.180 589 HA ARG 77 HA ARG 77 -16.057 -11.820 -8.130 590 HB2 ARG 77 HB2 ARG 77 -15.689 -10.800 -10.400 591 HB3 ARG 77 HB3 ARG 77 -16.551 -12.159 -11.117 592 HG2 ARG 77 HG2 ARG 77 -18.591 -11.525 -9.837 593 HG3 ARG 77 HG3 ARG 77 -17.707 -10.125 -9.175 594 HD2 ARG 77 HD2 ARG 77 -17.332 -9.277 -11.451 595 HD3 ARG 77 HD3 ARG 77 -18.071 -10.734 -12.130 596 HE ARG 77 HE ARG 77 -20.200 -9.960 -11.598 597 HH11 ARG 77 HH11 ARG 77 -17.755 -7.760 -10.256 598 HH12 ARG 77 HH12 ARG 77 -18.928 -6.509 -9.924 599 HH21 ARG 77 HH21 ARG 77 -21.678 -8.300 -11.125 600 HH22 ARG 77 HH22 ARG 77 -21.129 -6.811 -10.397 601 H SER 78 H SER 78 -15.846 -14.829 -9.836 602 HA SER 78 HA SER 78 -18.497 -15.677 -8.733 603 HB2 SER 78 HB2 SER 78 -17.101 -16.517 -11.306 604 HB3 SER 78 HB3 SER 78 -18.615 -17.223 -10.667 605 HG SER 78 HG SER 78 -18.992 -15.562 -12.208 606 H LYS 79 H LYS 79 -15.024 -16.277 -8.799 607 HA LYS 79 HA LYS 79 -15.343 -19.054 -7.979 608 HB2 LYS 79 HB2 LYS 79 -12.978 -17.163 -8.136 609 HB3 LYS 79 HB3 LYS 79 -12.855 -18.782 -7.469 610 HG2 LYS 79 HG2 LYS 79 -13.633 -18.066 -10.319 611 HG3 LYS 79 HG3 LYS 79 -12.146 -18.833 -9.770 612 HD2 LYS 79 HD2 LYS 79 -14.947 -19.990 -9.867 613 HD3 LYS 79 HD3 LYS 79 -13.477 -20.571 -10.672 614 HE2 LYS 79 HE2 LYS 79 -12.502 -21.018 -8.369 615 HE3 LYS 79 HE3 LYS 79 -14.098 -20.625 -7.689 616 HZ1 LYS 79 HZ1 LYS 79 -13.560 -22.780 -9.634 617 HZ2 LYS 79 HZ2 LYS 79 -13.832 -22.994 -8.026 618 HZ3 LYS 79 HZ3 LYS 79 -15.031 -22.418 -8.994 619 H LEU 80 H LEU 80 -15.021 -15.877 -6.321 620 HA LEU 80 HA LEU 80 -14.564 -17.167 -3.745 621 HB2 LEU 80 HB2 LEU 80 -15.430 -14.367 -4.563 622 HB3 LEU 80 HB3 LEU 80 -14.960 -14.843 -2.919 623 HG LEU 80 HG LEU 80 -13.170 -14.958 -5.377 624 HD11 LEU 80 HD11 LEU 80 -13.201 -13.078 -2.982 625 HD12 LEU 80 HD12 LEU 80 -11.981 -13.089 -4.285 626 HD13 LEU 80 HD13 LEU 80 -13.665 -12.663 -4.651 627 HD21 LEU 80 HD21 LEU 80 -12.522 -16.683 -3.774 628 HD22 LEU 80 HD22 LEU 80 -11.362 -15.347 -3.721 629 HD23 LEU 80 HD23 LEU 80 -12.587 -15.507 -2.438 630 H GLN 81 H GLN 81 -17.302 -16.167 -5.766 631 HA GLN 81 HA GLN 81 -19.322 -16.553 -3.731 632 HB2 GLN 81 HB2 GLN 81 -19.155 -16.163 -6.703 633 HB3 GLN 81 HB3 GLN 81 -20.586 -16.980 -6.105 634 HG2 GLN 81 HG2 GLN 81 -19.625 -14.242 -5.217 635 HG3 GLN 81 HG3 GLN 81 -21.041 -14.595 -6.219 636 HE21 GLN 81 HE22 GLN 81 -22.167 -16.804 -4.846 637 HE22 GLN 81 HE21 GLN 81 -22.669 -16.275 -3.251 638 H TYR 82 H TYR 82 -17.782 -18.581 -6.264 639 HA TYR 82 HA TYR 82 -19.485 -20.842 -6.051 640 HB2 TYR 82 HB2 TYR 82 -17.878 -20.675 -7.870 641 HB3 TYR 82 HB3 TYR 82 -16.564 -20.396 -6.751 642 HD1 TYR 82 HD1 TYR 82 -18.836 -22.993 -8.111 643 HD2 TYR 82 HD2 TYR 82 -15.393 -22.173 -5.664 644 HE1 TYR 82 HE1 TYR 82 -18.287 -25.406 -8.082 645 HE2 TYR 82 HE2 TYR 82 -14.849 -24.586 -5.611 646 HH TYR 82 HH TYR 82 -16.846 -27.031 -7.322 647 H ARG 83 H ARG 83 -16.428 -20.071 -4.223 648 HA ARG 83 HA ARG 83 -16.676 -22.589 -2.798 649 HB2 ARG 83 HB2 ARG 83 -14.503 -21.457 -3.213 650 HB3 ARG 83 HB3 ARG 83 -14.996 -20.119 -2.164 651 HG2 ARG 83 HG2 ARG 83 -13.529 -21.739 -1.014 652 HG3 ARG 83 HG3 ARG 83 -15.109 -21.618 -0.233 653 HD2 ARG 83 HD2 ARG 83 -14.439 -23.952 -0.335 654 HD3 ARG 83 HD3 ARG 83 -15.834 -23.704 -1.388 655 HE ARG 83 HE ARG 83 -13.412 -23.377 -2.896 656 HH11 ARG 83 HH11 ARG 83 -15.387 -25.883 -1.366 657 HH12 ARG 83 HH12 ARG 83 -14.838 -27.136 -2.447 658 HH21 ARG 83 HH21 ARG 83 -12.687 -25.046 -4.261 659 HH22 ARG 83 HH22 ARG 83 -13.324 -26.662 -4.090 660 H LEU 84 H LEU 84 -17.756 -19.251 -2.242 661 HA LEU 84 HA LEU 84 -18.588 -19.644 0.477 662 HB2 LEU 84 HB2 LEU 84 -18.169 -17.479 -0.580 663 HB3 LEU 84 HB3 LEU 84 -19.513 -17.706 -1.701 664 HG LEU 84 HG LEU 84 -20.104 -17.919 1.222 665 HD11 LEU 84 HD11 LEU 84 -19.604 -15.272 -0.198 666 HD12 LEU 84 HD12 LEU 84 -20.210 -15.480 1.470 667 HD13 LEU 84 HD13 LEU 84 -18.556 -15.975 1.044 668 HD21 LEU 84 HD21 LEU 84 -21.904 -18.150 -0.476 669 HD22 LEU 84 HD22 LEU 84 -22.157 -16.750 0.578 670 HD23 LEU 84 HD23 LEU 84 -21.531 -16.513 -1.066 671 H GLU 85 H GLU 85 -19.831 -20.613 -2.624 672 HA GLU 85 HA GLU 85 -22.569 -21.093 -1.691 673 HB2 GLU 85 HB2 GLU 85 -21.044 -21.195 -4.283 674 HB3 GLU 85 HB3 GLU 85 -22.532 -22.110 -4.167 675 HG2 GLU 85 HG2 GLU 85 -23.795 -20.130 -3.511 676 HG3 GLU 85 HG3 GLU 85 -22.310 -19.173 -3.417 677 H LEU 86 H LEU 86 -19.687 -22.747 -1.248 678 HA LEU 86 HA LEU 86 -21.204 -25.321 -0.993 679 HB2 LEU 86 HB2 LEU 86 -18.371 -24.833 -1.984 680 HB3 LEU 86 HB3 LEU 86 -18.860 -26.356 -1.252 681 HG LEU 86 HG LEU 86 -18.926 -26.712 -3.545 682 HD11 LEU 86 HD11 LEU 86 -21.824 -26.166 -2.780 683 HD12 LEU 86 HD12 LEU 86 -21.225 -27.308 -3.996 684 HD13 LEU 86 HD13 LEU 86 -20.887 -27.591 -2.275 685 HD21 LEU 86 HD21 LEU 86 -18.924 -24.438 -4.365 686 HD22 LEU 86 HD22 LEU 86 -20.188 -25.384 -5.165 687 HD23 LEU 86 HD23 LEU 86 -20.630 -24.224 -3.897 688 H ALA 87 H ALA 87 -18.807 -23.062 0.390 689 HA ALA 87 HA ALA 87 -17.899 -24.826 2.437 690 HB1 ALA 87 HB1 ALA 87 -17.967 -21.796 2.274 691 HB2 ALA 87 HB2 ALA 87 -17.048 -22.740 3.472 692 HB3 ALA 87 HB3 ALA 87 -16.646 -22.867 1.749 693 H GLN 88 H GLN 88 -20.956 -23.206 2.126 694 HA GLN 88 HA GLN 88 -21.456 -22.892 4.953 695 HB2 GLN 88 HB2 GLN 88 -23.283 -22.920 2.513 696 HB3 GLN 88 HB3 GLN 88 -23.775 -22.488 4.160 697 HG2 GLN 88 HG2 GLN 88 -22.074 -20.647 4.162 698 HG3 GLN 88 HG3 GLN 88 -21.666 -21.060 2.498 699 HE21 GLN 88 HE22 GLN 88 -22.544 -19.627 1.097 700 HE22 GLN 88 HE21 GLN 88 -24.139 -18.913 1.247 701 H GLY 89 H GLY 89 -20.918 -25.654 3.304 702 HA2 GLY 89 HA2 GLY 89 -22.425 -27.248 5.235 703 HA3 GLY 89 HA3 GLY 89 -22.946 -27.431 3.545 704 H ALA 90 H ALA 90 -20.083 -27.005 2.547 705 HA ALA 90 HA ALA 90 -19.279 -29.721 2.501 706 HB1 ALA 90 HB1 ALA 90 -17.690 -27.182 1.930 707 HB2 ALA 90 HB2 ALA 90 -17.235 -28.831 1.434 708 HB3 ALA 90 HB3 ALA 90 -18.694 -28.080 0.760 709 H VAL 91 H VAL 91 -18.659 -27.141 4.801 710 HA VAL 91 HA VAL 91 -16.338 -28.183 6.057 711 HB VAL 91 HB VAL 91 -17.450 -25.920 6.308 712 HG11 VAL 91 HG11 VAL 91 -19.733 -26.714 6.783 713 HG12 VAL 91 HG12 VAL 91 -19.173 -27.381 8.332 714 HG13 VAL 91 HG13 VAL 91 -19.125 -25.629 8.049 715 HG21 VAL 91 HG21 VAL 91 -16.727 -27.367 8.893 716 HG22 VAL 91 HG22 VAL 91 -15.554 -26.707 7.733 717 HG23 VAL 91 HG23 VAL 91 -16.655 -25.627 8.606 718 H GLY 92 H GLY 92 -19.505 -29.429 5.908 719 HA2 GLY 92 HA2 GLY 92 -19.128 -31.051 8.391 720 HA3 GLY 92 HA3 GLY 92 -20.692 -30.554 7.736 721 H SER 93 H SER 93 -18.677 -31.397 5.134 722 HA SER 93 HA SER 93 -20.132 -33.798 4.543 723 HB2 SER 93 HB2 SER 93 -17.499 -32.745 3.433 724 HB3 SER 93 HB3 SER 93 -18.476 -34.059 2.728 725 HG SER 93 HG SER 93 -20.184 -32.576 2.476 726 H VAL 94 H VAL 94 -18.813 -35.868 3.910 727 HA VAL 94 HA VAL 94 -16.766 -36.588 5.815 728 HB VAL 94 HB VAL 94 -18.873 -36.831 7.054 729 HG11 VAL 94 HG11 VAL 94 -19.681 -38.896 4.975 730 HG12 VAL 94 HG12 VAL 94 -20.578 -38.443 6.434 731 HG13 VAL 94 HG13 VAL 94 -20.379 -37.267 5.119 732 HG21 VAL 94 HG21 VAL 94 -17.643 -39.506 6.266 733 HG22 VAL 94 HG22 VAL 94 -16.987 -38.384 7.482 734 HG23 VAL 94 HG23 VAL 94 -18.550 -39.177 7.753 735 H GLN 95 H GLN 95 -15.477 -37.933 4.900 736 HA GLN 95 HA GLN 95 -16.314 -39.707 2.696 737 HB2 GLN 95 HB2 GLN 95 -14.458 -38.997 1.291 738 HB3 GLN 95 HB3 GLN 95 -15.531 -37.638 1.659 739 HG2 GLN 95 HG2 GLN 95 -12.942 -38.190 3.149 740 HG3 GLN 95 HG3 GLN 95 -13.066 -37.121 1.745 741 HE21 GLN 95 HE22 GLN 95 -14.563 -35.228 1.910 742 HE22 GLN 95 HE21 GLN 95 -14.768 -34.485 3.485 743 H ILE 96 H ILE 96 -15.094 -39.615 5.663 744 HA ILE 96 HA ILE 96 -13.511 -42.080 5.266 745 HB ILE 96 HB ILE 96 -11.838 -41.238 6.944 746 HG12 ILE 96 HG12 ILE 96 -13.070 -38.519 6.351 747 HG13 ILE 96 HG13 ILE 96 -13.220 -39.406 7.878 748 HG21 ILE 96 HG21 ILE 96 -11.921 -39.606 4.384 749 HG22 ILE 96 HG22 ILE 96 -10.486 -40.056 5.324 750 HG23 ILE 96 HG23 ILE 96 -11.417 -41.306 4.486 751 HD11 ILE 96 HD11 ILE 96 -10.632 -38.362 6.653 752 HD12 ILE 96 HD12 ILE 96 -11.470 -37.733 8.083 753 HD13 ILE 96 HD13 ILE 96 -10.739 -39.350 8.134 754 HA PRO 97 HA PRO 97 -15.859 -43.237 8.845 755 HB2 PRO 97 HB2 PRO 97 -14.291 -45.151 9.996 756 HB3 PRO 97 HB3 PRO 97 -15.081 -45.390 8.402 757 HG2 PRO 97 HG2 PRO 97 -12.236 -44.482 8.957 758 HG3 PRO 97 HG3 PRO 97 -12.782 -45.788 7.846 759 HD2 PRO 97 HD2 PRO 97 -12.225 -43.275 6.953 760 HD3 PRO 97 HD3 PRO 97 -13.579 -44.225 6.268 761 H VAL 98 H VAL 98 -15.826 -43.269 11.204 762 HA VAL 98 HA VAL 98 -13.587 -41.911 12.519 763 HB VAL 98 HB VAL 98 -14.997 -40.109 11.543 764 HG11 VAL 98 HG11 VAL 98 -17.135 -41.135 13.450 765 HG12 VAL 98 HG12 VAL 98 -17.225 -39.661 12.468 766 HG13 VAL 98 HG13 VAL 98 -17.193 -41.251 11.675 767 HG21 VAL 98 HG21 VAL 98 -13.694 -39.742 13.628 768 HG22 VAL 98 HG22 VAL 98 -15.151 -38.732 13.526 769 HG23 VAL 98 HG23 VAL 98 -15.146 -40.158 14.575 770 H VAL 99 H VAL 99 -16.197 -44.100 12.519 771 HA VAL 99 HA VAL 99 -16.687 -44.128 15.379 772 HB VAL 99 HB VAL 99 -18.002 -46.154 14.871 773 HG11 VAL 99 HG11 VAL 99 -18.474 -43.892 12.887 774 HG12 VAL 99 HG12 VAL 99 -19.674 -45.080 13.437 775 HG13 VAL 99 HG13 VAL 99 -18.993 -43.908 14.587 776 HG21 VAL 99 HG21 VAL 99 -16.573 -47.102 13.081 777 HG22 VAL 99 HG22 VAL 99 -18.257 -46.921 12.550 778 HG23 VAL 99 HG23 VAL 99 -17.037 -45.758 12.002 779 H GLU 100 H GLU 100 -14.010 -45.083 13.607 780 HA GLU 100 HA GLU 100 -13.323 -47.600 14.543 781 HB2 GLU 100 HB2 GLU 100 -12.239 -45.664 12.931 782 HB3 GLU 100 HB3 GLU 100 -11.153 -45.576 14.334 783 HG2 GLU 100 HG2 GLU 100 -10.868 -48.058 14.197 784 HG3 GLU 100 HG3 GLU 100 -11.954 -48.065 12.784 785 H VAL 101 H VAL 101 -11.923 -48.326 16.163 786 HA VAL 101 HA VAL 101 -12.364 -47.280 18.776 787 HB VAL 101 HB VAL 101 -11.979 -49.632 18.285 788 HG11 VAL 101 HG11 VAL 101 -9.138 -48.822 17.542 789 HG12 VAL 101 HG12 VAL 101 -9.762 -50.485 17.659 790 HG13 VAL 101 HG13 VAL 101 -10.393 -49.393 16.414 791 HG21 VAL 101 HG21 VAL 101 -11.374 -48.771 20.534 792 HG22 VAL 101 HG22 VAL 101 -10.416 -50.185 20.047 793 HG23 VAL 101 HG23 VAL 101 -9.689 -48.571 19.982 794 H ASP 102 H ASP 102 -10.777 -46.453 20.283 795 HA ASP 102 HA ASP 102 -8.332 -45.250 19.168 796 HB2 ASP 102 HB2 ASP 102 -10.242 -43.657 18.800 797 HB3 ASP 102 HB3 ASP 102 -10.472 -43.616 20.554 798 H GLU 103 H GLU 103 -7.087 -44.136 21.010 799 HA GLU 103 HA GLU 103 -7.535 -45.506 23.608 800 HB2 GLU 103 HB2 GLU 103 -4.835 -45.251 22.257 801 HB3 GLU 103 HB3 GLU 103 -5.265 -46.168 23.712 802 HG2 GLU 103 HG2 GLU 103 -6.831 -47.536 22.249 803 HG3 GLU 103 HG3 GLU 103 -6.085 -46.764 20.848 804 H LEU 104 H LEU 104 -5.526 -44.615 25.070 805 HA LEU 104 HA LEU 104 -5.549 -41.643 24.930 806 HB2 LEU 104 HB2 LEU 104 -5.852 -43.414 27.371 807 HB3 LEU 104 HB3 LEU 104 -5.929 -41.678 27.360 808 HG LEU 104 HG LEU 104 -7.937 -43.476 25.992 809 HD11 LEU 104 HD11 LEU 104 -8.016 -43.634 28.457 810 HD12 LEU 104 HD12 LEU 104 -8.107 -41.863 28.569 811 HD13 LEU 104 HD13 LEU 104 -9.441 -42.776 27.828 812 HD21 LEU 104 HD21 LEU 104 -9.268 -41.390 25.803 813 HD22 LEU 104 HD22 LEU 104 -7.928 -40.470 26.520 814 HD23 LEU 104 HD23 LEU 104 -7.729 -41.234 24.931 815 HA PRO 105 HA PRO 105 -1.247 -42.161 25.842 816 HB2 PRO 105 HB2 PRO 105 -0.563 -39.893 27.171 817 HB3 PRO 105 HB3 PRO 105 -1.206 -39.849 25.502 818 HG2 PRO 105 HG2 PRO 105 -2.682 -39.342 28.083 819 HG3 PRO 105 HG3 PRO 105 -2.760 -38.412 26.552 820 HD2 PRO 105 HD2 PRO 105 -4.549 -40.382 27.347 821 HD3 PRO 105 HD3 PRO 105 -4.303 -39.957 25.639 822 H GLU 106 H GLU 106 -3.274 -43.296 27.858 823 HA GLU 106 HA GLU 106 -3.259 -44.375 29.834 824 HB2 GLU 106 HB2 GLU 106 -1.135 -45.225 28.693 825 HB3 GLU 106 HB3 GLU 106 -0.234 -44.194 29.814 826 HG2 GLU 106 HG2 GLU 106 -1.286 -45.400 31.730 827 HG3 GLU 106 HG3 GLU 106 -2.223 -46.379 30.593 828 H GLY 107 H GLY 107 -3.452 -41.478 29.858 829 HA2 GLY 107 HA2 GLY 107 -3.287 -41.081 32.712 830 HA3 GLY 107 HA3 GLY 107 -2.042 -40.153 31.858 831 H TYR 108 H TYR 108 -3.810 -39.803 29.460 832 HA TYR 108 HA TYR 108 -4.994 -38.061 28.631 833 HB2 TYR 108 HB2 TYR 108 -7.358 -38.145 29.201 834 HB3 TYR 108 HB3 TYR 108 -6.642 -39.716 28.894 835 HD1 TYR 108 HD2 TYR 108 -6.299 -41.347 30.669 836 HD2 TYR 108 HD1 TYR 108 -8.220 -37.579 31.434 837 HE1 TYR 108 HE2 TYR 108 -7.183 -42.242 32.811 838 HE2 TYR 108 HE1 TYR 108 -9.119 -38.462 33.571 839 HH TYR 108 HH TYR 108 -9.225 -40.249 35.008 840 H ASP 109 H ASP 109 -7.016 -36.428 29.726 841 HA ASP 109 HA ASP 109 -5.392 -34.331 30.851 842 HB2 ASP 109 HB2 ASP 109 -7.303 -34.056 29.226 843 HB3 ASP 109 HB3 ASP 109 -8.416 -34.498 30.534 844 H ARG 110 H ARG 110 -5.827 -36.867 32.405 845 HA ARG 110 HA ARG 110 -6.434 -37.696 34.411 846 HB2 ARG 110 HB2 ARG 110 -5.481 -36.631 36.277 847 HB3 ARG 110 HB3 ARG 110 -4.413 -36.495 34.876 848 HG2 ARG 110 HG2 ARG 110 -5.034 -34.161 34.561 849 HG3 ARG 110 HG3 ARG 110 -6.260 -34.283 35.857 850 HD2 ARG 110 HD2 ARG 110 -4.489 -34.898 37.450 851 HD3 ARG 110 HD3 ARG 110 -3.280 -34.792 36.158 852 HE ARG 110 HE ARG 110 -4.648 -32.310 36.269 853 HH11 ARG 110 HH11 ARG 110 -2.438 -34.228 38.249 854 HH12 ARG 110 HH12 ARG 110 -1.752 -32.835 39.038 855 HH21 ARG 110 HH21 ARG 110 -3.733 -30.505 37.318 856 HH22 ARG 110 HH22 ARG 110 -2.472 -30.729 38.502 857 H SER 111 H SER 111 -7.303 -36.705 36.822 858 HA SER 111 HA SER 111 -9.945 -35.468 36.293 859 HB2 SER 111 HB2 SER 111 -9.525 -38.133 37.710 860 HB3 SER 111 HB3 SER 111 -11.059 -37.242 37.608 861 HG SER 111 HG SER 111 -10.937 -38.842 35.981 Start of MODEL 5 1 H1 SER 2 H1 SER 2 8.738 -2.359 -1.157 2 H2 SER 2 H2 SER 2 8.604 -2.524 -2.787 3 H3 SER 2 H3 SER 2 9.253 -3.737 -1.888 4 HA SER 2 HA SER 2 7.195 -4.128 -0.782 5 HB2 SER 2 HB2 SER 2 6.147 -1.970 -2.648 6 HB3 SER 2 HB3 SER 2 5.167 -2.966 -1.543 7 HG SER 2 HG SER 2 5.732 -0.944 -0.631 8 H GLN 3 H GLN 3 5.682 -5.652 -1.610 9 HA GLN 3 HA GLN 3 5.654 -6.193 -4.494 10 HB2 GLN 3 HB2 GLN 3 6.436 -8.512 -4.219 11 HB3 GLN 3 HB3 GLN 3 7.699 -7.345 -3.780 12 HG2 GLN 3 HG2 GLN 3 7.211 -7.661 -1.387 13 HG3 GLN 3 HG3 GLN 3 5.896 -8.779 -1.774 14 HE21 GLN 3 HE22 GLN 3 8.514 -9.126 -0.249 15 HE22 GLN 3 HE21 GLN 3 9.271 -10.506 -1.015 16 H PHE 4 H PHE 4 4.214 -8.124 -4.951 17 HA PHE 4 HA PHE 4 2.281 -8.816 -2.836 18 HB2 PHE 4 HB2 PHE 4 1.521 -6.632 -3.768 19 HB3 PHE 4 HB3 PHE 4 1.488 -7.335 -5.375 20 HD1 PHE 4 HD2 PHE 4 -0.033 -9.586 -5.555 21 HD2 PHE 4 HD1 PHE 4 -0.445 -6.495 -2.600 22 HE1 PHE 4 HE2 PHE 4 -2.343 -10.323 -5.127 23 HE2 PHE 4 HE1 PHE 4 -2.812 -7.157 -2.238 24 HZ PHE 4 HZ PHE 4 -3.772 -9.073 -3.507 25 H GLU 5 H GLU 5 3.220 -8.919 -6.291 26 HA GLU 5 HA GLU 5 1.727 -11.440 -6.657 27 HB2 GLU 5 HB2 GLU 5 3.156 -9.574 -8.597 28 HB3 GLU 5 HB3 GLU 5 2.304 -11.063 -9.061 29 HG2 GLU 5 HG2 GLU 5 0.211 -10.186 -8.055 30 HG3 GLU 5 HG3 GLU 5 1.050 -8.673 -7.647 31 H LYS 6 H LYS 6 4.563 -11.029 -5.225 32 HA LYS 6 HA LYS 6 5.714 -13.408 -6.566 33 HB2 LYS 6 HB2 LYS 6 7.005 -10.825 -5.675 34 HB3 LYS 6 HB3 LYS 6 7.931 -12.320 -5.698 35 HG2 LYS 6 HG2 LYS 6 6.374 -11.289 -8.104 36 HG3 LYS 6 HG3 LYS 6 8.088 -10.922 -7.818 37 HD2 LYS 6 HD2 LYS 6 8.687 -13.260 -7.909 38 HD3 LYS 6 HD3 LYS 6 6.991 -13.762 -8.029 39 HE2 LYS 6 HE2 LYS 6 8.351 -11.963 -10.071 40 HE3 LYS 6 HE3 LYS 6 8.271 -13.724 -10.219 41 HZ1 LYS 6 HZ1 LYS 6 5.897 -13.605 -10.185 42 HZ2 LYS 6 HZ2 LYS 6 5.921 -11.957 -10.009 43 HZ3 LYS 6 HZ3 LYS 6 6.481 -12.649 -11.395 44 H GLN 7 H GLN 7 5.290 -11.579 -3.459 45 HA GLN 7 HA GLN 7 6.357 -13.683 -1.855 46 HB2 GLN 7 HB2 GLN 7 5.309 -11.142 -1.441 47 HB3 GLN 7 HB3 GLN 7 4.036 -12.167 -0.771 48 HG2 GLN 7 HG2 GLN 7 7.000 -12.220 -0.084 49 HG3 GLN 7 HG3 GLN 7 5.705 -11.577 0.943 50 HE21 GLN 7 HE22 GLN 7 3.817 -13.332 1.271 51 HE22 GLN 7 HE21 GLN 7 4.389 -14.925 1.689 52 H LYS 8 H LYS 8 3.316 -13.135 -3.489 53 HA LYS 8 HA LYS 8 1.791 -15.228 -2.128 54 HB2 LYS 8 HB2 LYS 8 0.901 -13.049 -2.888 55 HB3 LYS 8 HB3 LYS 8 1.330 -13.446 -4.529 56 HG2 LYS 8 HG2 LYS 8 -0.287 -15.509 -4.192 57 HG3 LYS 8 HG3 LYS 8 -0.881 -14.577 -2.820 58 HD2 LYS 8 HD2 LYS 8 -2.253 -13.773 -4.556 59 HD3 LYS 8 HD3 LYS 8 -0.932 -12.589 -4.572 60 HE2 LYS 8 HE2 LYS 8 -1.161 -13.218 -6.843 61 HE3 LYS 8 HE3 LYS 8 0.250 -14.099 -6.277 62 HZ1 LYS 8 HZ1 LYS 8 -1.254 -15.497 -7.541 63 HZ2 LYS 8 HZ2 LYS 8 -1.133 -16.041 -5.993 64 HZ3 LYS 8 HZ3 LYS 8 -2.472 -15.217 -6.470 65 H GLU 9 H GLU 9 2.993 -14.639 -5.501 66 HA GLU 9 HA GLU 9 2.210 -17.106 -6.579 67 HB2 GLU 9 HB2 GLU 9 2.866 -15.054 -7.802 68 HB3 GLU 9 HB3 GLU 9 4.555 -15.302 -7.300 69 HG2 GLU 9 HG2 GLU 9 4.623 -17.431 -8.490 70 HG3 GLU 9 HG3 GLU 9 2.900 -17.275 -8.898 71 H GLN 10 H GLN 10 5.188 -16.249 -4.731 72 HA GLN 10 HA GLN 10 6.558 -18.688 -5.413 73 HB2 GLN 10 HB2 GLN 10 6.921 -16.615 -3.228 74 HB3 GLN 10 HB3 GLN 10 7.975 -18.038 -3.386 75 HG2 GLN 10 HG2 GLN 10 8.604 -17.430 -5.653 76 HG3 GLN 10 HG3 GLN 10 7.506 -16.049 -5.639 77 HE21 GLN 10 HE22 GLN 10 9.804 -15.156 -6.297 78 HE22 GLN 10 HE21 GLN 10 10.740 -14.503 -4.970 79 H GLY 11 H GLY 11 3.739 -18.347 -3.652 80 HA2 GLY 11 HA2 GLY 11 4.365 -20.795 -2.064 81 HA3 GLY 11 HA3 GLY 11 3.210 -19.581 -1.546 82 H ASN 12 H ASN 12 2.785 -19.687 -4.855 83 HA ASN 12 HA ASN 12 0.349 -21.152 -4.681 84 HB2 ASN 12 HB2 ASN 12 0.058 -20.557 -6.844 85 HB3 ASN 12 HB3 ASN 12 1.400 -19.460 -6.517 86 HD21 ASN 12 HD22 ASN 12 3.508 -20.075 -7.343 87 HD22 ASN 12 HD21 ASN 12 3.634 -21.217 -8.668 88 H SER 13 H SER 13 3.674 -22.085 -5.295 89 HA SER 13 HA SER 13 2.977 -24.771 -6.182 90 HB2 SER 13 HB2 SER 13 5.039 -23.624 -6.954 91 HB3 SER 13 HB3 SER 13 5.636 -23.571 -5.283 92 HG SER 13 HG SER 13 6.448 -25.366 -6.485 93 H LEU 14 H LEU 14 4.002 -23.184 -3.123 94 HA LEU 14 HA LEU 14 4.377 -25.526 -1.574 95 HB2 LEU 14 HB2 LEU 14 3.333 -22.747 -0.855 96 HB3 LEU 14 HB3 LEU 14 3.890 -23.936 0.293 97 HG LEU 14 HG LEU 14 5.595 -22.625 -1.846 98 HD11 LEU 14 HD11 LEU 14 5.571 -22.399 1.201 99 HD12 LEU 14 HD12 LEU 14 6.706 -21.583 0.111 100 HD13 LEU 14 HD13 LEU 14 4.978 -21.170 0.070 101 HD21 LEU 14 HD21 LEU 14 6.310 -24.658 0.310 102 HD22 LEU 14 HD22 LEU 14 6.387 -24.902 -1.453 103 HD23 LEU 14 HD23 LEU 14 7.485 -23.754 -0.672 104 H PHE 15 H PHE 15 1.485 -23.670 -2.485 105 HA PHE 15 HA PHE 15 -0.395 -25.063 -0.834 106 HB2 PHE 15 HB2 PHE 15 -0.930 -22.926 -1.776 107 HB3 PHE 15 HB3 PHE 15 -0.538 -23.460 -3.403 108 HD1 PHE 15 HD1 PHE 15 -2.849 -24.462 -0.606 109 HD2 PHE 15 HD2 PHE 15 -2.230 -23.949 -4.818 110 HE1 PHE 15 HE1 PHE 15 -5.226 -25.061 -1.018 111 HE2 PHE 15 HE2 PHE 15 -4.633 -24.498 -5.243 112 HZ PHE 15 HZ PHE 15 -6.119 -25.058 -3.343 113 H LYS 16 H LYS 16 1.368 -26.069 -3.616 114 HA LYS 16 HA LYS 16 -0.635 -28.193 -4.198 115 HB2 LYS 16 HB2 LYS 16 1.608 -27.056 -5.907 116 HB3 LYS 16 HB3 LYS 16 0.480 -28.347 -6.402 117 HG2 LYS 16 HG2 LYS 16 -1.429 -26.844 -6.200 118 HG3 LYS 16 HG3 LYS 16 -0.423 -25.579 -5.488 119 HD2 LYS 16 HD2 LYS 16 0.929 -25.523 -7.623 120 HD3 LYS 16 HD3 LYS 16 -0.297 -26.594 -8.339 121 HE2 LYS 16 HE2 LYS 16 -2.059 -24.935 -7.725 122 HE3 LYS 16 HE3 LYS 16 -0.802 -23.867 -7.060 123 HZ1 LYS 16 HZ1 LYS 16 -1.414 -23.270 -9.310 124 HZ2 LYS 16 HZ2 LYS 16 0.165 -23.703 -9.220 125 HZ3 LYS 16 HZ3 LYS 16 -0.942 -24.745 -9.869 126 H GLN 17 H GLN 17 2.228 -27.676 -2.500 127 HA GLN 17 HA GLN 17 3.430 -30.299 -3.000 128 HB2 GLN 17 HB2 GLN 17 3.958 -28.158 -0.926 129 HB3 GLN 17 HB3 GLN 17 4.830 -29.694 -1.039 130 HG2 GLN 17 HG2 GLN 17 5.232 -29.063 -3.534 131 HG3 GLN 17 HG3 GLN 17 4.810 -27.424 -3.017 132 HE21 GLN 17 HE22 GLN 17 5.879 -27.160 -0.537 133 HE22 GLN 17 HE21 GLN 17 7.610 -27.388 -0.592 134 H GLY 18 H GLY 18 0.752 -29.133 -1.117 135 HA2 GLY 18 HA2 GLY 18 -0.745 -30.518 0.011 136 HA3 GLY 18 HA3 GLY 18 0.457 -31.812 0.074 137 H LEU 19 H LEU 19 1.214 -28.500 1.066 138 HA LEU 19 HA LEU 19 1.022 -29.232 3.928 139 HB2 LEU 19 HB2 LEU 19 3.267 -28.099 4.247 140 HB3 LEU 19 HB3 LEU 19 3.251 -29.711 3.542 141 HG LEU 19 HG LEU 19 3.567 -28.803 1.288 142 HD11 LEU 19 HD11 LEU 19 3.842 -26.119 2.709 143 HD12 LEU 19 HD12 LEU 19 4.228 -26.432 1.003 144 HD13 LEU 19 HD13 LEU 19 2.552 -26.567 1.571 145 HD21 LEU 19 HD21 LEU 19 5.466 -29.462 2.716 146 HD22 LEU 19 HD22 LEU 19 5.905 -28.112 1.644 147 HD23 LEU 19 HD23 LEU 19 5.560 -27.807 3.361 148 H TYR 20 H TYR 20 -0.905 -27.980 2.761 149 HA TYR 20 HA TYR 20 -0.985 -25.410 1.998 150 HB2 TYR 20 HB2 TYR 20 -2.995 -26.633 3.895 151 HB3 TYR 20 HB3 TYR 20 -3.320 -25.446 2.652 152 HD1 TYR 20 HD2 TYR 20 -2.048 -26.531 0.251 153 HD2 TYR 20 HD1 TYR 20 -4.101 -28.576 3.429 154 HE1 TYR 20 HE2 TYR 20 -2.624 -28.377 -1.297 155 HE2 TYR 20 HE1 TYR 20 -4.691 -30.411 1.883 156 HH TYR 20 HH TYR 20 -4.491 -31.259 -0.245 157 H ARG 21 H ARG 21 -0.407 -26.349 5.398 158 HA ARG 21 HA ARG 21 -1.425 -23.995 6.582 159 HB2 ARG 21 HB2 ARG 21 -0.168 -26.360 7.435 160 HB3 ARG 21 HB3 ARG 21 0.963 -25.089 7.917 161 HG2 ARG 21 HG2 ARG 21 -2.000 -25.270 8.608 162 HG3 ARG 21 HG3 ARG 21 -0.639 -25.546 9.707 163 HD2 ARG 21 HD2 ARG 21 0.082 -23.193 9.434 164 HD3 ARG 21 HD3 ARG 21 -1.272 -22.897 8.326 165 HE ARG 21 HE ARG 21 -1.374 -23.079 11.240 166 HH11 ARG 21 HH11 ARG 21 -3.255 -23.365 8.257 167 HH12 ARG 21 HH12 ARG 21 -4.793 -23.106 9.062 168 HH21 ARG 21 HH21 ARG 21 -3.402 -22.703 12.240 169 HH22 ARG 21 HH22 ARG 21 -4.861 -22.706 11.277 170 H GLU 22 H GLU 22 1.588 -24.580 4.858 171 HA GLU 22 HA GLU 22 2.904 -22.133 5.734 172 HB2 GLU 22 HB2 GLU 22 3.285 -23.835 3.237 173 HB3 GLU 22 HB3 GLU 22 4.447 -22.669 3.883 174 HG2 GLU 22 HG2 GLU 22 3.496 -25.154 5.388 175 HG3 GLU 22 HG3 GLU 22 4.912 -25.083 4.343 176 H ALA 23 H ALA 23 0.944 -23.268 3.027 177 HA ALA 23 HA ALA 23 1.215 -20.996 1.329 178 HB1 ALA 23 HB1 ALA 23 0.611 -23.246 0.584 179 HB2 ALA 23 HB2 ALA 23 -0.943 -23.118 1.448 180 HB3 ALA 23 HB3 ALA 23 -0.593 -22.028 0.083 181 H VAL 24 H VAL 24 -0.743 -21.402 4.205 182 HA VAL 24 HA VAL 24 -2.813 -19.471 3.435 183 HB VAL 24 HB VAL 24 -1.748 -20.359 6.176 184 HG11 VAL 24 HG11 VAL 24 -3.002 -18.231 6.294 185 HG12 VAL 24 HG12 VAL 24 -4.348 -18.953 5.377 186 HG13 VAL 24 HG13 VAL 24 -3.956 -19.543 7.012 187 HG21 VAL 24 HG21 VAL 24 -3.785 -21.807 6.243 188 HG22 VAL 24 HG22 VAL 24 -4.196 -21.323 4.582 189 HG23 VAL 24 HG23 VAL 24 -2.716 -22.261 4.912 190 H HIS 25 H HIS 25 0.122 -19.718 5.203 191 HA HIS 25 HA HIS 25 0.494 -17.045 6.128 192 HB2 HIS 25 HB2 HIS 25 1.507 -19.759 6.334 193 HB3 HIS 25 HB3 HIS 25 2.819 -18.691 6.087 194 HD2 HIS 25 HD2 HIS 25 3.567 -17.308 8.301 195 HE1 HIS 25 HE1 HIS 25 0.222 -18.281 10.757 196 HE2 HIS 25 HE2 HIS 25 2.511 -17.144 10.706 197 H CYS 26 H CYS 26 0.441 -17.973 3.056 198 HA CYS 26 HA CYS 26 2.755 -16.284 2.226 199 HB2 CYS 26 HB2 CYS 26 1.598 -18.807 0.980 200 HB3 CYS 26 HB3 CYS 26 2.633 -17.662 0.114 201 HG CYS 26 HG CYS 26 3.219 -19.239 2.964 202 H TYR 27 H TYR 27 -0.570 -16.440 2.392 203 HA TYR 27 HA TYR 27 -0.844 -14.545 0.090 204 HB2 TYR 27 HB2 TYR 27 -3.002 -16.323 1.235 205 HB3 TYR 27 HB3 TYR 27 -3.108 -15.331 -0.214 206 HD1 TYR 27 HD1 TYR 27 -0.432 -16.168 -1.502 207 HD2 TYR 27 HD2 TYR 27 -3.558 -18.387 0.432 208 HE1 TYR 27 HE1 TYR 27 0.156 -18.162 -2.843 209 HE2 TYR 27 HE2 TYR 27 -2.970 -20.398 -0.902 210 HH TYR 27 HH TYR 27 -1.616 -21.262 -2.539 211 H ASP 28 H ASP 28 -1.080 -14.996 3.488 212 HA ASP 28 HA ASP 28 -3.311 -13.286 4.071 213 HB2 ASP 28 HB2 ASP 28 -2.222 -15.015 5.543 214 HB3 ASP 28 HB3 ASP 28 -0.852 -13.924 5.764 215 H GLN 29 H GLN 29 0.069 -12.652 3.275 216 HA GLN 29 HA GLN 29 0.215 -10.095 4.577 217 HB2 GLN 29 HB2 GLN 29 2.314 -9.858 3.587 218 HB3 GLN 29 HB3 GLN 29 2.158 -11.577 3.958 219 HG2 GLN 29 HG2 GLN 29 1.574 -10.324 1.273 220 HG3 GLN 29 HG3 GLN 29 3.140 -11.018 1.693 221 HE21 GLN 29 HE22 GLN 29 1.542 -11.825 -0.520 222 HE22 GLN 29 HE21 GLN 29 1.057 -13.484 -0.288 223 H LEU 30 H LEU 30 -1.520 -11.070 1.847 224 HA LEU 30 HA LEU 30 -1.231 -8.561 0.343 225 HB2 LEU 30 HB2 LEU 30 -3.180 -10.893 0.080 226 HB3 LEU 30 HB3 LEU 30 -2.845 -9.653 -1.145 227 HG LEU 30 HG LEU 30 -0.938 -11.765 -0.063 228 HD11 LEU 30 HD11 LEU 30 -1.019 -12.527 -2.406 229 HD12 LEU 30 HD12 LEU 30 -2.578 -12.655 -1.593 230 HD13 LEU 30 HD13 LEU 30 -2.279 -11.338 -2.754 231 HD21 LEU 30 HD21 LEU 30 0.346 -9.729 -0.513 232 HD22 LEU 30 HD22 LEU 30 0.648 -10.916 -1.800 233 HD23 LEU 30 HD23 LEU 30 -0.446 -9.564 -2.094 234 H ILE 31 H ILE 31 -3.444 -10.070 2.629 235 HA ILE 31 HA ILE 31 -5.555 -8.151 2.238 236 HB ILE 31 HB ILE 31 -4.908 -10.206 4.380 237 HG12 ILE 31 HG12 ILE 31 -7.242 -10.729 2.668 238 HG13 ILE 31 HG13 ILE 31 -5.800 -10.521 1.715 239 HG21 ILE 31 HG21 ILE 31 -7.440 -8.582 3.953 240 HG22 ILE 31 HG22 ILE 31 -7.345 -10.042 4.980 241 HG23 ILE 31 HG23 ILE 31 -6.396 -8.607 5.391 242 HD11 ILE 31 HD11 ILE 31 -4.647 -12.237 2.984 243 HD12 ILE 31 HD12 ILE 31 -6.029 -12.381 4.106 244 HD13 ILE 31 HD13 ILE 31 -6.209 -12.873 2.406 245 H THR 32 H THR 32 -2.510 -7.935 3.566 246 HA THR 32 HA THR 32 -3.300 -5.655 5.339 247 HB THR 32 HB THR 32 -0.907 -7.512 5.559 248 HG1 THR 32 HG1 THR 32 -2.008 -8.248 7.389 249 HG21 THR 32 HG21 THR 32 -0.379 -5.275 6.418 250 HG22 THR 32 HG22 THR 32 -1.900 -5.247 7.345 251 HG23 THR 32 HG23 THR 32 -0.605 -6.396 7.770 252 H ALA 33 H ALA 33 -1.141 -6.782 2.698 253 HA ALA 33 HA ALA 33 0.437 -4.346 2.684 254 HB1 ALA 33 HB1 ALA 33 1.301 -6.456 1.763 255 HB2 ALA 33 HB2 ALA 33 -0.014 -6.493 0.567 256 HB3 ALA 33 HB3 ALA 33 1.210 -5.219 0.494 257 H GLN 34 H GLN 34 -2.547 -5.477 1.137 258 HA GLN 34 HA GLN 34 -3.568 -2.939 0.563 259 HB2 GLN 34 HB2 GLN 34 -3.366 -2.927 -1.942 260 HB3 GLN 34 HB3 GLN 34 -1.922 -2.513 -1.040 261 HG2 GLN 34 HG2 GLN 34 -1.390 -5.106 -1.322 262 HG3 GLN 34 HG3 GLN 34 -2.500 -4.949 -2.687 263 HE21 GLN 34 HE22 GLN 34 0.411 -3.522 -1.159 264 HE22 GLN 34 HE21 GLN 34 1.166 -3.000 -2.645 265 HA PRO 35 HA PRO 35 -6.328 -6.624 0.519 266 HB2 PRO 35 HB2 PRO 35 -8.314 -5.480 2.042 267 HB3 PRO 35 HB3 PRO 35 -6.870 -6.304 2.701 268 HG2 PRO 35 HG2 PRO 35 -7.295 -3.338 2.271 269 HG3 PRO 35 HG3 PRO 35 -6.666 -4.161 3.730 270 HD2 PRO 35 HD2 PRO 35 -5.013 -3.031 1.906 271 HD3 PRO 35 HD3 PRO 35 -4.578 -4.590 2.677 272 H GLN 36 H GLN 36 -6.364 -3.522 -0.828 273 HA GLN 36 HA GLN 36 -9.029 -3.284 -1.754 274 HB2 GLN 36 HB2 GLN 36 -8.169 -1.565 -3.209 275 HB3 GLN 36 HB3 GLN 36 -7.418 -1.430 -1.608 276 HG2 GLN 36 HG2 GLN 36 -5.443 -2.676 -2.460 277 HG3 GLN 36 HG3 GLN 36 -6.168 -2.714 -4.074 278 HE21 GLN 36 HE22 GLN 36 -3.674 -1.611 -3.831 279 HE22 GLN 36 HE21 GLN 36 -3.763 0.132 -3.982 280 H ASN 37 H ASN 37 -7.236 -5.875 -2.385 281 HA ASN 37 HA ASN 37 -8.296 -6.151 -5.145 282 HB2 ASN 37 HB2 ASN 37 -5.529 -6.895 -4.133 283 HB3 ASN 37 HB3 ASN 37 -6.197 -7.438 -5.680 284 HD21 ASN 37 HD22 ASN 37 -4.267 -5.142 -4.250 285 HD22 ASN 37 HD21 ASN 37 -4.359 -3.895 -5.487 286 HA PRO 38 HA PRO 38 -10.036 -9.784 -3.299 287 HB2 PRO 38 HB2 PRO 38 -10.994 -11.004 -5.500 288 HB3 PRO 38 HB3 PRO 38 -11.595 -9.405 -4.997 289 HG2 PRO 38 HG2 PRO 38 -9.408 -9.927 -7.036 290 HG3 PRO 38 HG3 PRO 38 -10.935 -8.993 -7.271 291 HD2 PRO 38 HD2 PRO 38 -8.707 -7.659 -6.551 292 HD3 PRO 38 HD3 PRO 38 -10.243 -7.310 -5.781 293 H VAL 39 H VAL 39 -7.219 -9.839 -5.341 294 HA VAL 39 HA VAL 39 -6.954 -12.650 -5.762 295 HB VAL 39 HB VAL 39 -4.713 -10.619 -5.362 296 HG11 VAL 39 HG11 VAL 39 -4.902 -13.193 -6.992 297 HG12 VAL 39 HG12 VAL 39 -3.486 -12.115 -6.889 298 HG13 VAL 39 HG13 VAL 39 -4.030 -13.003 -5.456 299 HG21 VAL 39 HG21 VAL 39 -6.287 -9.726 -7.010 300 HG22 VAL 39 HG22 VAL 39 -4.828 -10.301 -7.824 301 HG23 VAL 39 HG23 VAL 39 -6.298 -11.284 -7.876 302 H GLY 40 H GLY 40 -5.974 -10.479 -3.100 303 HA2 GLY 40 HA2 GLY 40 -4.625 -12.221 -1.359 304 HA3 GLY 40 HA3 GLY 40 -5.624 -10.851 -0.877 305 H TYR 41 H TYR 41 -7.976 -12.230 -2.308 306 HA TYR 41 HA TYR 41 -8.594 -14.180 -0.150 307 HB2 TYR 41 HB2 TYR 41 -10.689 -12.589 -1.600 308 HB3 TYR 41 HB3 TYR 41 -10.809 -13.388 -0.107 309 HD1 TYR 41 HD2 TYR 41 -9.128 -10.427 -1.638 310 HD2 TYR 41 HD1 TYR 41 -10.545 -12.306 1.949 311 HE1 TYR 41 HE2 TYR 41 -8.762 -8.315 -0.394 312 HE2 TYR 41 HE1 TYR 41 -10.168 -10.198 3.206 313 HH TYR 41 HH TYR 41 -9.520 -8.015 3.102 314 H SER 42 H SER 42 -7.402 -14.569 -2.912 315 HA SER 42 HA SER 42 -9.554 -16.299 -4.037 316 HB2 SER 42 HB2 SER 42 -9.096 -14.258 -5.407 317 HB3 SER 42 HB3 SER 42 -7.412 -14.811 -5.591 318 HG SER 42 HG SER 42 -8.670 -15.490 -7.344 319 H ASN 43 H ASN 43 -6.599 -16.235 -2.475 320 HA ASN 43 HA ASN 43 -6.017 -18.990 -3.436 321 HB2 ASN 43 HB2 ASN 43 -4.032 -16.780 -2.739 322 HB3 ASN 43 HB3 ASN 43 -3.626 -18.464 -3.073 323 HD21 ASN 43 HD22 ASN 43 -4.535 -19.342 -5.251 324 HD22 ASN 43 HD21 ASN 43 -4.360 -18.262 -6.611 325 H LYS 44 H LYS 44 -5.904 -16.598 -0.731 326 HA LYS 44 HA LYS 44 -5.393 -18.599 1.301 327 HB2 LYS 44 HB2 LYS 44 -5.088 -16.128 1.541 328 HB3 LYS 44 HB3 LYS 44 -6.809 -15.904 1.399 329 HG2 LYS 44 HG2 LYS 44 -7.168 -17.301 3.433 330 HG3 LYS 44 HG3 LYS 44 -5.405 -17.521 3.573 331 HD2 LYS 44 HD2 LYS 44 -5.117 -15.080 3.863 332 HD3 LYS 44 HD3 LYS 44 -6.858 -14.838 3.642 333 HE2 LYS 44 HE2 LYS 44 -7.306 -16.260 5.628 334 HE3 LYS 44 HE3 LYS 44 -5.561 -16.463 5.871 335 HZ1 LYS 44 HZ1 LYS 44 -6.491 -14.732 7.252 336 HZ2 LYS 44 HZ2 LYS 44 -5.395 -14.094 6.208 337 HZ3 LYS 44 HZ3 LYS 44 -7.010 -13.895 5.929 338 H ALA 45 H ALA 45 -8.228 -17.088 -0.142 339 HA ALA 45 HA ALA 45 -10.230 -18.524 1.320 340 HB1 ALA 45 HB1 ALA 45 -11.752 -17.614 -0.359 341 HB2 ALA 45 HB2 ALA 45 -10.557 -16.354 0.046 342 HB3 ALA 45 HB3 ALA 45 -10.397 -17.296 -1.459 343 H MET 46 H MET 46 -7.933 -19.872 -0.592 344 HA MET 46 HA MET 46 -9.703 -22.108 -1.424 345 HB2 MET 46 HB2 MET 46 -8.997 -20.410 -3.285 346 HB3 MET 46 HB3 MET 46 -7.393 -21.150 -3.141 347 HG2 MET 46 HG2 MET 46 -8.463 -23.383 -3.556 348 HG3 MET 46 HG3 MET 46 -10.015 -22.572 -3.785 349 HE1 MET 46 HE1 MET 46 -9.230 -19.945 -5.417 350 HE2 MET 46 HE2 MET 46 -9.495 -20.547 -7.066 351 HE3 MET 46 HE3 MET 46 -10.616 -21.008 -5.761 352 H ALA 47 H ALA 47 -7.273 -21.144 0.548 353 HA ALA 47 HA ALA 47 -6.039 -23.855 0.473 354 HB1 ALA 47 HB1 ALA 47 -4.757 -21.244 1.346 355 HB2 ALA 47 HB2 ALA 47 -3.995 -22.849 1.399 356 HB3 ALA 47 HB3 ALA 47 -4.424 -22.123 -0.166 357 H LEU 48 H LEU 48 -7.723 -21.420 2.374 358 HA LEU 48 HA LEU 48 -7.334 -22.743 4.935 359 HB2 LEU 48 HB2 LEU 48 -9.412 -20.826 3.798 360 HB3 LEU 48 HB3 LEU 48 -9.493 -21.446 5.454 361 HG LEU 48 HG LEU 48 -7.117 -19.898 4.337 362 HD11 LEU 48 HD11 LEU 48 -9.140 -18.496 4.451 363 HD12 LEU 48 HD12 LEU 48 -9.447 -19.054 6.109 364 HD13 LEU 48 HD13 LEU 48 -8.014 -18.060 5.753 365 HD21 LEU 48 HD21 LEU 48 -6.556 -19.688 6.762 366 HD22 LEU 48 HD22 LEU 48 -7.910 -20.769 7.156 367 HD23 LEU 48 HD23 LEU 48 -6.520 -21.370 6.225 368 H ILE 49 H ILE 49 -9.642 -22.992 2.212 369 HA ILE 49 HA ILE 49 -11.435 -24.827 3.417 370 HB ILE 49 HB ILE 49 -11.983 -25.485 1.098 371 HG12 ILE 49 HG12 ILE 49 -9.976 -23.415 0.248 372 HG13 ILE 49 HG13 ILE 49 -9.474 -25.078 0.389 373 HG21 ILE 49 HG21 ILE 49 -13.016 -23.483 2.150 374 HG22 ILE 49 HG22 ILE 49 -11.698 -22.476 1.517 375 HG23 ILE 49 HG23 ILE 49 -12.813 -23.274 0.399 376 HD11 ILE 49 HD11 ILE 49 -11.119 -25.893 -1.118 377 HD12 ILE 49 HD12 ILE 49 -11.735 -24.224 -1.391 378 HD13 ILE 49 HD13 ILE 49 -10.089 -24.676 -1.899 379 H LYS 50 H LYS 50 -8.212 -25.141 2.167 380 HA LYS 50 HA LYS 50 -8.461 -27.887 1.376 381 HB2 LYS 50 HB2 LYS 50 -6.788 -25.767 0.765 382 HB3 LYS 50 HB3 LYS 50 -5.747 -26.768 1.770 383 HG2 LYS 50 HG2 LYS 50 -5.336 -27.597 -0.348 384 HG3 LYS 50 HG3 LYS 50 -6.595 -28.725 0.183 385 HD2 LYS 50 HD2 LYS 50 -6.999 -26.206 -1.491 386 HD3 LYS 50 HD3 LYS 50 -6.879 -27.836 -2.164 387 HE2 LYS 50 HE2 LYS 50 -8.984 -26.943 -0.171 388 HE3 LYS 50 HE3 LYS 50 -9.211 -26.922 -1.928 389 HZ1 LYS 50 HZ1 LYS 50 -8.630 -29.338 -0.330 390 HZ2 LYS 50 HZ2 LYS 50 -10.093 -28.930 -0.965 391 HZ3 LYS 50 HZ3 LYS 50 -8.836 -29.292 -1.959 392 H LEU 51 H LEU 51 -8.279 -26.452 4.361 393 HA LEU 51 HA LEU 51 -6.738 -28.674 5.629 394 HB2 LEU 51 HB2 LEU 51 -6.881 -25.703 6.268 395 HB3 LEU 51 HB3 LEU 51 -6.243 -26.893 7.410 396 HG LEU 51 HG LEU 51 -5.128 -26.561 4.612 397 HD11 LEU 51 HD11 LEU 51 -3.309 -25.294 5.735 398 HD12 LEU 51 HD12 LEU 51 -4.867 -24.475 5.905 399 HD13 LEU 51 HD13 LEU 51 -4.192 -25.397 7.272 400 HD21 LEU 51 HD21 LEU 51 -4.131 -27.923 7.153 401 HD22 LEU 51 HD22 LEU 51 -4.656 -28.738 5.664 402 HD23 LEU 51 HD23 LEU 51 -3.181 -27.754 5.668 403 H GLY 52 H GLY 52 -9.773 -27.139 5.300 404 HA2 GLY 52 HA2 GLY 52 -11.698 -28.120 6.312 405 HA3 GLY 52 HA3 GLY 52 -10.748 -28.508 7.755 406 H GLU 53 H GLU 53 -9.756 -25.436 6.960 407 HA GLU 53 HA GLU 53 -11.417 -24.249 9.036 408 HB2 GLU 53 HB2 GLU 53 -9.199 -23.094 7.289 409 HB3 GLU 53 HB3 GLU 53 -10.021 -22.237 8.604 410 HG2 GLU 53 HG2 GLU 53 -9.352 -24.122 10.159 411 HG3 GLU 53 HG3 GLU 53 -8.322 -24.744 8.842 412 H TYR 54 H TYR 54 -13.122 -25.046 7.005 413 HA TYR 54 HA TYR 54 -13.651 -23.193 4.965 414 HB2 TYR 54 HB2 TYR 54 -15.620 -24.825 6.616 415 HB3 TYR 54 HB3 TYR 54 -15.946 -24.106 5.033 416 HD1 TYR 54 HD1 TYR 54 -14.471 -24.877 3.054 417 HD2 TYR 54 HD2 TYR 54 -14.781 -27.013 6.777 418 HE1 TYR 54 HE1 TYR 54 -13.656 -26.941 1.929 419 HE2 TYR 54 HE2 TYR 54 -13.981 -29.076 5.662 420 HH TYR 54 HH TYR 54 -13.131 -29.165 2.176 421 H THR 55 H THR 55 -14.387 -23.088 8.432 422 HA THR 55 HA THR 55 -16.329 -21.025 8.415 423 HB THR 55 HB THR 55 -14.233 -21.740 10.490 424 HG1 THR 55 HG1 THR 55 -15.889 -23.031 11.319 425 HG21 THR 55 HG21 THR 55 -15.320 -19.568 10.963 426 HG22 THR 55 HG22 THR 55 -16.918 -20.305 10.732 427 HG23 THR 55 HG23 THR 55 -15.885 -20.805 12.105 428 H GLN 56 H GLN 56 -12.749 -20.929 8.326 429 HA GLN 56 HA GLN 56 -12.686 -18.002 8.567 430 HB2 GLN 56 HB2 GLN 56 -10.595 -20.149 8.151 431 HB3 GLN 56 HB3 GLN 56 -10.249 -18.418 8.075 432 HG2 GLN 56 HG2 GLN 56 -9.746 -19.112 10.262 433 HG3 GLN 56 HG3 GLN 56 -11.195 -18.114 10.357 434 HE21 GLN 56 HE22 GLN 56 -9.878 -21.412 10.603 435 HE22 GLN 56 HE21 GLN 56 -11.267 -22.097 11.429 436 H ALA 57 H ALA 57 -13.075 -20.379 6.012 437 HA ALA 57 HA ALA 57 -11.670 -18.825 3.989 438 HB1 ALA 57 HB1 ALA 57 -11.864 -21.297 3.902 439 HB2 ALA 57 HB2 ALA 57 -13.630 -21.150 3.756 440 HB3 ALA 57 HB3 ALA 57 -12.581 -20.532 2.463 441 H ILE 58 H ILE 58 -15.095 -19.422 4.902 442 HA ILE 58 HA ILE 58 -16.305 -17.891 2.791 443 HB ILE 58 HB ILE 58 -17.191 -18.472 5.672 444 HG12 ILE 58 HG12 ILE 58 -17.814 -20.001 3.126 445 HG13 ILE 58 HG13 ILE 58 -16.600 -20.503 4.309 446 HG21 ILE 58 HG21 ILE 58 -18.871 -17.900 3.218 447 HG22 ILE 58 HG22 ILE 58 -19.470 -18.165 4.861 448 HG23 ILE 58 HG23 ILE 58 -18.521 -16.707 4.506 449 HD11 ILE 58 HD11 ILE 58 -18.373 -20.481 6.077 450 HD12 ILE 58 HD12 ILE 58 -19.589 -20.221 4.785 451 HD13 ILE 58 HD13 ILE 58 -18.623 -21.710 4.821 452 H GLN 59 H GLN 59 -14.984 -17.082 6.011 453 HA GLN 59 HA GLN 59 -15.962 -14.387 6.069 454 HB2 GLN 59 HB2 GLN 59 -13.700 -15.804 7.541 455 HB3 GLN 59 HB3 GLN 59 -14.240 -14.151 7.909 456 HG2 GLN 59 HG2 GLN 59 -16.494 -14.956 8.423 457 HG3 GLN 59 HG3 GLN 59 -16.053 -16.608 7.982 458 HE21 GLN 59 HE22 GLN 59 -17.120 -16.292 10.442 459 HE22 GLN 59 HE21 GLN 59 -15.889 -16.411 11.682 460 H MET 60 H MET 60 -13.670 -15.789 4.046 461 HA MET 60 HA MET 60 -12.326 -13.167 3.616 462 HB2 MET 60 HB2 MET 60 -11.481 -15.987 2.848 463 HB3 MET 60 HB3 MET 60 -10.566 -14.530 2.449 464 HG2 MET 60 HG2 MET 60 -11.219 -15.166 5.330 465 HG3 MET 60 HG3 MET 60 -9.935 -16.029 4.505 466 HE1 MET 60 HE1 MET 60 -9.878 -11.506 5.425 467 HE2 MET 60 HE2 MET 60 -10.782 -12.100 4.031 468 HE3 MET 60 HE3 MET 60 -11.267 -12.619 5.664 469 H CYS 61 H CYS 61 -14.271 -15.790 2.169 470 HA CYS 61 HA CYS 61 -13.948 -14.936 -0.530 471 HB2 CYS 61 HB2 CYS 61 -16.237 -16.401 0.898 472 HB3 CYS 61 HB3 CYS 61 -16.120 -16.210 -0.852 473 HG CYS 61 HG CYS 61 -15.407 -18.638 -0.177 474 H GLN 62 H GLN 62 -16.415 -14.054 2.011 475 HA GLN 62 HA GLN 62 -17.812 -12.269 0.222 476 HB2 GLN 62 HB2 GLN 62 -17.702 -12.304 3.266 477 HB3 GLN 62 HB3 GLN 62 -18.953 -11.544 2.251 478 HG2 GLN 62 HG2 GLN 62 -19.656 -13.746 1.414 479 HG3 GLN 62 HG3 GLN 62 -18.355 -14.528 2.319 480 HE21 GLN 62 HE22 GLN 62 -19.808 -15.799 3.447 481 HE22 GLN 62 HE21 GLN 62 -20.877 -15.136 4.645 482 H GLN 63 H GLN 63 -14.770 -11.996 1.853 483 HA GLN 63 HA GLN 63 -14.953 -9.048 2.064 484 HB2 GLN 63 HB2 GLN 63 -12.726 -11.038 2.657 485 HB3 GLN 63 HB3 GLN 63 -12.604 -9.297 2.928 486 HG2 GLN 63 HG2 GLN 63 -14.727 -11.046 4.246 487 HG3 GLN 63 HG3 GLN 63 -13.153 -10.699 4.951 488 HE21 GLN 63 HE22 GLN 63 -14.430 -9.833 6.737 489 HE22 GLN 63 HE21 GLN 63 -14.951 -8.167 6.650 490 H GLY 64 H GLY 64 -13.679 -11.557 -0.100 491 HA2 GLY 64 HA2 GLY 64 -11.945 -9.656 -1.510 492 HA3 GLY 64 HA3 GLY 64 -12.261 -11.347 -1.930 493 H LEU 65 H LEU 65 -15.190 -11.104 -1.867 494 HA LEU 65 HA LEU 65 -15.664 -10.212 -4.533 495 HB2 LEU 65 HB2 LEU 65 -17.431 -10.951 -2.173 496 HB3 LEU 65 HB3 LEU 65 -18.121 -10.459 -3.726 497 HG LEU 65 HG LEU 65 -16.078 -12.720 -3.520 498 HD11 LEU 65 HD11 LEU 65 -17.987 -14.254 -3.584 499 HD12 LEU 65 HD12 LEU 65 -18.051 -13.251 -2.130 500 HD13 LEU 65 HD13 LEU 65 -19.114 -12.869 -3.504 501 HD21 LEU 65 HD21 LEU 65 -18.154 -11.952 -5.612 502 HD22 LEU 65 HD22 LEU 65 -16.387 -11.728 -5.755 503 HD23 LEU 65 HD23 LEU 65 -17.068 -13.366 -5.675 504 H ARG 66 H ARG 66 -15.045 -8.351 -1.817 505 HA ARG 66 HA ARG 66 -16.746 -6.062 -2.513 506 HB2 ARG 66 HB2 ARG 66 -14.387 -6.312 -0.596 507 HB3 ARG 66 HB3 ARG 66 -15.564 -4.993 -0.659 508 HG2 ARG 66 HG2 ARG 66 -17.364 -6.540 0.011 509 HG3 ARG 66 HG3 ARG 66 -16.214 -7.887 0.011 510 HD2 ARG 66 HD2 ARG 66 -16.533 -7.114 2.291 511 HD3 ARG 66 HD3 ARG 66 -14.876 -6.740 1.761 512 HE ARG 66 HE ARG 66 -16.598 -4.513 1.240 513 HH11 ARG 66 HH11 ARG 66 -15.025 -6.227 3.901 514 HH12 ARG 66 HH12 ARG 66 -14.938 -4.804 4.917 515 HH21 ARG 66 HH21 ARG 66 -16.468 -2.677 2.577 516 HH22 ARG 66 HH22 ARG 66 -15.748 -2.798 4.163 517 H TYR 67 H TYR 67 -14.129 -7.433 -3.985 518 HA TYR 67 HA TYR 67 -12.860 -4.842 -4.735 519 HB2 TYR 67 HB2 TYR 67 -11.502 -7.375 -3.799 520 HB3 TYR 67 HB3 TYR 67 -10.649 -5.984 -4.446 521 HD1 TYR 67 HD1 TYR 67 -11.335 -3.647 -3.231 522 HD2 TYR 67 HD2 TYR 67 -11.641 -7.576 -1.508 523 HE1 TYR 67 HE1 TYR 67 -11.378 -2.652 -0.964 524 HE2 TYR 67 HE2 TYR 67 -11.665 -6.589 0.767 525 HH TYR 67 HH TYR 67 -11.492 -3.034 1.292 526 H THR 68 H THR 68 -14.444 -7.601 -5.775 527 HA THR 68 HA THR 68 -12.926 -7.943 -8.257 528 HB THR 68 HB THR 68 -14.811 -9.564 -8.749 529 HG1 THR 68 HG1 THR 68 -16.394 -8.644 -7.417 530 HG21 THR 68 HG21 THR 68 -13.365 -9.880 -6.097 531 HG22 THR 68 HG22 THR 68 -14.004 -11.192 -7.102 532 HG23 THR 68 HG23 THR 68 -12.653 -10.201 -7.698 533 H SER 69 H SER 69 -14.381 -5.351 -7.445 534 HA SER 69 HA SER 69 -16.641 -5.006 -9.150 535 HB2 SER 69 HB2 SER 69 -14.777 -2.946 -7.911 536 HB3 SER 69 HB3 SER 69 -16.429 -2.658 -8.503 537 HG SER 69 HG SER 69 -17.169 -4.112 -6.900 538 H THR 70 H THR 70 -13.825 -5.804 -10.441 539 HA THR 70 HA THR 70 -14.121 -3.868 -12.679 540 HB THR 70 HB THR 70 -11.769 -3.519 -12.864 541 HG1 THR 70 HG1 THR 70 -10.341 -4.527 -11.396 542 HG21 THR 70 HG21 THR 70 -12.415 -3.302 -9.887 543 HG22 THR 70 HG22 THR 70 -11.158 -2.413 -10.774 544 HG23 THR 70 HG23 THR 70 -12.874 -2.101 -11.126 545 H ALA 71 H ALA 71 -13.019 -4.640 -14.677 546 HA ALA 71 HA ALA 71 -13.688 -7.382 -15.204 547 HB1 ALA 71 HB1 ALA 71 -12.111 -5.350 -16.834 548 HB2 ALA 71 HB2 ALA 71 -12.782 -6.875 -17.445 549 HB3 ALA 71 HB3 ALA 71 -13.874 -5.587 -16.881 550 H GLU 72 H GLU 72 -10.899 -5.957 -13.774 551 HA GLU 72 HA GLU 72 -8.920 -7.783 -14.815 552 HB2 GLU 72 HB2 GLU 72 -8.939 -6.101 -12.310 553 HB3 GLU 72 HB3 GLU 72 -7.525 -6.892 -12.994 554 HG2 GLU 72 HG2 GLU 72 -9.189 -4.723 -14.349 555 HG3 GLU 72 HG3 GLU 72 -7.607 -4.499 -13.591 556 H HIS 73 H HIS 73 -11.572 -8.387 -12.920 557 HA HIS 73 HA HIS 73 -10.289 -10.721 -11.615 558 HB2 HIS 73 HB2 HIS 73 -12.407 -9.034 -10.262 559 HB3 HIS 73 HB3 HIS 73 -11.395 -10.277 -9.554 560 HD2 HIS 73 HD2 HIS 73 -11.758 -6.692 -9.583 561 HE1 HIS 73 HE1 HIS 73 -7.594 -7.176 -8.963 562 HE2 HIS 73 HE2 HIS 73 -9.525 -5.527 -8.874 563 H VAL 74 H VAL 74 -11.984 -10.287 -14.076 564 HA VAL 74 HA VAL 74 -14.686 -10.749 -13.716 565 HB VAL 74 HB VAL 74 -13.483 -10.134 -15.790 566 HG11 VAL 74 HG11 VAL 74 -12.889 -13.114 -16.023 567 HG12 VAL 74 HG12 VAL 74 -12.565 -11.872 -17.250 568 HG13 VAL 74 HG13 VAL 74 -11.687 -11.836 -15.703 569 HG21 VAL 74 HG21 VAL 74 -15.860 -10.874 -15.832 570 HG22 VAL 74 HG22 VAL 74 -14.990 -11.273 -17.331 571 HG23 VAL 74 HG23 VAL 74 -15.313 -12.545 -16.142 572 H ALA 75 H ALA 75 -12.111 -13.089 -13.293 573 HA ALA 75 HA ALA 75 -14.119 -15.289 -13.193 574 HB1 ALA 75 HB1 ALA 75 -11.071 -15.347 -13.091 575 HB2 ALA 75 HB2 ALA 75 -12.147 -16.763 -13.142 576 HB3 ALA 75 HB3 ALA 75 -12.073 -15.652 -14.531 577 H ILE 76 H ILE 76 -11.687 -13.579 -11.142 578 HA ILE 76 HA ILE 76 -12.076 -15.192 -8.819 579 HB ILE 76 HB ILE 76 -11.295 -12.268 -9.145 580 HG12 ILE 76 HG12 ILE 76 -9.652 -14.798 -8.756 581 HG13 ILE 76 HG13 ILE 76 -9.731 -13.823 -10.220 582 HG21 ILE 76 HG21 ILE 76 -12.120 -12.674 -6.865 583 HG22 ILE 76 HG22 ILE 76 -11.019 -14.072 -6.714 584 HG23 ILE 76 HG23 ILE 76 -10.383 -12.416 -6.865 585 HD11 ILE 76 HD11 ILE 76 -8.789 -11.882 -8.964 586 HD12 ILE 76 HD12 ILE 76 -8.519 -12.974 -7.581 587 HD13 ILE 76 HD13 ILE 76 -7.691 -13.277 -9.116 588 H ARG 77 H ARG 77 -13.979 -12.622 -10.296 589 HA ARG 77 HA ARG 77 -15.678 -11.869 -8.186 590 HB2 ARG 77 HB2 ARG 77 -15.423 -10.826 -10.452 591 HB3 ARG 77 HB3 ARG 77 -16.292 -12.204 -11.150 592 HG2 ARG 77 HG2 ARG 77 -18.281 -11.633 -9.759 593 HG3 ARG 77 HG3 ARG 77 -17.392 -10.233 -9.104 594 HD2 ARG 77 HD2 ARG 77 -17.097 -9.380 -11.408 595 HD3 ARG 77 HD3 ARG 77 -17.990 -10.783 -12.039 596 HE ARG 77 HE ARG 77 -19.775 -9.732 -10.274 597 HH11 ARG 77 HH11 ARG 77 -17.885 -8.240 -12.856 598 HH12 ARG 77 HH12 ARG 77 -19.073 -6.996 -13.166 599 HH21 ARG 77 HH21 ARG 77 -21.311 -8.101 -10.700 600 HH22 ARG 77 HH22 ARG 77 -21.000 -6.917 -11.944 601 H SER 78 H SER 78 -15.436 -14.869 -9.877 602 HA SER 78 HA SER 78 -18.028 -15.787 -8.696 603 HB2 SER 78 HB2 SER 78 -16.648 -16.637 -11.273 604 HB3 SER 78 HB3 SER 78 -18.115 -17.390 -10.596 605 HG SER 78 HG SER 78 -18.587 -15.769 -12.166 606 H LYS 79 H LYS 79 -14.563 -16.235 -8.675 607 HA LYS 79 HA LYS 79 -14.755 -19.037 -7.917 608 HB2 LYS 79 HB2 LYS 79 -12.512 -16.989 -7.795 609 HB3 LYS 79 HB3 LYS 79 -12.340 -18.634 -7.211 610 HG2 LYS 79 HG2 LYS 79 -12.900 -17.786 -10.067 611 HG3 LYS 79 HG3 LYS 79 -11.449 -18.550 -9.432 612 HD2 LYS 79 HD2 LYS 79 -14.188 -19.781 -9.854 613 HD3 LYS 79 HD3 LYS 79 -12.646 -20.252 -10.572 614 HE2 LYS 79 HE2 LYS 79 -11.842 -20.840 -8.225 615 HE3 LYS 79 HE3 LYS 79 -13.513 -20.572 -7.671 616 HZ1 LYS 79 HZ1 LYS 79 -12.678 -22.537 -9.704 617 HZ2 LYS 79 HZ2 LYS 79 -13.107 -22.875 -8.155 618 HZ3 LYS 79 HZ3 LYS 79 -14.226 -22.278 -9.202 619 H LEU 80 H LEU 80 -14.736 -15.895 -6.143 620 HA LEU 80 HA LEU 80 -14.349 -17.230 -3.577 621 HB2 LEU 80 HB2 LEU 80 -15.158 -14.472 -4.538 622 HB3 LEU 80 HB3 LEU 80 -15.296 -14.913 -2.828 623 HG LEU 80 HG LEU 80 -12.951 -15.340 -2.628 624 HD11 LEU 80 HD11 LEU 80 -12.781 -14.883 -5.627 625 HD12 LEU 80 HD12 LEU 80 -11.386 -14.942 -4.543 626 HD13 LEU 80 HD13 LEU 80 -12.393 -16.384 -4.750 627 HD21 LEU 80 HD21 LEU 80 -12.039 -13.109 -3.221 628 HD22 LEU 80 HD22 LEU 80 -13.448 -12.814 -4.262 629 HD23 LEU 80 HD23 LEU 80 -13.663 -12.987 -2.501 630 H GLN 81 H GLN 81 -17.054 -16.310 -5.709 631 HA GLN 81 HA GLN 81 -19.114 -16.949 -3.795 632 HB2 GLN 81 HB2 GLN 81 -18.869 -16.359 -6.719 633 HB3 GLN 81 HB3 GLN 81 -20.253 -17.330 -6.254 634 HG2 GLN 81 HG2 GLN 81 -19.557 -14.550 -5.265 635 HG3 GLN 81 HG3 GLN 81 -20.980 -15.064 -6.199 636 HE21 GLN 81 HE22 GLN 81 -21.754 -17.395 -4.753 637 HE22 GLN 81 HE21 GLN 81 -22.200 -16.920 -3.120 638 H TYR 82 H TYR 82 -17.356 -18.750 -6.326 639 HA TYR 82 HA TYR 82 -18.915 -21.128 -6.294 640 HB2 TYR 82 HB2 TYR 82 -17.277 -20.746 -8.036 641 HB3 TYR 82 HB3 TYR 82 -16.023 -20.417 -6.861 642 HD1 TYR 82 HD2 TYR 82 -17.961 -23.084 -8.520 643 HD2 TYR 82 HD1 TYR 82 -14.789 -22.174 -5.760 644 HE1 TYR 82 HE2 TYR 82 -17.179 -25.439 -8.644 645 HE2 TYR 82 HE1 TYR 82 -13.994 -24.526 -5.890 646 HH TYR 82 HH TYR 82 -14.331 -26.600 -6.785 647 H ARG 83 H ARG 83 -15.927 -20.307 -4.362 648 HA ARG 83 HA ARG 83 -16.148 -22.855 -2.994 649 HB2 ARG 83 HB2 ARG 83 -14.408 -20.414 -2.791 650 HB3 ARG 83 HB3 ARG 83 -14.496 -21.482 -1.378 651 HG2 ARG 83 HG2 ARG 83 -13.465 -22.112 -4.151 652 HG3 ARG 83 HG3 ARG 83 -12.619 -22.197 -2.605 653 HD2 ARG 83 HD2 ARG 83 -14.742 -24.069 -3.693 654 HD3 ARG 83 HD3 ARG 83 -13.080 -24.449 -3.248 655 HE ARG 83 HE ARG 83 -14.395 -23.466 -0.933 656 HH11 ARG 83 HH11 ARG 83 -14.492 -26.265 -3.087 657 HH12 ARG 83 HH12 ARG 83 -15.143 -27.326 -1.868 658 HH21 ARG 83 HH21 ARG 83 -15.271 -24.876 0.631 659 HH22 ARG 83 HH22 ARG 83 -15.571 -26.550 0.232 660 H LEU 84 H LEU 84 -17.438 -19.619 -2.373 661 HA LEU 84 HA LEU 84 -18.226 -20.148 0.340 662 HB2 LEU 84 HB2 LEU 84 -18.061 -17.960 -0.905 663 HB3 LEU 84 HB3 LEU 84 -19.573 -18.352 -1.727 664 HG LEU 84 HG LEU 84 -19.209 -18.124 1.267 665 HD11 LEU 84 HD11 LEU 84 -20.293 -15.926 1.056 666 HD12 LEU 84 HD12 LEU 84 -18.756 -15.990 0.174 667 HD13 LEU 84 HD13 LEU 84 -20.296 -16.101 -0.717 668 HD21 LEU 84 HD21 LEU 84 -21.704 -18.312 -0.442 669 HD22 LEU 84 HD22 LEU 84 -21.190 -19.408 0.867 670 HD23 LEU 84 HD23 LEU 84 -21.705 -17.770 1.259 671 H GLU 85 H GLU 85 -19.657 -20.676 -2.861 672 HA GLU 85 HA GLU 85 -22.188 -21.693 -2.057 673 HB2 GLU 85 HB2 GLU 85 -20.529 -21.593 -4.565 674 HB3 GLU 85 HB3 GLU 85 -21.946 -22.625 -4.552 675 HG2 GLU 85 HG2 GLU 85 -23.392 -20.765 -3.919 676 HG3 GLU 85 HG3 GLU 85 -21.997 -19.703 -3.674 677 H LEU 86 H LEU 86 -19.160 -23.141 -1.589 678 HA LEU 86 HA LEU 86 -20.533 -25.786 -1.312 679 HB2 LEU 86 HB2 LEU 86 -17.712 -25.160 -2.259 680 HB3 LEU 86 HB3 LEU 86 -18.140 -26.702 -1.526 681 HG LEU 86 HG LEU 86 -18.160 -27.092 -3.810 682 HD11 LEU 86 HD11 LEU 86 -21.085 -26.633 -3.129 683 HD12 LEU 86 HD12 LEU 86 -20.421 -27.764 -4.315 684 HD13 LEU 86 HD13 LEU 86 -20.119 -28.028 -2.577 685 HD21 LEU 86 HD21 LEU 86 -18.215 -24.810 -4.641 686 HD22 LEU 86 HD22 LEU 86 -19.413 -25.820 -5.472 687 HD23 LEU 86 HD23 LEU 86 -19.943 -24.678 -4.229 688 H ALA 87 H ALA 87 -18.688 -23.213 0.161 689 HA ALA 87 HA ALA 87 -17.652 -24.725 2.368 690 HB1 ALA 87 HB1 ALA 87 -18.400 -21.766 2.183 691 HB2 ALA 87 HB2 ALA 87 -17.309 -22.522 3.376 692 HB3 ALA 87 HB3 ALA 87 -16.841 -22.466 1.671 693 H GLN 88 H GLN 88 -20.748 -23.049 1.719 694 HA GLN 88 HA GLN 88 -21.778 -23.351 4.388 695 HB2 GLN 88 HB2 GLN 88 -23.090 -22.794 1.693 696 HB3 GLN 88 HB3 GLN 88 -23.918 -22.717 3.263 697 HG2 GLN 88 HG2 GLN 88 -22.274 -21.007 4.029 698 HG3 GLN 88 HG3 GLN 88 -21.530 -21.020 2.431 699 HE21 GLN 88 HE22 GLN 88 -22.889 -18.806 3.906 700 HE22 GLN 88 HE21 GLN 88 -24.187 -18.270 2.861 701 H GLY 89 H GLY 89 -20.864 -25.747 2.443 702 HA2 GLY 89 HA2 GLY 89 -23.054 -27.558 3.318 703 HA3 GLY 89 HA3 GLY 89 -22.408 -27.614 1.664 704 H ALA 90 H ALA 90 -20.062 -26.739 4.023 705 HA ALA 90 HA ALA 90 -19.236 -29.525 4.574 706 HB1 ALA 90 HB1 ALA 90 -17.475 -27.491 3.139 707 HB2 ALA 90 HB2 ALA 90 -16.966 -29.104 3.684 708 HB3 ALA 90 HB3 ALA 90 -18.198 -28.935 2.398 709 H VAL 91 H VAL 91 -19.456 -26.197 5.461 710 HA VAL 91 HA VAL 91 -17.309 -26.114 7.368 711 HB VAL 91 HB VAL 91 -18.423 -24.179 6.279 712 HG11 VAL 91 HG11 VAL 91 -20.532 -23.304 7.156 713 HG12 VAL 91 HG12 VAL 91 -20.786 -24.921 6.472 714 HG13 VAL 91 HG13 VAL 91 -20.693 -24.706 8.234 715 HG21 VAL 91 HG21 VAL 91 -18.353 -22.709 8.219 716 HG22 VAL 91 HG22 VAL 91 -18.530 -24.089 9.317 717 HG23 VAL 91 HG23 VAL 91 -17.058 -23.921 8.327 718 H GLY 92 H GLY 92 -20.449 -27.539 7.394 719 HA2 GLY 92 HA2 GLY 92 -20.123 -28.701 9.987 720 HA3 GLY 92 HA3 GLY 92 -21.248 -27.326 10.075 721 H SER 93 H SER 93 -20.744 -29.705 7.430 722 HA SER 93 HA SER 93 -23.531 -30.673 7.784 723 HB2 SER 93 HB2 SER 93 -22.314 -29.714 5.170 724 HB3 SER 93 HB3 SER 93 -23.945 -30.373 5.403 725 HG SER 93 HG SER 93 -23.975 -28.094 5.389 726 H VAL 94 H VAL 94 -23.790 -32.336 5.694 727 HA VAL 94 HA VAL 94 -21.527 -34.191 5.730 728 HB VAL 94 HB VAL 94 -24.357 -34.893 6.546 729 HG11 VAL 94 HG11 VAL 94 -23.406 -37.153 6.955 730 HG12 VAL 94 HG12 VAL 94 -23.281 -36.679 5.252 731 HG13 VAL 94 HG13 VAL 94 -21.846 -36.601 6.304 732 HG21 VAL 94 HG21 VAL 94 -23.166 -33.775 8.380 733 HG22 VAL 94 HG22 VAL 94 -23.330 -35.507 8.729 734 HG23 VAL 94 HG23 VAL 94 -21.779 -34.860 8.156 735 H GLN 95 H GLN 95 -21.222 -34.847 3.834 736 HA GLN 95 HA GLN 95 -23.339 -34.910 1.769 737 HB2 GLN 95 HB2 GLN 95 -21.930 -33.717 0.198 738 HB3 GLN 95 HB3 GLN 95 -22.195 -32.734 1.642 739 HG2 GLN 95 HG2 GLN 95 -19.701 -34.370 1.049 740 HG3 GLN 95 HG3 GLN 95 -19.868 -32.615 0.848 741 HE21 GLN 95 HE22 GLN 95 -20.415 -31.322 2.869 742 HE22 GLN 95 HE21 GLN 95 -19.717 -31.890 4.375 743 H ILE 96 H ILE 96 -21.659 -36.872 3.425 744 HA ILE 96 HA ILE 96 -20.916 -38.629 1.170 745 HB ILE 96 HB ILE 96 -18.907 -39.363 2.444 746 HG12 ILE 96 HG12 ILE 96 -19.489 -36.947 4.200 747 HG13 ILE 96 HG13 ILE 96 -19.628 -38.644 4.693 748 HG21 ILE 96 HG21 ILE 96 -18.858 -36.395 1.808 749 HG22 ILE 96 HG22 ILE 96 -17.494 -37.530 1.758 750 HG23 ILE 96 HG23 ILE 96 -18.820 -37.683 0.591 751 HD11 ILE 96 HD11 ILE 96 -17.194 -38.950 4.208 752 HD12 ILE 96 HD12 ILE 96 -17.079 -37.213 3.846 753 HD13 ILE 96 HD13 ILE 96 -17.509 -37.744 5.481 754 HA PRO 97 HA PRO 97 -23.203 -41.548 3.564 755 HB2 PRO 97 HB2 PRO 97 -22.112 -43.942 2.863 756 HB3 PRO 97 HB3 PRO 97 -23.002 -42.919 1.692 757 HG2 PRO 97 HG2 PRO 97 -20.006 -43.068 2.102 758 HG3 PRO 97 HG3 PRO 97 -20.917 -43.197 0.562 759 HD2 PRO 97 HD2 PRO 97 -19.814 -40.856 1.388 760 HD3 PRO 97 HD3 PRO 97 -21.398 -40.877 0.555 761 H VAL 98 H VAL 98 -23.041 -43.251 5.224 762 HA VAL 98 HA VAL 98 -20.487 -43.342 6.701 763 HB VAL 98 HB VAL 98 -21.647 -42.837 8.835 764 HG11 VAL 98 HG11 VAL 98 -21.833 -40.427 8.552 765 HG12 VAL 98 HG12 VAL 98 -20.455 -41.041 7.614 766 HG13 VAL 98 HG13 VAL 98 -21.977 -40.604 6.792 767 HG21 VAL 98 HG21 VAL 98 -23.874 -41.796 8.816 768 HG22 VAL 98 HG22 VAL 98 -24.002 -42.045 7.065 769 HG23 VAL 98 HG23 VAL 98 -23.951 -43.441 8.164 770 H VAL 99 H VAL 99 -22.632 -45.079 5.137 771 HA VAL 99 HA VAL 99 -23.701 -46.944 7.004 772 HB VAL 99 HB VAL 99 -23.049 -47.293 4.066 773 HG11 VAL 99 HG11 VAL 99 -25.032 -48.714 5.891 774 HG12 VAL 99 HG12 VAL 99 -25.007 -48.869 4.119 775 HG13 VAL 99 HG13 VAL 99 -23.632 -49.444 5.067 776 HG21 VAL 99 HG21 VAL 99 -24.444 -45.299 4.429 777 HG22 VAL 99 HG22 VAL 99 -25.418 -46.593 3.711 778 HG23 VAL 99 HG23 VAL 99 -25.551 -46.246 5.450 779 H GLU 100 H GLU 100 -20.471 -46.418 6.094 780 HA GLU 100 HA GLU 100 -19.732 -49.124 6.981 781 HB2 GLU 100 HB2 GLU 100 -17.942 -49.179 5.321 782 HB3 GLU 100 HB3 GLU 100 -19.493 -48.882 4.517 783 HG2 GLU 100 HG2 GLU 100 -17.481 -46.697 5.192 784 HG3 GLU 100 HG3 GLU 100 -17.602 -47.510 3.633 785 H VAL 101 H VAL 101 -20.093 -46.963 8.557 786 HA VAL 101 HA VAL 101 -17.787 -45.554 9.369 787 HB VAL 101 HB VAL 101 -20.081 -45.114 10.121 788 HG11 VAL 101 HG11 VAL 101 -19.791 -47.644 11.799 789 HG12 VAL 101 HG12 VAL 101 -21.165 -46.512 11.816 790 HG13 VAL 101 HG13 VAL 101 -20.821 -47.475 10.361 791 HG21 VAL 101 HG21 VAL 101 -18.164 -44.315 11.514 792 HG22 VAL 101 HG22 VAL 101 -19.644 -44.616 12.448 793 HG23 VAL 101 HG23 VAL 101 -18.319 -45.785 12.510 794 H ASP 102 H ASP 102 -16.432 -45.925 11.312 795 HA ASP 102 HA ASP 102 -15.985 -48.764 12.015 796 HB2 ASP 102 HB2 ASP 102 -14.632 -48.204 9.991 797 HB3 ASP 102 HB3 ASP 102 -13.854 -46.923 10.917 798 H GLU 103 H GLU 103 -14.227 -48.906 13.724 799 HA GLU 103 HA GLU 103 -14.916 -47.252 15.958 800 HB2 GLU 103 HB2 GLU 103 -12.541 -49.112 15.612 801 HB3 GLU 103 HB3 GLU 103 -13.231 -48.546 17.138 802 HG2 GLU 103 HG2 GLU 103 -15.391 -49.663 16.558 803 HG3 GLU 103 HG3 GLU 103 -14.637 -50.315 15.095 804 H LEU 104 H LEU 104 -12.725 -46.683 17.345 805 HA LEU 104 HA LEU 104 -11.131 -44.763 15.755 806 HB2 LEU 104 HB2 LEU 104 -11.538 -43.396 18.023 807 HB3 LEU 104 HB3 LEU 104 -12.522 -43.181 16.576 808 HG LEU 104 HG LEU 104 -14.224 -44.730 17.556 809 HD11 LEU 104 HD11 LEU 104 -12.775 -46.038 19.090 810 HD12 LEU 104 HD12 LEU 104 -12.437 -44.567 20.023 811 HD13 LEU 104 HD13 LEU 104 -14.074 -45.243 19.987 812 HD21 LEU 104 HD21 LEU 104 -15.028 -43.138 19.233 813 HD22 LEU 104 HD22 LEU 104 -13.418 -42.392 19.311 814 HD23 LEU 104 HD23 LEU 104 -14.376 -42.285 17.814 815 HA PRO 105 HA PRO 105 -7.792 -46.289 18.105 816 HB2 PRO 105 HB2 PRO 105 -6.028 -44.219 18.115 817 HB3 PRO 105 HB3 PRO 105 -6.588 -44.972 16.583 818 HG2 PRO 105 HG2 PRO 105 -7.670 -42.474 17.928 819 HG3 PRO 105 HG3 PRO 105 -7.142 -42.671 16.223 820 HD2 PRO 105 HD2 PRO 105 -9.766 -42.898 16.982 821 HD3 PRO 105 HD3 PRO 105 -9.071 -43.901 15.676 822 H GLU 106 H GLU 106 -10.034 -44.736 19.744 823 HA GLU 106 HA GLU 106 -10.349 -43.988 21.872 824 HB2 GLU 106 HB2 GLU 106 -8.011 -45.884 22.278 825 HB3 GLU 106 HB3 GLU 106 -8.911 -45.155 23.617 826 HG2 GLU 106 HG2 GLU 106 -10.251 -46.780 21.423 827 HG3 GLU 106 HG3 GLU 106 -9.653 -47.479 22.930 828 H GLY 107 H GLY 107 -8.480 -42.439 20.093 829 HA2 GLY 107 HA2 GLY 107 -7.515 -40.588 22.145 830 HA3 GLY 107 HA3 GLY 107 -6.252 -41.329 21.140 831 H TYR 108 H TYR 108 -9.403 -40.827 19.717 832 HA TYR 108 HA TYR 108 -8.454 -39.183 17.615 833 HB2 TYR 108 HB2 TYR 108 -10.716 -39.057 16.925 834 HB3 TYR 108 HB3 TYR 108 -10.442 -40.673 17.553 835 HD1 TYR 108 HD2 TYR 108 -11.039 -40.957 20.156 836 HD2 TYR 108 HD1 TYR 108 -12.636 -37.942 17.542 837 HE1 TYR 108 HE2 TYR 108 -12.990 -40.685 21.673 838 HE2 TYR 108 HE1 TYR 108 -14.591 -37.662 19.046 839 HH TYR 108 HH TYR 108 -15.629 -38.367 20.973 840 H ASP 109 H ASP 109 -9.777 -37.058 17.100 841 HA ASP 109 HA ASP 109 -8.723 -35.112 18.902 842 HB2 ASP 109 HB2 ASP 109 -8.864 -34.961 16.390 843 HB3 ASP 109 HB3 ASP 109 -10.618 -34.723 16.549 844 H ARG 110 H ARG 110 -11.001 -36.878 19.862 845 HA ARG 110 HA ARG 110 -12.863 -36.787 21.130 846 HB2 ARG 110 HB2 ARG 110 -11.120 -35.397 22.371 847 HB3 ARG 110 HB3 ARG 110 -12.078 -33.982 21.884 848 HG2 ARG 110 HG2 ARG 110 -14.050 -34.934 23.052 849 HG3 ARG 110 HG3 ARG 110 -13.110 -36.388 23.452 850 HD2 ARG 110 HD2 ARG 110 -11.513 -35.005 24.730 851 HD3 ARG 110 HD3 ARG 110 -12.446 -33.545 24.323 852 HE ARG 110 HE ARG 110 -14.223 -35.388 25.524 853 HH11 ARG 110 HH11 ARG 110 -11.377 -33.487 26.413 854 HH12 ARG 110 HH12 ARG 110 -11.845 -33.359 28.092 855 HH21 ARG 110 HH21 ARG 110 -14.814 -35.200 27.716 856 HH22 ARG 110 HH22 ARG 110 -13.782 -34.341 28.831 857 H SER 111 H SER 111 -12.925 -35.461 18.306 858 HA SER 111 HA SER 111 -15.718 -34.520 18.494 859 HB2 SER 111 HB2 SER 111 -13.455 -32.927 17.213 860 HB3 SER 111 HB3 SER 111 -15.187 -32.589 17.015 861 HG SER 111 HG SER 111 -14.243 -31.340 18.698 Start of MODEL 6 1 H1 SER 2 H1 SER 2 7.496 -3.278 -6.480 2 H2 SER 2 H2 SER 2 8.241 -3.089 -5.022 3 H3 SER 2 H3 SER 2 7.094 -2.013 -5.504 4 HA SER 2 HA SER 2 6.224 -3.479 -3.848 5 HB2 SER 2 HB2 SER 2 4.715 -2.583 -5.593 6 HB3 SER 2 HB3 SER 2 5.050 -4.001 -6.606 7 HG SER 2 HG SER 2 3.132 -4.205 -5.328 8 H GLN 3 H GLN 3 5.261 -5.715 -3.561 9 HA GLN 3 HA GLN 3 6.787 -7.860 -4.869 10 HB2 GLN 3 HB2 GLN 3 7.601 -8.799 -2.787 11 HB3 GLN 3 HB3 GLN 3 8.220 -7.153 -2.978 12 HG2 GLN 3 HG2 GLN 3 5.804 -7.900 -1.269 13 HG3 GLN 3 HG3 GLN 3 7.438 -7.739 -0.640 14 HE21 GLN 3 HE22 GLN 3 4.771 -6.180 -0.278 15 HE22 GLN 3 HE21 GLN 3 5.273 -4.513 -0.449 16 H PHE 4 H PHE 4 3.901 -6.741 -4.295 17 HA PHE 4 HA PHE 4 2.430 -8.508 -2.704 18 HB2 PHE 4 HB2 PHE 4 1.637 -6.401 -3.730 19 HB3 PHE 4 HB3 PHE 4 1.669 -7.145 -5.318 20 HD1 PHE 4 HD2 PHE 4 0.181 -9.353 -5.588 21 HD2 PHE 4 HD1 PHE 4 -0.334 -6.382 -2.537 22 HE1 PHE 4 HE2 PHE 4 -2.137 -10.135 -5.233 23 HE2 PHE 4 HE1 PHE 4 -2.694 -7.099 -2.215 24 HZ PHE 4 HZ PHE 4 -3.598 -8.975 -3.580 25 H GLU 5 H GLU 5 3.203 -8.805 -6.229 26 HA GLU 5 HA GLU 5 1.805 -11.367 -6.370 27 HB2 GLU 5 HB2 GLU 5 3.575 -9.885 -8.353 28 HB3 GLU 5 HB3 GLU 5 2.650 -11.361 -8.708 29 HG2 GLU 5 HG2 GLU 5 0.546 -10.177 -8.116 30 HG3 GLU 5 HG3 GLU 5 1.465 -8.699 -7.791 31 H LYS 6 H LYS 6 5.064 -10.329 -5.621 32 HA LYS 6 HA LYS 6 6.391 -12.741 -6.563 33 HB2 LYS 6 HB2 LYS 6 7.140 -10.385 -4.808 34 HB3 LYS 6 HB3 LYS 6 8.201 -11.788 -4.973 35 HG2 LYS 6 HG2 LYS 6 8.849 -10.019 -6.511 36 HG3 LYS 6 HG3 LYS 6 8.359 -11.475 -7.384 37 HD2 LYS 6 HD2 LYS 6 6.193 -10.469 -7.929 38 HD3 LYS 6 HD3 LYS 6 6.603 -9.024 -6.960 39 HE2 LYS 6 HE2 LYS 6 8.529 -8.580 -8.434 40 HE3 LYS 6 HE3 LYS 6 8.152 -10.027 -9.383 41 HZ1 LYS 6 HZ1 LYS 6 7.286 -8.047 -10.407 42 HZ2 LYS 6 HZ2 LYS 6 6.041 -9.021 -9.961 43 HZ3 LYS 6 HZ3 LYS 6 6.396 -7.677 -9.074 44 H GLN 7 H GLN 7 5.540 -11.477 -3.271 45 HA GLN 7 HA GLN 7 6.434 -13.796 -1.908 46 HB2 GLN 7 HB2 GLN 7 5.428 -11.302 -1.233 47 HB3 GLN 7 HB3 GLN 7 4.123 -12.366 -0.723 48 HG2 GLN 7 HG2 GLN 7 7.057 -12.526 0.056 49 HG3 GLN 7 HG3 GLN 7 5.714 -12.004 1.096 50 HE21 GLN 7 HE22 GLN 7 3.850 -13.750 1.267 51 HE22 GLN 7 HE21 GLN 7 4.408 -15.388 1.499 52 H LYS 8 H LYS 8 3.415 -13.012 -3.543 53 HA LYS 8 HA LYS 8 1.796 -15.061 -2.280 54 HB2 LYS 8 HB2 LYS 8 1.001 -12.878 -3.139 55 HB3 LYS 8 HB3 LYS 8 1.457 -13.354 -4.751 56 HG2 LYS 8 HG2 LYS 8 -0.199 -15.376 -4.380 57 HG3 LYS 8 HG3 LYS 8 -0.812 -14.403 -3.041 58 HD2 LYS 8 HD2 LYS 8 -2.164 -13.743 -4.873 59 HD3 LYS 8 HD3 LYS 8 -0.930 -12.471 -4.800 60 HE2 LYS 8 HE2 LYS 8 -1.082 -13.147 -7.120 61 HE3 LYS 8 HE3 LYS 8 0.442 -13.769 -6.482 62 HZ1 LYS 8 HZ1 LYS 8 -0.667 -15.903 -6.151 63 HZ2 LYS 8 HZ2 LYS 8 -2.043 -15.314 -6.839 64 HZ3 LYS 8 HZ3 LYS 8 -0.655 -15.459 -7.722 65 H GLU 9 H GLU 9 2.990 -14.658 -5.724 66 HA GLU 9 HA GLU 9 2.051 -17.203 -6.517 67 HB2 GLU 9 HB2 GLU 9 2.610 -15.070 -7.840 68 HB3 GLU 9 HB3 GLU 9 4.305 -15.576 -7.737 69 HG2 GLU 9 HG2 GLU 9 3.322 -16.312 -9.825 70 HG3 GLU 9 HG3 GLU 9 3.707 -17.721 -8.810 71 H GLN 10 H GLN 10 5.068 -16.205 -4.930 72 HA GLN 10 HA GLN 10 6.510 -18.618 -5.618 73 HB2 GLN 10 HB2 GLN 10 6.905 -16.451 -3.522 74 HB3 GLN 10 HB3 GLN 10 8.008 -17.835 -3.710 75 HG2 GLN 10 HG2 GLN 10 8.478 -17.245 -6.024 76 HG3 GLN 10 HG3 GLN 10 7.316 -15.922 -5.976 77 HE21 GLN 10 HE22 GLN 10 9.270 -14.661 -6.699 78 HE22 GLN 10 HE21 GLN 10 10.334 -14.030 -5.453 79 H GLY 11 H GLY 11 3.747 -18.348 -3.850 80 HA2 GLY 11 HA2 GLY 11 4.499 -20.655 -2.111 81 HA3 GLY 11 HA3 GLY 11 3.302 -19.442 -1.658 82 H ASN 12 H ASN 12 2.854 -19.780 -4.946 83 HA ASN 12 HA ASN 12 0.440 -21.272 -4.629 84 HB2 ASN 12 HB2 ASN 12 0.095 -20.800 -6.822 85 HB3 ASN 12 HB3 ASN 12 1.382 -19.639 -6.562 86 HD21 ASN 12 HD22 ASN 12 3.486 -20.144 -7.409 87 HD22 ASN 12 HD21 ASN 12 3.667 -21.339 -8.672 88 H SER 13 H SER 13 3.763 -22.194 -5.218 89 HA SER 13 HA SER 13 3.086 -24.917 -6.022 90 HB2 SER 13 HB2 SER 13 5.554 -25.253 -5.850 91 HB3 SER 13 HB3 SER 13 5.117 -23.869 -6.881 92 HG SER 13 HG SER 13 6.786 -23.361 -5.386 93 H LEU 14 H LEU 14 4.086 -23.223 -3.021 94 HA LEU 14 HA LEU 14 4.485 -25.522 -1.404 95 HB2 LEU 14 HB2 LEU 14 3.807 -22.609 -0.991 96 HB3 LEU 14 HB3 LEU 14 3.638 -23.713 0.357 97 HG LEU 14 HG LEU 14 5.996 -24.402 0.153 98 HD11 LEU 14 HD11 LEU 14 7.517 -23.116 -1.322 99 HD12 LEU 14 HD12 LEU 14 6.355 -24.056 -2.254 100 HD13 LEU 14 HD13 LEU 14 6.118 -22.302 -2.054 101 HD21 LEU 14 HD21 LEU 14 5.571 -21.387 0.233 102 HD22 LEU 14 HD22 LEU 14 5.341 -22.508 1.588 103 HD23 LEU 14 HD23 LEU 14 6.963 -22.264 0.908 104 H PHE 15 H PHE 15 1.585 -23.692 -2.371 105 HA PHE 15 HA PHE 15 -0.297 -24.977 -0.664 106 HB2 PHE 15 HB2 PHE 15 -0.831 -22.942 -1.844 107 HB3 PHE 15 HB3 PHE 15 -0.405 -23.658 -3.392 108 HD1 PHE 15 HD1 PHE 15 -2.663 -24.716 -0.575 109 HD2 PHE 15 HD2 PHE 15 -2.188 -23.926 -4.765 110 HE1 PHE 15 HE1 PHE 15 -5.027 -25.374 -0.954 111 HE2 PHE 15 HE2 PHE 15 -4.581 -24.536 -5.156 112 HZ PHE 15 HZ PHE 15 -5.982 -25.268 -3.253 113 H LYS 16 H LYS 16 1.419 -26.088 -3.490 114 HA LYS 16 HA LYS 16 -0.530 -28.289 -3.898 115 HB2 LYS 16 HB2 LYS 16 1.742 -27.260 -5.633 116 HB3 LYS 16 HB3 LYS 16 0.619 -28.559 -6.081 117 HG2 LYS 16 HG2 LYS 16 -1.288 -27.042 -5.981 118 HG3 LYS 16 HG3 LYS 16 -0.288 -25.748 -5.306 119 HD2 LYS 16 HD2 LYS 16 1.093 -25.771 -7.411 120 HD3 LYS 16 HD3 LYS 16 -0.102 -26.900 -8.109 121 HE2 LYS 16 HE2 LYS 16 -1.898 -25.218 -7.592 122 HE3 LYS 16 HE3 LYS 16 -0.647 -24.108 -6.993 123 HZ1 LYS 16 HZ1 LYS 16 -0.780 -25.150 -9.744 124 HZ2 LYS 16 HZ2 LYS 16 -1.245 -23.643 -9.272 125 HZ3 LYS 16 HZ3 LYS 16 0.336 -24.088 -9.156 126 H GLN 17 H GLN 17 2.353 -27.682 -2.232 127 HA GLN 17 HA GLN 17 3.594 -30.291 -2.593 128 HB2 GLN 17 HB2 GLN 17 3.987 -28.129 -0.518 129 HB3 GLN 17 HB3 GLN 17 4.918 -29.634 -0.607 130 HG2 GLN 17 HG2 GLN 17 5.400 -28.997 -3.073 131 HG3 GLN 17 HG3 GLN 17 4.849 -27.379 -2.613 132 HE21 GLN 17 HE22 GLN 17 5.795 -26.928 -0.137 133 HE22 GLN 17 HE21 GLN 17 7.526 -27.057 -0.102 134 H GLY 18 H GLY 18 0.828 -29.174 -0.787 135 HA2 GLY 18 HA2 GLY 18 -0.653 -30.629 0.291 136 HA3 GLY 18 HA3 GLY 18 0.614 -31.852 0.446 137 H LEU 19 H LEU 19 1.192 -28.496 1.368 138 HA LEU 19 HA LEU 19 0.891 -29.169 4.237 139 HB2 LEU 19 HB2 LEU 19 3.093 -27.961 4.629 140 HB3 LEU 19 HB3 LEU 19 3.145 -29.594 3.969 141 HG LEU 19 HG LEU 19 3.558 -28.731 1.710 142 HD11 LEU 19 HD11 LEU 19 4.154 -26.359 1.389 143 HD12 LEU 19 HD12 LEU 19 2.456 -26.532 1.859 144 HD13 LEU 19 HD13 LEU 19 3.661 -26.005 3.058 145 HD21 LEU 19 HD21 LEU 19 5.408 -27.603 3.844 146 HD22 LEU 19 HD22 LEU 19 5.416 -29.278 3.236 147 HD23 LEU 19 HD23 LEU 19 5.847 -27.931 2.156 148 H TYR 20 H TYR 20 -1.021 -27.977 2.977 149 HA TYR 20 HA TYR 20 -1.133 -25.434 2.134 150 HB2 TYR 20 HB2 TYR 20 -3.174 -26.583 4.040 151 HB3 TYR 20 HB3 TYR 20 -3.468 -25.482 2.709 152 HD1 TYR 20 HD2 TYR 20 -2.088 -26.688 0.436 153 HD2 TYR 20 HD1 TYR 20 -4.253 -28.579 3.633 154 HE1 TYR 20 HE2 TYR 20 -2.553 -28.630 -1.024 155 HE2 TYR 20 HE1 TYR 20 -4.721 -30.522 2.180 156 HH TYR 20 HH TYR 20 -4.400 -31.483 0.116 157 H ARG 21 H ARG 21 -0.702 -26.229 5.600 158 HA ARG 21 HA ARG 21 -1.641 -23.911 6.794 159 HB2 ARG 21 HB2 ARG 21 -0.535 -26.213 7.604 160 HB3 ARG 21 HB3 ARG 21 0.938 -25.249 7.654 161 HG2 ARG 21 HG2 ARG 21 -1.656 -24.778 9.170 162 HG3 ARG 21 HG3 ARG 21 -0.085 -25.257 9.843 163 HD2 ARG 21 HD2 ARG 21 -0.751 -22.640 8.486 164 HD3 ARG 21 HD3 ARG 21 -0.546 -22.871 10.232 165 HE ARG 21 HE ARG 21 1.794 -23.718 8.730 166 HH11 ARG 21 HH11 ARG 21 0.169 -20.914 10.129 167 HH12 ARG 21 HH12 ARG 21 1.637 -19.970 10.238 168 HH21 ARG 21 HH21 ARG 21 3.666 -22.485 8.846 169 HH22 ARG 21 HH22 ARG 21 3.632 -20.871 9.539 170 H GLU 22 H GLU 22 1.557 -24.535 5.282 171 HA GLU 22 HA GLU 22 2.691 -21.977 5.943 172 HB2 GLU 22 HB2 GLU 22 3.304 -23.764 3.567 173 HB3 GLU 22 HB3 GLU 22 4.400 -22.604 4.335 174 HG2 GLU 22 HG2 GLU 22 3.278 -25.125 5.662 175 HG3 GLU 22 HG3 GLU 22 4.839 -24.979 4.874 176 H ALA 23 H ALA 23 0.933 -23.323 3.210 177 HA ALA 23 HA ALA 23 1.271 -21.134 1.413 178 HB1 ALA 23 HB1 ALA 23 -0.829 -23.327 1.457 179 HB2 ALA 23 HB2 ALA 23 -0.391 -22.305 0.075 180 HB3 ALA 23 HB3 ALA 23 0.798 -23.448 0.747 181 H VAL 24 H VAL 24 -0.881 -21.429 4.163 182 HA VAL 24 HA VAL 24 -2.920 -19.579 3.121 183 HB VAL 24 HB VAL 24 -2.032 -20.348 5.958 184 HG11 VAL 24 HG11 VAL 24 -4.591 -18.952 5.020 185 HG12 VAL 24 HG12 VAL 24 -4.227 -19.461 6.686 186 HG13 VAL 24 HG13 VAL 24 -3.256 -18.189 5.921 187 HG21 VAL 24 HG21 VAL 24 -4.416 -21.309 4.270 188 HG22 VAL 24 HG22 VAL 24 -2.999 -22.276 4.713 189 HG23 VAL 24 HG23 VAL 24 -4.126 -21.748 5.969 190 H HIS 25 H HIS 25 -0.128 -19.698 5.121 191 HA HIS 25 HA HIS 25 0.147 -16.957 5.879 192 HB2 HIS 25 HB2 HIS 25 1.185 -19.630 6.356 193 HB3 HIS 25 HB3 HIS 25 2.488 -18.544 6.156 194 HD2 HIS 25 HD2 HIS 25 3.127 -17.316 8.460 195 HE1 HIS 25 HE1 HIS 25 -0.634 -17.677 10.437 196 HE2 HIS 25 HE2 HIS 25 1.787 -16.873 10.677 197 H CYS 26 H CYS 26 0.385 -18.151 2.881 198 HA CYS 26 HA CYS 26 2.744 -16.486 2.110 199 HB2 CYS 26 HB2 CYS 26 1.486 -18.960 0.863 200 HB3 CYS 26 HB3 CYS 26 2.571 -17.875 -0.009 201 HG CYS 26 HG CYS 26 3.102 -19.441 2.863 202 H TYR 27 H TYR 27 -0.562 -16.464 2.237 203 HA TYR 27 HA TYR 27 -0.733 -14.555 -0.066 204 HB2 TYR 27 HB2 TYR 27 -2.965 -16.279 1.017 205 HB3 TYR 27 HB3 TYR 27 -3.025 -15.268 -0.422 206 HD1 TYR 27 HD2 TYR 27 -0.462 -16.100 -1.784 207 HD2 TYR 27 HD1 TYR 27 -3.405 -18.383 0.345 208 HE1 TYR 27 HE2 TYR 27 0.119 -18.105 -3.139 209 HE2 TYR 27 HE1 TYR 27 -2.829 -20.393 -0.998 210 HH TYR 27 HH TYR 27 -1.527 -21.245 -2.670 211 H ASP 28 H ASP 28 -1.060 -15.062 3.314 212 HA ASP 28 HA ASP 28 -3.225 -13.271 3.893 213 HB2 ASP 28 HB2 ASP 28 -2.225 -15.104 5.335 214 HB3 ASP 28 HB3 ASP 28 -0.830 -14.066 5.613 215 H GLN 29 H GLN 29 0.175 -12.761 3.120 216 HA GLN 29 HA GLN 29 0.421 -10.253 4.495 217 HB2 GLN 29 HB2 GLN 29 2.502 -10.043 3.481 218 HB3 GLN 29 HB3 GLN 29 2.316 -11.768 3.799 219 HG2 GLN 29 HG2 GLN 29 1.717 -10.415 1.158 220 HG3 GLN 29 HG3 GLN 29 3.268 -11.148 1.527 221 HE21 GLN 29 HE22 GLN 29 1.645 -11.850 -0.676 222 HE22 GLN 29 HE21 GLN 29 1.144 -13.508 -0.513 223 H LEU 30 H LEU 30 -1.383 -11.109 1.759 224 HA LEU 30 HA LEU 30 -1.084 -8.538 0.355 225 HB2 LEU 30 HB2 LEU 30 -3.037 -10.843 -0.024 226 HB3 LEU 30 HB3 LEU 30 -2.685 -9.553 -1.191 227 HG LEU 30 HG LEU 30 -0.806 -11.733 -0.202 228 HD11 LEU 30 HD11 LEU 30 -2.425 -12.539 -1.787 229 HD12 LEU 30 HD12 LEU 30 -2.153 -11.148 -2.858 230 HD13 LEU 30 HD13 LEU 30 -0.875 -12.344 -2.610 231 HD21 LEU 30 HD21 LEU 30 0.488 -9.669 -0.552 232 HD22 LEU 30 HD22 LEU 30 0.812 -10.827 -1.853 233 HD23 LEU 30 HD23 LEU 30 -0.273 -9.466 -2.138 234 H ILE 31 H ILE 31 -3.328 -10.154 2.539 235 HA ILE 31 HA ILE 31 -5.433 -8.210 2.230 236 HB ILE 31 HB ILE 31 -4.787 -10.308 4.334 237 HG12 ILE 31 HG12 ILE 31 -6.968 -10.555 2.256 238 HG13 ILE 31 HG13 ILE 31 -5.314 -10.864 1.787 239 HG21 ILE 31 HG21 ILE 31 -7.368 -8.771 3.895 240 HG22 ILE 31 HG22 ILE 31 -7.218 -10.206 4.935 241 HG23 ILE 31 HG23 ILE 31 -6.338 -8.728 5.343 242 HD11 ILE 31 HD11 ILE 31 -6.763 -12.267 4.025 243 HD12 ILE 31 HD12 ILE 31 -6.339 -12.945 2.424 244 HD13 ILE 31 HD13 ILE 31 -5.055 -12.490 3.585 245 H THR 32 H THR 32 -2.415 -8.269 3.766 246 HA THR 32 HA THR 32 -3.148 -5.974 5.544 247 HB THR 32 HB THR 32 -0.690 -7.773 5.594 248 HG1 THR 32 HG1 THR 32 -1.711 -8.629 7.421 249 HG21 THR 32 HG21 THR 32 -1.708 -5.628 7.517 250 HG22 THR 32 HG22 THR 32 -0.377 -6.756 7.862 251 HG23 THR 32 HG23 THR 32 -0.210 -5.567 6.554 252 H ALA 33 H ALA 33 -1.099 -6.889 2.747 253 HA ALA 33 HA ALA 33 0.454 -4.432 2.839 254 HB1 ALA 33 HB1 ALA 33 -0.004 -6.463 0.623 255 HB2 ALA 33 HB2 ALA 33 1.198 -5.168 0.595 256 HB3 ALA 33 HB3 ALA 33 1.341 -6.467 1.790 257 H GLN 34 H GLN 34 -2.482 -5.568 1.178 258 HA GLN 34 HA GLN 34 -3.553 -2.996 0.734 259 HB2 GLN 34 HB2 GLN 34 -3.333 -2.895 -1.767 260 HB3 GLN 34 HB3 GLN 34 -1.890 -2.511 -0.839 261 HG2 GLN 34 HG2 GLN 34 -1.347 -5.085 -1.203 262 HG3 GLN 34 HG3 GLN 34 -2.460 -4.887 -2.572 263 HE21 GLN 34 HE22 GLN 34 0.489 -3.587 -1.022 264 HE22 GLN 34 HE21 GLN 34 1.214 -2.974 -2.483 265 HA PRO 35 HA PRO 35 -6.302 -6.679 0.538 266 HB2 PRO 35 HB2 PRO 35 -8.318 -5.574 2.060 267 HB3 PRO 35 HB3 PRO 35 -6.884 -6.402 2.737 268 HG2 PRO 35 HG2 PRO 35 -7.316 -3.433 2.351 269 HG3 PRO 35 HG3 PRO 35 -6.697 -4.292 3.806 270 HD2 PRO 35 HD2 PRO 35 -5.015 -3.116 2.040 271 HD3 PRO 35 HD3 PRO 35 -4.601 -4.689 2.786 272 H GLN 36 H GLN 36 -6.308 -3.549 -0.756 273 HA GLN 36 HA GLN 36 -8.974 -3.305 -1.685 274 HB2 GLN 36 HB2 GLN 36 -8.118 -1.549 -3.100 275 HB3 GLN 36 HB3 GLN 36 -7.372 -1.454 -1.496 276 HG2 GLN 36 HG2 GLN 36 -5.380 -2.669 -2.395 277 HG3 GLN 36 HG3 GLN 36 -6.124 -2.660 -4.002 278 HE21 GLN 36 HE22 GLN 36 -3.657 -1.548 -3.808 279 HE22 GLN 36 HE21 GLN 36 -3.750 0.197 -3.897 280 H ASN 37 H ASN 37 -7.152 -5.875 -2.373 281 HA ASN 37 HA ASN 37 -8.206 -6.078 -5.148 282 HB2 ASN 37 HB2 ASN 37 -5.438 -6.807 -4.118 283 HB3 ASN 37 HB3 ASN 37 -6.089 -7.375 -5.665 284 HD21 ASN 37 HD22 ASN 37 -4.188 -5.045 -4.261 285 HD22 ASN 37 HD21 ASN 37 -4.300 -3.812 -5.496 286 HA PRO 38 HA PRO 38 -9.964 -9.749 -3.387 287 HB2 PRO 38 HB2 PRO 38 -10.920 -10.924 -5.605 288 HB3 PRO 38 HB3 PRO 38 -11.514 -9.325 -5.072 289 HG2 PRO 38 HG2 PRO 38 -9.335 -9.834 -7.116 290 HG3 PRO 38 HG3 PRO 38 -10.854 -8.881 -7.337 291 HD2 PRO 38 HD2 PRO 38 -8.601 -7.590 -6.597 292 HD3 PRO 38 HD3 PRO 38 -10.134 -7.229 -5.837 293 H VAL 39 H VAL 39 -7.134 -9.773 -5.399 294 HA VAL 39 HA VAL 39 -6.889 -12.568 -5.921 295 HB VAL 39 HB VAL 39 -4.646 -10.548 -5.486 296 HG11 VAL 39 HG11 VAL 39 -4.872 -13.049 -7.215 297 HG12 VAL 39 HG12 VAL 39 -3.456 -11.979 -7.107 298 HG13 VAL 39 HG13 VAL 39 -3.963 -12.921 -5.689 299 HG21 VAL 39 HG21 VAL 39 -6.303 -11.119 -7.981 300 HG22 VAL 39 HG22 VAL 39 -6.260 -9.586 -7.073 301 HG23 VAL 39 HG23 VAL 39 -4.816 -10.133 -7.933 302 H GLY 40 H GLY 40 -5.832 -10.501 -3.193 303 HA2 GLY 40 HA2 GLY 40 -4.472 -12.412 -1.621 304 HA3 GLY 40 HA3 GLY 40 -5.326 -10.977 -1.025 305 H TYR 41 H TYR 41 -7.832 -12.189 -2.407 306 HA TYR 41 HA TYR 41 -8.490 -14.182 -0.297 307 HB2 TYR 41 HB2 TYR 41 -10.559 -12.528 -1.715 308 HB3 TYR 41 HB3 TYR 41 -10.693 -13.373 -0.247 309 HD1 TYR 41 HD2 TYR 41 -9.086 -10.348 -1.701 310 HD2 TYR 41 HD1 TYR 41 -10.308 -12.408 1.861 311 HE1 TYR 41 HE2 TYR 41 -8.720 -8.278 -0.394 312 HE2 TYR 41 HE1 TYR 41 -9.927 -10.343 3.188 313 HH TYR 41 HH TYR 41 -9.341 -8.135 3.136 314 H SER 42 H SER 42 -7.298 -14.527 -3.065 315 HA SER 42 HA SER 42 -9.431 -16.332 -4.100 316 HB2 SER 42 HB2 SER 42 -9.184 -14.283 -5.508 317 HB3 SER 42 HB3 SER 42 -7.480 -14.712 -5.792 318 HG SER 42 HG SER 42 -8.242 -16.699 -6.673 319 H ASN 43 H ASN 43 -6.493 -16.145 -2.633 320 HA ASN 43 HA ASN 43 -5.804 -18.857 -3.649 321 HB2 ASN 43 HB2 ASN 43 -3.912 -16.585 -2.894 322 HB3 ASN 43 HB3 ASN 43 -3.431 -18.260 -3.183 323 HD21 ASN 43 HD22 ASN 43 -4.160 -19.214 -5.366 324 HD22 ASN 43 HD21 ASN 43 -4.023 -18.146 -6.740 325 H LYS 44 H LYS 44 -5.726 -16.508 -0.865 326 HA LYS 44 HA LYS 44 -5.237 -18.576 1.091 327 HB2 LYS 44 HB2 LYS 44 -4.974 -16.102 1.420 328 HB3 LYS 44 HB3 LYS 44 -6.695 -15.911 1.316 329 HG2 LYS 44 HG2 LYS 44 -6.981 -17.443 3.276 330 HG3 LYS 44 HG3 LYS 44 -5.214 -17.608 3.377 331 HD2 LYS 44 HD2 LYS 44 -5.009 -15.182 3.803 332 HD3 LYS 44 HD3 LYS 44 -6.776 -15.002 3.652 333 HE2 LYS 44 HE2 LYS 44 -7.082 -16.602 5.541 334 HE3 LYS 44 HE3 LYS 44 -5.320 -16.702 5.723 335 HZ1 LYS 44 HZ1 LYS 44 -6.290 -15.129 7.248 336 HZ2 LYS 44 HZ2 LYS 44 -5.296 -14.341 6.201 337 HZ3 LYS 44 HZ3 LYS 44 -6.934 -14.252 6.018 338 H ALA 45 H ALA 45 -8.065 -17.043 -0.338 339 HA ALA 45 HA ALA 45 -10.083 -18.487 1.078 340 HB1 ALA 45 HB1 ALA 45 -10.189 -17.250 -1.695 341 HB2 ALA 45 HB2 ALA 45 -11.573 -17.607 -0.650 342 HB3 ALA 45 HB3 ALA 45 -10.413 -16.340 -0.178 343 H MET 46 H MET 46 -7.768 -19.873 -0.826 344 HA MET 46 HA MET 46 -9.557 -22.102 -1.605 345 HB2 MET 46 HB2 MET 46 -8.812 -20.298 -3.482 346 HB3 MET 46 HB3 MET 46 -7.359 -21.304 -3.498 347 HG2 MET 46 HG2 MET 46 -8.952 -22.082 -5.179 348 HG3 MET 46 HG3 MET 46 -8.773 -23.302 -3.913 349 HE1 MET 46 HE1 MET 46 -10.960 -20.486 -5.484 350 HE2 MET 46 HE2 MET 46 -12.428 -20.497 -4.481 351 HE3 MET 46 HE3 MET 46 -10.895 -19.921 -3.798 352 H ALA 47 H ALA 47 -7.046 -21.158 0.242 353 HA ALA 47 HA ALA 47 -5.873 -23.897 0.134 354 HB1 ALA 47 HB1 ALA 47 -4.452 -21.282 0.820 355 HB2 ALA 47 HB2 ALA 47 -3.729 -22.908 0.864 356 HB3 ALA 47 HB3 ALA 47 -4.249 -22.209 -0.688 357 H LEU 48 H LEU 48 -7.179 -21.223 2.055 358 HA LEU 48 HA LEU 48 -6.617 -22.452 4.609 359 HB2 LEU 48 HB2 LEU 48 -6.997 -20.024 4.267 360 HB3 LEU 48 HB3 LEU 48 -8.638 -20.354 3.699 361 HG LEU 48 HG LEU 48 -9.274 -21.192 5.907 362 HD11 LEU 48 HD11 LEU 48 -6.403 -20.534 6.692 363 HD12 LEU 48 HD12 LEU 48 -7.706 -20.952 7.827 364 HD13 LEU 48 HD13 LEU 48 -7.134 -22.154 6.660 365 HD21 LEU 48 HD21 LEU 48 -9.096 -19.044 7.106 366 HD22 LEU 48 HD22 LEU 48 -7.770 -18.545 6.030 367 HD23 LEU 48 HD23 LEU 48 -9.402 -18.763 5.373 368 H ILE 49 H ILE 49 -9.140 -22.651 2.134 369 HA ILE 49 HA ILE 49 -11.068 -24.121 3.634 370 HB ILE 49 HB ILE 49 -11.806 -24.940 1.397 371 HG12 ILE 49 HG12 ILE 49 -9.627 -23.133 0.326 372 HG13 ILE 49 HG13 ILE 49 -9.370 -24.846 0.487 373 HG21 ILE 49 HG21 ILE 49 -12.628 -22.796 2.344 374 HG22 ILE 49 HG22 ILE 49 -11.275 -21.944 1.564 375 HG23 ILE 49 HG23 ILE 49 -12.514 -22.739 0.579 376 HD11 ILE 49 HD11 ILE 49 -11.559 -23.694 -1.207 377 HD12 ILE 49 HD12 ILE 49 -10.038 -24.441 -1.764 378 HD13 ILE 49 HD13 ILE 49 -11.231 -25.424 -0.893 379 H LYS 50 H LYS 50 -8.008 -24.909 2.173 380 HA LYS 50 HA LYS 50 -8.620 -27.602 1.503 381 HB2 LYS 50 HB2 LYS 50 -6.704 -25.807 0.758 382 HB3 LYS 50 HB3 LYS 50 -5.779 -26.764 1.904 383 HG2 LYS 50 HG2 LYS 50 -5.402 -27.925 -0.045 384 HG3 LYS 50 HG3 LYS 50 -6.820 -28.807 0.543 385 HD2 LYS 50 HD2 LYS 50 -6.759 -26.540 -1.504 386 HD3 LYS 50 HD3 LYS 50 -6.949 -28.268 -1.865 387 HE2 LYS 50 HE2 LYS 50 -9.082 -28.192 -0.454 388 HE3 LYS 50 HE3 LYS 50 -8.903 -26.421 -0.448 389 HZ1 LYS 50 HZ1 LYS 50 -10.324 -27.184 -2.225 390 HZ2 LYS 50 HZ2 LYS 50 -8.974 -26.470 -2.840 391 HZ3 LYS 50 HZ3 LYS 50 -9.130 -28.107 -2.847 392 H LEU 51 H LEU 51 -8.302 -26.245 4.488 393 HA LEU 51 HA LEU 51 -6.949 -28.592 5.731 394 HB2 LEU 51 HB2 LEU 51 -7.035 -25.653 6.502 395 HB3 LEU 51 HB3 LEU 51 -6.424 -26.918 7.579 396 HG LEU 51 HG LEU 51 -5.293 -26.490 4.797 397 HD11 LEU 51 HD11 LEU 51 -4.338 -25.370 7.462 398 HD12 LEU 51 HD12 LEU 51 -3.470 -25.265 5.915 399 HD13 LEU 51 HD13 LEU 51 -5.021 -24.428 6.112 400 HD21 LEU 51 HD21 LEU 51 -4.864 -28.694 5.834 401 HD22 LEU 51 HD22 LEU 51 -3.370 -27.729 5.810 402 HD23 LEU 51 HD23 LEU 51 -4.294 -27.893 7.321 403 H GLY 52 H GLY 52 -9.950 -27.226 5.200 404 HA2 GLY 52 HA2 GLY 52 -11.935 -28.108 6.112 405 HA3 GLY 52 HA3 GLY 52 -11.064 -28.597 7.579 406 H GLU 53 H GLU 53 -9.944 -25.558 7.091 407 HA GLU 53 HA GLU 53 -11.686 -24.423 9.125 408 HB2 GLU 53 HB2 GLU 53 -9.319 -23.250 7.592 409 HB3 GLU 53 HB3 GLU 53 -10.121 -22.498 8.968 410 HG2 GLU 53 HG2 GLU 53 -9.565 -24.442 10.392 411 HG3 GLU 53 HG3 GLU 53 -8.718 -25.195 9.035 412 H TYR 54 H TYR 54 -13.357 -24.972 7.052 413 HA TYR 54 HA TYR 54 -13.575 -23.005 5.023 414 HB2 TYR 54 HB2 TYR 54 -15.703 -24.685 6.389 415 HB3 TYR 54 HB3 TYR 54 -15.948 -23.770 4.902 416 HD1 TYR 54 HD1 TYR 54 -14.467 -24.315 2.888 417 HD2 TYR 54 HD2 TYR 54 -14.884 -26.901 6.290 418 HE1 TYR 54 HE1 TYR 54 -13.680 -26.227 1.520 419 HE2 TYR 54 HE2 TYR 54 -14.108 -28.829 4.934 420 HH TYR 54 HH TYR 54 -13.200 -28.476 1.471 421 H THR 55 H THR 55 -14.834 -23.067 8.387 422 HA THR 55 HA THR 55 -16.584 -20.851 8.199 423 HB THR 55 HB THR 55 -14.873 -21.822 10.513 424 HG1 THR 55 HG1 THR 55 -16.770 -22.948 11.038 425 HG21 THR 55 HG21 THR 55 -16.674 -20.786 11.914 426 HG22 THR 55 HG22 THR 55 -15.784 -19.573 10.976 427 HG23 THR 55 HG23 THR 55 -17.394 -20.109 10.433 428 H GLN 56 H GLN 56 -13.065 -21.064 8.496 429 HA GLN 56 HA GLN 56 -12.751 -18.192 8.982 430 HB2 GLN 56 HB2 GLN 56 -10.720 -20.413 8.525 431 HB3 GLN 56 HB3 GLN 56 -10.373 -18.751 8.992 432 HG2 GLN 56 HG2 GLN 56 -10.310 -19.721 11.018 433 HG3 GLN 56 HG3 GLN 56 -12.005 -19.237 11.016 434 HE21 GLN 56 HE22 GLN 56 -10.443 -21.418 12.448 435 HE22 GLN 56 HE21 GLN 56 -11.304 -22.898 12.090 436 H ALA 57 H ALA 57 -13.345 -20.115 6.248 437 HA ALA 57 HA ALA 57 -11.505 -18.544 4.509 438 HB1 ALA 57 HB1 ALA 57 -11.315 -21.014 4.451 439 HB2 ALA 57 HB2 ALA 57 -13.038 -21.126 4.003 440 HB3 ALA 57 HB3 ALA 57 -11.880 -20.352 2.892 441 H ILE 58 H ILE 58 -14.978 -19.440 4.953 442 HA ILE 58 HA ILE 58 -15.932 -17.991 2.665 443 HB ILE 58 HB ILE 58 -17.241 -18.393 5.392 444 HG12 ILE 58 HG12 ILE 58 -17.481 -20.112 2.885 445 HG13 ILE 58 HG13 ILE 58 -16.531 -20.555 4.307 446 HG21 ILE 58 HG21 ILE 58 -19.341 -18.082 4.160 447 HG22 ILE 58 HG22 ILE 58 -18.278 -16.693 3.890 448 HG23 ILE 58 HG23 ILE 58 -18.428 -17.952 2.644 449 HD11 ILE 58 HD11 ILE 58 -18.613 -20.246 5.711 450 HD12 ILE 58 HD12 ILE 58 -19.538 -20.120 4.183 451 HD13 ILE 58 HD13 ILE 58 -18.668 -21.612 4.581 452 H GLN 59 H GLN 59 -14.968 -17.078 5.970 453 HA GLN 59 HA GLN 59 -15.942 -14.407 5.912 454 HB2 GLN 59 HB2 GLN 59 -15.267 -15.735 7.934 455 HB3 GLN 59 HB3 GLN 59 -13.580 -15.605 7.433 456 HG2 GLN 59 HG2 GLN 59 -14.145 -13.942 9.172 457 HG3 GLN 59 HG3 GLN 59 -13.672 -13.155 7.667 458 HE21 GLN 59 HE22 GLN 59 -14.775 -11.213 8.102 459 HE22 GLN 59 HE21 GLN 59 -16.527 -11.112 8.122 460 H MET 60 H MET 60 -13.411 -15.904 4.134 461 HA MET 60 HA MET 60 -12.069 -13.299 3.641 462 HB2 MET 60 HB2 MET 60 -11.336 -16.139 2.827 463 HB3 MET 60 HB3 MET 60 -10.345 -14.706 2.518 464 HG2 MET 60 HG2 MET 60 -11.150 -15.387 5.344 465 HG3 MET 60 HG3 MET 60 -9.888 -16.321 4.556 466 HE1 MET 60 HE1 MET 60 -9.525 -11.781 5.415 467 HE2 MET 60 HE2 MET 60 -10.371 -12.353 3.972 468 HE3 MET 60 HE3 MET 60 -11.028 -12.745 5.585 469 H CYS 61 H CYS 61 -14.173 -15.749 2.187 470 HA CYS 61 HA CYS 61 -13.786 -14.869 -0.534 471 HB2 CYS 61 HB2 CYS 61 -16.072 -16.351 0.864 472 HB3 CYS 61 HB3 CYS 61 -15.919 -16.169 -0.891 473 HG CYS 61 HG CYS 61 -13.737 -17.510 1.203 474 H GLN 62 H GLN 62 -16.263 -14.085 2.010 475 HA GLN 62 HA GLN 62 -17.655 -12.215 0.306 476 HB2 GLN 62 HB2 GLN 62 -17.537 -12.356 3.349 477 HB3 GLN 62 HB3 GLN 62 -18.794 -11.579 2.353 478 HG2 GLN 62 HG2 GLN 62 -19.475 -13.762 1.450 479 HG3 GLN 62 HG3 GLN 62 -18.166 -14.551 2.334 480 HE21 GLN 62 HE22 GLN 62 -19.765 -15.875 3.303 481 HE22 GLN 62 HE21 GLN 62 -20.767 -15.256 4.581 482 H GLN 63 H GLN 63 -14.549 -12.056 1.611 483 HA GLN 63 HA GLN 63 -14.632 -9.089 1.871 484 HB2 GLN 63 HB2 GLN 63 -12.598 -11.184 2.738 485 HB3 GLN 63 HB3 GLN 63 -12.332 -9.438 2.869 486 HG2 GLN 63 HG2 GLN 63 -14.731 -10.780 4.176 487 HG3 GLN 63 HG3 GLN 63 -13.139 -10.693 4.949 488 HE21 GLN 63 HE22 GLN 63 -13.133 -9.175 6.478 489 HE22 GLN 63 HE21 GLN 63 -13.792 -7.565 6.305 490 H GLY 64 H GLY 64 -14.027 -11.507 -0.405 491 HA2 GLY 64 HA2 GLY 64 -11.951 -9.878 -1.797 492 HA3 GLY 64 HA3 GLY 64 -12.398 -11.559 -2.153 493 H LEU 65 H LEU 65 -15.262 -11.193 -1.999 494 HA LEU 65 HA LEU 65 -15.858 -10.243 -4.629 495 HB2 LEU 65 HB2 LEU 65 -17.490 -10.964 -2.174 496 HB3 LEU 65 HB3 LEU 65 -18.273 -10.418 -3.655 497 HG LEU 65 HG LEU 65 -16.350 -12.789 -3.571 498 HD11 LEU 65 HD11 LEU 65 -19.393 -12.724 -3.557 499 HD12 LEU 65 HD12 LEU 65 -18.383 -14.179 -3.703 500 HD13 LEU 65 HD13 LEU 65 -18.359 -13.220 -2.203 501 HD21 LEU 65 HD21 LEU 65 -16.566 -11.763 -5.794 502 HD22 LEU 65 HD22 LEU 65 -17.402 -13.321 -5.745 503 HD23 LEU 65 HD23 LEU 65 -18.337 -11.811 -5.668 504 H ARG 66 H ARG 66 -14.925 -8.435 -2.005 505 HA ARG 66 HA ARG 66 -16.669 -6.118 -2.541 506 HB2 ARG 66 HB2 ARG 66 -14.320 -6.479 -0.634 507 HB3 ARG 66 HB3 ARG 66 -15.463 -5.129 -0.651 508 HG2 ARG 66 HG2 ARG 66 -17.299 -6.720 -0.085 509 HG3 ARG 66 HG3 ARG 66 -16.101 -8.036 -0.023 510 HD2 ARG 66 HD2 ARG 66 -16.513 -7.236 2.235 511 HD3 ARG 66 HD3 ARG 66 -14.869 -6.777 1.747 512 HE ARG 66 HE ARG 66 -16.673 -4.658 1.118 513 HH11 ARG 66 HH11 ARG 66 -15.201 -6.245 3.904 514 HH12 ARG 66 HH12 ARG 66 -15.237 -4.799 4.890 515 HH21 ARG 66 HH21 ARG 66 -16.705 -2.788 2.420 516 HH22 ARG 66 HH22 ARG 66 -16.101 -2.853 4.059 517 H TYR 67 H TYR 67 -14.059 -7.465 -4.045 518 HA TYR 67 HA TYR 67 -12.815 -4.853 -4.768 519 HB2 TYR 67 HB2 TYR 67 -11.404 -7.374 -3.868 520 HB3 TYR 67 HB3 TYR 67 -10.588 -5.951 -4.499 521 HD1 TYR 67 HD2 TYR 67 -11.245 -3.651 -3.267 522 HD2 TYR 67 HD1 TYR 67 -11.623 -7.588 -1.577 523 HE1 TYR 67 HE2 TYR 67 -11.287 -2.665 -0.988 524 HE2 TYR 67 HE1 TYR 67 -11.648 -6.611 0.707 525 HH TYR 67 HH TYR 67 -11.571 -4.703 1.962 526 H THR 68 H THR 68 -14.365 -7.611 -5.813 527 HA THR 68 HA THR 68 -12.909 -7.897 -8.343 528 HB THR 68 HB THR 68 -14.799 -9.524 -8.803 529 HG1 THR 68 HG1 THR 68 -16.346 -8.636 -7.415 530 HG21 THR 68 HG21 THR 68 -12.616 -10.172 -7.836 531 HG22 THR 68 HG22 THR 68 -13.266 -9.883 -6.210 532 HG23 THR 68 HG23 THR 68 -13.945 -11.181 -7.211 533 H SER 69 H SER 69 -14.224 -5.308 -7.500 534 HA SER 69 HA SER 69 -16.611 -4.882 -8.983 535 HB2 SER 69 HB2 SER 69 -14.537 -2.888 -7.996 536 HB3 SER 69 HB3 SER 69 -16.221 -2.534 -8.440 537 HG SER 69 HG SER 69 -15.943 -2.828 -6.178 538 H THR 70 H THR 70 -13.814 -5.721 -10.433 539 HA THR 70 HA THR 70 -14.379 -3.995 -12.786 540 HB THR 70 HB THR 70 -12.057 -3.556 -13.172 541 HG1 THR 70 HG1 THR 70 -10.488 -4.325 -11.709 542 HG21 THR 70 HG21 THR 70 -13.163 -2.026 -11.531 543 HG22 THR 70 HG22 THR 70 -12.535 -3.048 -10.204 544 HG23 THR 70 HG23 THR 70 -11.407 -2.187 -11.268 545 H ALA 71 H ALA 71 -13.328 -4.862 -14.786 546 HA ALA 71 HA ALA 71 -13.916 -7.663 -15.055 547 HB1 ALA 71 HB1 ALA 71 -12.481 -5.732 -16.935 548 HB2 ALA 71 HB2 ALA 71 -13.164 -7.315 -17.383 549 HB3 ALA 71 HB3 ALA 71 -14.243 -6.005 -16.855 550 H GLU 72 H GLU 72 -11.121 -6.084 -13.851 551 HA GLU 72 HA GLU 72 -9.117 -7.858 -14.907 552 HB2 GLU 72 HB2 GLU 72 -9.125 -6.143 -12.420 553 HB3 GLU 72 HB3 GLU 72 -7.699 -6.884 -13.150 554 HG2 GLU 72 HG2 GLU 72 -9.501 -4.795 -14.454 555 HG3 GLU 72 HG3 GLU 72 -7.897 -4.502 -13.773 556 H HIS 73 H HIS 73 -11.676 -8.498 -12.867 557 HA HIS 73 HA HIS 73 -10.285 -10.858 -11.712 558 HB2 HIS 73 HB2 HIS 73 -12.294 -9.366 -10.043 559 HB3 HIS 73 HB3 HIS 73 -10.993 -10.444 -9.532 560 HD2 HIS 73 HD2 HIS 73 -11.895 -6.836 -10.046 561 HE1 HIS 73 HE1 HIS 73 -7.762 -6.792 -9.095 562 HE2 HIS 73 HE2 HIS 73 -9.833 -5.356 -9.399 563 H VAL 74 H VAL 74 -12.185 -10.360 -13.995 564 HA VAL 74 HA VAL 74 -14.852 -10.755 -13.422 565 HB VAL 74 HB VAL 74 -13.816 -10.209 -15.598 566 HG11 VAL 74 HG11 VAL 74 -13.324 -13.203 -15.821 567 HG12 VAL 74 HG12 VAL 74 -13.074 -11.994 -17.091 568 HG13 VAL 74 HG13 VAL 74 -12.062 -11.955 -15.635 569 HG21 VAL 74 HG21 VAL 74 -15.492 -11.340 -16.970 570 HG22 VAL 74 HG22 VAL 74 -15.745 -12.569 -15.716 571 HG23 VAL 74 HG23 VAL 74 -16.204 -10.880 -15.406 572 H ALA 75 H ALA 75 -12.311 -13.205 -13.262 573 HA ALA 75 HA ALA 75 -14.319 -15.366 -13.033 574 HB1 ALA 75 HB1 ALA 75 -12.179 -15.770 -14.214 575 HB2 ALA 75 HB2 ALA 75 -11.276 -15.360 -12.735 576 HB3 ALA 75 HB3 ALA 75 -12.313 -16.802 -12.778 577 H ILE 76 H ILE 76 -11.943 -13.657 -10.882 578 HA ILE 76 HA ILE 76 -12.535 -15.214 -8.567 579 HB ILE 76 HB ILE 76 -11.683 -12.295 -8.748 580 HG12 ILE 76 HG12 ILE 76 -9.998 -14.833 -8.554 581 HG13 ILE 76 HG13 ILE 76 -10.149 -13.811 -9.976 582 HG21 ILE 76 HG21 ILE 76 -10.746 -12.747 -6.469 583 HG22 ILE 76 HG22 ILE 76 -12.497 -12.899 -6.519 584 HG23 ILE 76 HG23 ILE 76 -11.479 -14.362 -6.510 585 HD11 ILE 76 HD11 ILE 76 -8.086 -13.268 -8.885 586 HD12 ILE 76 HD12 ILE 76 -9.193 -11.895 -8.723 587 HD13 ILE 76 HD13 ILE 76 -8.893 -12.980 -7.345 588 H ARG 77 H ARG 77 -14.190 -12.554 -10.158 589 HA ARG 77 HA ARG 77 -15.971 -11.670 -8.175 590 HB2 ARG 77 HB2 ARG 77 -15.503 -10.707 -10.458 591 HB3 ARG 77 HB3 ARG 77 -16.424 -12.045 -11.155 592 HG2 ARG 77 HG2 ARG 77 -18.444 -11.280 -9.889 593 HG3 ARG 77 HG3 ARG 77 -17.491 -9.903 -9.271 594 HD2 ARG 77 HD2 ARG 77 -17.041 -9.188 -11.602 595 HD3 ARG 77 HD3 ARG 77 -17.936 -10.601 -12.199 596 HE ARG 77 HE ARG 77 -19.972 -9.568 -11.665 597 HH11 ARG 77 HH11 ARG 77 -17.279 -7.626 -10.424 598 HH12 ARG 77 HH12 ARG 77 -18.294 -6.244 -10.089 599 HH21 ARG 77 HH21 ARG 77 -21.251 -7.753 -11.196 600 HH22 ARG 77 HH22 ARG 77 -20.527 -6.314 -10.522 601 H SER 78 H SER 78 -15.800 -14.728 -9.747 602 HA SER 78 HA SER 78 -18.505 -15.470 -8.690 603 HB2 SER 78 HB2 SER 78 -18.350 -15.303 -11.202 604 HB3 SER 78 HB3 SER 78 -17.094 -16.566 -11.162 605 HG SER 78 HG SER 78 -18.656 -17.927 -10.150 606 H LYS 79 H LYS 79 -15.039 -16.273 -8.936 607 HA LYS 79 HA LYS 79 -15.404 -19.007 -8.146 608 HB2 LYS 79 HB2 LYS 79 -13.034 -17.108 -8.112 609 HB3 LYS 79 HB3 LYS 79 -12.924 -18.746 -7.498 610 HG2 LYS 79 HG2 LYS 79 -13.586 -17.932 -10.353 611 HG3 LYS 79 HG3 LYS 79 -12.105 -18.696 -9.762 612 HD2 LYS 79 HD2 LYS 79 -14.872 -19.905 -10.053 613 HD3 LYS 79 HD3 LYS 79 -13.341 -20.428 -10.777 614 HE2 LYS 79 HE2 LYS 79 -12.534 -20.893 -8.378 615 HE3 LYS 79 HE3 LYS 79 -14.232 -20.652 -7.877 616 HZ1 LYS 79 HZ1 LYS 79 -13.291 -22.652 -9.839 617 HZ2 LYS 79 HZ2 LYS 79 -13.753 -22.961 -8.288 618 HZ3 LYS 79 HZ3 LYS 79 -14.855 -22.424 -9.382 619 H LEU 80 H LEU 80 -15.179 -15.932 -6.308 620 HA LEU 80 HA LEU 80 -14.737 -17.391 -3.813 621 HB2 LEU 80 HB2 LEU 80 -15.537 -14.508 -4.319 622 HB3 LEU 80 HB3 LEU 80 -14.928 -15.183 -2.797 623 HG LEU 80 HG LEU 80 -13.437 -14.877 -5.424 624 HD11 LEU 80 HD11 LEU 80 -12.970 -13.753 -2.632 625 HD12 LEU 80 HD12 LEU 80 -11.951 -13.454 -4.059 626 HD13 LEU 80 HD13 LEU 80 -13.632 -12.862 -4.026 627 HD21 LEU 80 HD21 LEU 80 -11.486 -15.841 -4.306 628 HD22 LEU 80 HD22 LEU 80 -12.491 -16.245 -2.892 629 HD23 LEU 80 HD23 LEU 80 -12.780 -17.030 -4.466 630 H GLN 81 H GLN 81 -17.424 -16.534 -5.845 631 HA GLN 81 HA GLN 81 -19.438 -16.880 -3.773 632 HB2 GLN 81 HB2 GLN 81 -19.367 -16.158 -6.525 633 HB3 GLN 81 HB3 GLN 81 -20.191 -17.706 -6.498 634 HG2 GLN 81 HG2 GLN 81 -21.005 -15.172 -5.097 635 HG3 GLN 81 HG3 GLN 81 -21.936 -16.152 -6.247 636 HE21 GLN 81 HE22 GLN 81 -21.912 -18.702 -5.306 637 HE22 GLN 81 HE21 GLN 81 -22.398 -18.828 -3.634 638 H TYR 82 H TYR 82 -17.935 -18.810 -6.365 639 HA TYR 82 HA TYR 82 -19.402 -21.179 -6.059 640 HB2 TYR 82 HB2 TYR 82 -18.033 -20.793 -8.026 641 HB3 TYR 82 HB3 TYR 82 -16.642 -20.410 -7.040 642 HD1 TYR 82 HD1 TYR 82 -15.254 -22.193 -6.050 643 HD2 TYR 82 HD2 TYR 82 -18.699 -23.121 -8.468 644 HE1 TYR 82 HE1 TYR 82 -14.493 -24.543 -6.220 645 HE2 TYR 82 HE2 TYR 82 -17.929 -25.472 -8.655 646 HH TYR 82 HH TYR 82 -14.916 -26.628 -7.085 647 H ARG 83 H ARG 83 -16.243 -20.223 -4.479 648 HA ARG 83 HA ARG 83 -16.214 -22.806 -3.156 649 HB2 ARG 83 HB2 ARG 83 -14.145 -21.567 -3.689 650 HB3 ARG 83 HB3 ARG 83 -14.622 -20.258 -2.598 651 HG2 ARG 83 HG2 ARG 83 -12.963 -21.849 -1.600 652 HG3 ARG 83 HG3 ARG 83 -14.458 -21.729 -0.671 653 HD2 ARG 83 HD2 ARG 83 -13.768 -24.050 -0.807 654 HD3 ARG 83 HD3 ARG 83 -15.266 -23.835 -1.706 655 HE ARG 83 HE ARG 83 -13.002 -23.528 -3.449 656 HH11 ARG 83 HH11 ARG 83 -14.867 -25.983 -1.725 657 HH12 ARG 83 HH12 ARG 83 -14.452 -27.253 -2.848 658 HH21 ARG 83 HH21 ARG 83 -12.471 -25.203 -4.891 659 HH22 ARG 83 HH22 ARG 83 -13.099 -26.808 -4.638 660 H LEU 84 H LEU 84 -17.681 -19.686 -2.495 661 HA LEU 84 HA LEU 84 -18.082 -20.126 0.323 662 HB2 LEU 84 HB2 LEU 84 -18.008 -17.925 -0.650 663 HB3 LEU 84 HB3 LEU 84 -19.363 -18.264 -1.734 664 HG LEU 84 HG LEU 84 -19.792 -18.593 1.207 665 HD11 LEU 84 HD11 LEU 84 -18.563 -16.436 0.994 666 HD12 LEU 84 HD12 LEU 84 -19.720 -15.908 -0.240 667 HD13 LEU 84 HD13 LEU 84 -20.266 -16.166 1.431 668 HD21 LEU 84 HD21 LEU 84 -21.530 -17.476 -1.017 669 HD22 LEU 84 HD22 LEU 84 -21.631 -19.110 -0.342 670 HD23 LEU 84 HD23 LEU 84 -22.020 -17.719 0.676 671 H GLU 85 H GLU 85 -19.919 -20.858 -2.673 672 HA GLU 85 HA GLU 85 -22.274 -21.683 -1.202 673 HB2 GLU 85 HB2 GLU 85 -23.053 -22.529 -3.340 674 HB3 GLU 85 HB3 GLU 85 -22.415 -20.869 -3.513 675 HG2 GLU 85 HG2 GLU 85 -20.438 -21.623 -4.496 676 HG3 GLU 85 HG3 GLU 85 -20.928 -23.307 -4.312 677 H LEU 86 H LEU 86 -19.415 -23.358 -2.509 678 HA LEU 86 HA LEU 86 -20.308 -25.983 -1.649 679 HB2 LEU 86 HB2 LEU 86 -17.646 -24.781 -2.459 680 HB3 LEU 86 HB3 LEU 86 -17.682 -26.332 -1.627 681 HG LEU 86 HG LEU 86 -17.538 -26.770 -3.949 682 HD11 LEU 86 HD11 LEU 86 -20.422 -27.296 -3.149 683 HD12 LEU 86 HD12 LEU 86 -19.435 -28.202 -4.309 684 HD13 LEU 86 HD13 LEU 86 -19.020 -28.241 -2.583 685 HD21 LEU 86 HD21 LEU 86 -18.407 -24.686 -4.842 686 HD22 LEU 86 HD22 LEU 86 -19.246 -26.070 -5.568 687 HD23 LEU 86 HD23 LEU 86 -20.056 -25.118 -4.309 688 H ALA 87 H ALA 87 -18.603 -23.278 -0.026 689 HA ALA 87 HA ALA 87 -17.689 -24.843 2.191 690 HB1 ALA 87 HB1 ALA 87 -18.346 -21.871 2.031 691 HB2 ALA 87 HB2 ALA 87 -17.362 -22.674 3.283 692 HB3 ALA 87 HB3 ALA 87 -16.785 -22.618 1.621 693 H GLN 88 H GLN 88 -20.741 -23.120 1.493 694 HA GLN 88 HA GLN 88 -21.924 -23.567 4.078 695 HB2 GLN 88 HB2 GLN 88 -22.987 -22.884 1.313 696 HB3 GLN 88 HB3 GLN 88 -24.034 -23.010 2.729 697 HG2 GLN 88 HG2 GLN 88 -21.647 -21.128 2.532 698 HG3 GLN 88 HG3 GLN 88 -23.322 -20.668 2.212 699 HE21 GLN 88 HE22 GLN 88 -21.826 -19.340 4.151 700 HE22 GLN 88 HE21 GLN 88 -22.467 -19.724 5.737 701 H GLY 89 H GLY 89 -20.838 -25.842 2.053 702 HA2 GLY 89 HA2 GLY 89 -22.944 -27.784 2.808 703 HA3 GLY 89 HA3 GLY 89 -22.369 -27.697 1.133 704 H ALA 90 H ALA 90 -19.997 -26.925 3.531 705 HA ALA 90 HA ALA 90 -19.020 -29.716 3.709 706 HB1 ALA 90 HB1 ALA 90 -17.363 -27.353 2.725 707 HB2 ALA 90 HB2 ALA 90 -16.760 -28.997 3.039 708 HB3 ALA 90 HB3 ALA 90 -17.935 -28.716 1.731 709 H VAL 91 H VAL 91 -19.385 -26.511 5.032 710 HA VAL 91 HA VAL 91 -17.512 -26.783 7.202 711 HB VAL 91 HB VAL 91 -18.483 -24.687 6.204 712 HG11 VAL 91 HG11 VAL 91 -20.643 -23.864 7.000 713 HG12 VAL 91 HG12 VAL 91 -20.862 -25.384 6.128 714 HG13 VAL 91 HG13 VAL 91 -20.909 -25.368 7.906 715 HG21 VAL 91 HG21 VAL 91 -18.539 -23.458 8.313 716 HG22 VAL 91 HG22 VAL 91 -18.830 -24.960 9.215 717 HG23 VAL 91 HG23 VAL 91 -17.277 -24.714 8.381 718 H GLY 92 H GLY 92 -20.424 -28.274 6.478 719 HA2 GLY 92 HA2 GLY 92 -20.867 -29.131 9.300 720 HA3 GLY 92 HA3 GLY 92 -22.224 -28.663 8.252 721 H SER 93 H SER 93 -19.335 -30.368 7.132 722 HA SER 93 HA SER 93 -20.860 -32.912 6.835 723 HB2 SER 93 HB2 SER 93 -19.260 -31.550 4.645 724 HB3 SER 93 HB3 SER 93 -20.106 -33.104 4.525 725 HG SER 93 HG SER 93 -21.316 -31.342 3.661 726 H VAL 94 H VAL 94 -18.979 -34.420 5.549 727 HA VAL 94 HA VAL 94 -16.559 -34.233 7.238 728 HB VAL 94 HB VAL 94 -18.300 -36.691 6.960 729 HG11 VAL 94 HG11 VAL 94 -15.702 -36.189 8.480 730 HG12 VAL 94 HG12 VAL 94 -16.680 -37.667 8.583 731 HG13 VAL 94 HG13 VAL 94 -15.895 -37.234 7.055 732 HG21 VAL 94 HG21 VAL 94 -19.275 -35.068 8.532 733 HG22 VAL 94 HG22 VAL 94 -18.589 -36.444 9.424 734 HG23 VAL 94 HG23 VAL 94 -17.700 -34.901 9.347 735 H GLN 95 H GLN 95 -15.114 -33.922 5.748 736 HA GLN 95 HA GLN 95 -14.764 -35.963 3.635 737 HB2 GLN 95 HB2 GLN 95 -14.090 -34.220 2.044 738 HB3 GLN 95 HB3 GLN 95 -15.769 -33.980 2.610 739 HG2 GLN 95 HG2 GLN 95 -13.540 -32.475 3.952 740 HG3 GLN 95 HG3 GLN 95 -14.220 -31.912 2.420 741 HE21 GLN 95 HE22 GLN 95 -14.552 -31.606 5.730 742 HE22 GLN 95 HE21 GLN 95 -16.251 -31.164 5.772 743 H ILE 96 H ILE 96 -13.636 -34.995 6.417 744 HA ILE 96 HA ILE 96 -10.833 -35.650 5.785 745 HB ILE 96 HB ILE 96 -10.079 -33.830 7.343 746 HG12 ILE 96 HG12 ILE 96 -12.918 -32.778 7.012 747 HG13 ILE 96 HG13 ILE 96 -12.244 -33.473 8.497 748 HG21 ILE 96 HG21 ILE 96 -10.115 -32.071 5.684 749 HG22 ILE 96 HG22 ILE 96 -9.988 -33.628 4.853 750 HG23 ILE 96 HG23 ILE 96 -11.550 -32.775 4.902 751 HD11 ILE 96 HD11 ILE 96 -11.276 -30.943 7.097 752 HD12 ILE 96 HD12 ILE 96 -12.158 -31.044 8.630 753 HD13 ILE 96 HD13 ILE 96 -10.506 -31.689 8.520 754 HA PRO 97 HA PRO 97 -11.055 -38.171 9.396 755 HB2 PRO 97 HB2 PRO 97 -8.771 -36.555 10.525 756 HB3 PRO 97 HB3 PRO 97 -8.958 -38.344 10.449 757 HG2 PRO 97 HG2 PRO 97 -7.371 -37.083 8.656 758 HG3 PRO 97 HG3 PRO 97 -8.509 -38.355 8.097 759 HD2 PRO 97 HD2 PRO 97 -8.842 -35.354 7.987 760 HD3 PRO 97 HD3 PRO 97 -9.205 -36.569 6.725 761 H VAL 98 H VAL 98 -11.674 -38.253 11.627 762 HA VAL 98 HA VAL 98 -12.367 -35.673 12.891 763 HB VAL 98 HB VAL 98 -14.436 -37.884 12.678 764 HG11 VAL 98 HG11 VAL 98 -15.989 -35.990 13.120 765 HG12 VAL 98 HG12 VAL 98 -14.808 -36.152 14.422 766 HG13 VAL 98 HG13 VAL 98 -14.604 -34.879 13.202 767 HG21 VAL 98 HG21 VAL 98 -13.985 -37.214 10.362 768 HG22 VAL 98 HG22 VAL 98 -15.537 -36.561 10.903 769 HG23 VAL 98 HG23 VAL 98 -14.117 -35.499 10.814 770 H VAL 99 H VAL 99 -10.495 -38.111 13.267 771 HA VAL 99 HA VAL 99 -11.225 -38.626 16.096 772 HB VAL 99 HB VAL 99 -10.559 -40.993 15.832 773 HG11 VAL 99 HG11 VAL 99 -12.771 -40.186 13.899 774 HG12 VAL 99 HG12 VAL 99 -12.570 -41.762 14.681 775 HG13 VAL 99 HG13 VAL 99 -12.949 -40.333 15.668 776 HG21 VAL 99 HG21 VAL 99 -9.094 -40.769 13.847 777 HG22 VAL 99 HG22 VAL 99 -10.364 -41.975 13.573 778 HG23 VAL 99 HG23 VAL 99 -10.508 -40.368 12.847 779 H GLU 100 H GLU 100 -8.963 -37.235 14.121 780 HA GLU 100 HA GLU 100 -6.521 -38.287 15.090 781 HB2 GLU 100 HB2 GLU 100 -7.496 -35.695 13.806 782 HB3 GLU 100 HB3 GLU 100 -5.823 -36.047 14.127 783 HG2 GLU 100 HG2 GLU 100 -7.628 -37.735 12.386 784 HG3 GLU 100 HG3 GLU 100 -6.429 -36.576 11.792 785 H VAL 101 H VAL 101 -4.977 -36.823 16.318 786 HA VAL 101 HA VAL 101 -6.262 -35.142 18.360 787 HB VAL 101 HB VAL 101 -6.092 -37.550 19.057 788 HG11 VAL 101 HG11 VAL 101 -3.920 -38.449 19.734 789 HG12 VAL 101 HG12 VAL 101 -3.929 -38.079 17.996 790 HG13 VAL 101 HG13 VAL 101 -3.099 -36.992 19.133 791 HG21 VAL 101 HG21 VAL 101 -4.437 -35.617 20.740 792 HG22 VAL 101 HG22 VAL 101 -6.215 -35.654 20.682 793 HG23 VAL 101 HG23 VAL 101 -5.310 -37.048 21.316 794 H ASP 102 H ASP 102 -4.675 -33.800 19.535 795 HA ASP 102 HA ASP 102 -2.007 -33.589 18.376 796 HB2 ASP 102 HB2 ASP 102 -3.631 -32.286 16.946 797 HB3 ASP 102 HB3 ASP 102 -3.942 -31.254 18.341 798 H GLU 103 H GLU 103 -3.217 -34.280 20.876 799 HA GLU 103 HA GLU 103 -1.933 -32.305 22.682 800 HB2 GLU 103 HB2 GLU 103 -4.558 -33.696 23.280 801 HB3 GLU 103 HB3 GLU 103 -3.781 -32.398 24.189 802 HG2 GLU 103 HG2 GLU 103 -4.020 -30.957 22.092 803 HG3 GLU 103 HG3 GLU 103 -5.055 -32.229 21.431 804 H LEU 104 H LEU 104 -2.173 -33.423 25.047 805 HA LEU 104 HA LEU 104 -0.324 -35.602 25.019 806 HB2 LEU 104 HB2 LEU 104 -2.069 -34.454 27.218 807 HB3 LEU 104 HB3 LEU 104 -0.812 -35.611 27.496 808 HG LEU 104 HG LEU 104 0.002 -33.482 28.112 809 HD11 LEU 104 HD11 LEU 104 1.591 -35.047 27.000 810 HD12 LEU 104 HD12 LEU 104 1.277 -34.240 25.442 811 HD13 LEU 104 HD13 LEU 104 2.032 -33.339 26.769 812 HD21 LEU 104 HD21 LEU 104 0.220 -31.575 26.687 813 HD22 LEU 104 HD22 LEU 104 -0.399 -32.463 25.273 814 HD23 LEU 104 HD23 LEU 104 -1.481 -32.092 26.648 815 HA PRO 105 HA PRO 105 -3.038 -39.030 24.925 816 HB2 PRO 105 HB2 PRO 105 -1.570 -40.981 26.112 817 HB3 PRO 105 HB3 PRO 105 -0.965 -40.131 24.662 818 HG2 PRO 105 HG2 PRO 105 -0.260 -39.627 27.559 819 HG3 PRO 105 HG3 PRO 105 0.836 -39.716 26.134 820 HD2 PRO 105 HD2 PRO 105 -0.212 -37.403 27.282 821 HD3 PRO 105 HD3 PRO 105 0.375 -37.460 25.608 822 H GLU 106 H GLU 106 -3.267 -37.155 27.385 823 HA GLU 106 HA GLU 106 -4.432 -37.049 29.319 824 HB2 GLU 106 HB2 GLU 106 -5.849 -39.421 28.064 825 HB3 GLU 106 HB3 GLU 106 -6.448 -38.512 29.467 826 HG2 GLU 106 HG2 GLU 106 -6.446 -36.428 28.113 827 HG3 GLU 106 HG3 GLU 106 -5.900 -37.353 26.702 828 H GLY 107 H GLY 107 -1.966 -38.744 29.229 829 HA2 GLY 107 HA2 GLY 107 -2.294 -39.921 31.911 830 HA3 GLY 107 HA3 GLY 107 -1.772 -41.013 30.612 831 H TYR 108 H TYR 108 -0.751 -37.763 30.176 832 HA TYR 108 HA TYR 108 2.012 -38.394 30.353 833 HB2 TYR 108 HB2 TYR 108 2.397 -36.103 29.847 834 HB3 TYR 108 HB3 TYR 108 1.023 -36.656 28.894 835 HD1 TYR 108 HD2 TYR 108 -1.367 -36.186 29.984 836 HD2 TYR 108 HD1 TYR 108 2.260 -34.090 30.962 837 HE1 TYR 108 HE2 TYR 108 -2.704 -34.274 30.815 838 HE2 TYR 108 HE1 TYR 108 0.923 -32.160 31.790 839 HH TYR 108 HH TYR 108 -1.178 -31.318 32.140 840 H ASP 109 H ASP 109 3.513 -36.831 31.661 841 HA ASP 109 HA ASP 109 3.181 -37.619 34.396 842 HB2 ASP 109 HB2 ASP 109 5.327 -37.542 33.088 843 HB3 ASP 109 HB3 ASP 109 5.260 -35.771 33.153 844 H ARG 110 H ARG 110 1.234 -35.611 33.298 845 HA ARG 110 HA ARG 110 0.203 -33.670 33.799 846 HB2 ARG 110 HB2 ARG 110 1.137 -34.310 36.595 847 HB3 ARG 110 HB3 ARG 110 -0.263 -33.343 36.134 848 HG2 ARG 110 HG2 ARG 110 0.108 -36.330 35.664 849 HG3 ARG 110 HG3 ARG 110 -0.997 -35.560 36.806 850 HD2 ARG 110 HD2 ARG 110 -1.131 -35.344 33.773 851 HD3 ARG 110 HD3 ARG 110 -2.182 -36.320 34.800 852 HE ARG 110 HE ARG 110 -2.229 -33.559 35.642 853 HH11 ARG 110 HH11 ARG 110 -3.446 -35.724 33.133 854 HH12 ARG 110 HH12 ARG 110 -4.858 -34.743 32.806 855 HH21 ARG 110 HH21 ARG 110 -4.067 -32.286 35.177 856 HH22 ARG 110 HH22 ARG 110 -5.197 -32.799 33.952 857 H SER 111 H SER 111 3.174 -33.446 33.183 858 HA SER 111 HA SER 111 3.414 -30.609 33.906 859 HB2 SER 111 HB2 SER 111 4.487 -31.813 35.797 860 HB3 SER 111 HB3 SER 111 5.546 -32.654 34.644 861 HG SER 111 HG SER 111 6.366 -30.615 34.016 Start of MODEL 7 1 H1 SER 2 H1 SER 2 5.312 -4.353 -5.785 2 H2 SER 2 H2 SER 2 6.708 -4.242 -6.650 3 H3 SER 2 H3 SER 2 5.996 -2.887 -6.062 4 HA SER 2 HA SER 2 7.894 -3.424 -4.765 5 HB2 SER 2 HB2 SER 2 6.770 -3.562 -2.530 6 HB3 SER 2 HB3 SER 2 6.104 -2.311 -3.605 7 HG SER 2 HG SER 2 4.458 -3.532 -2.603 8 H GLN 3 H GLN 3 5.653 -5.777 -3.322 9 HA GLN 3 HA GLN 3 7.316 -8.044 -4.194 10 HB2 GLN 3 HB2 GLN 3 8.411 -6.993 -2.174 11 HB3 GLN 3 HB3 GLN 3 6.962 -7.386 -1.237 12 HG2 GLN 3 HG2 GLN 3 7.342 -9.794 -1.655 13 HG3 GLN 3 HG3 GLN 3 8.700 -9.411 -2.719 14 HE21 GLN 3 HE22 GLN 3 9.733 -10.988 -1.124 15 HE22 GLN 3 HE21 GLN 3 10.459 -10.285 0.304 16 H PHE 4 H PHE 4 4.336 -6.693 -3.613 17 HA PHE 4 HA PHE 4 2.796 -8.568 -2.228 18 HB2 PHE 4 HB2 PHE 4 2.012 -6.389 -2.938 19 HB3 PHE 4 HB3 PHE 4 2.178 -6.804 -4.623 20 HD1 PHE 4 HD2 PHE 4 0.737 -8.980 -5.378 21 HD2 PHE 4 HD1 PHE 4 -0.117 -6.432 -2.024 22 HE1 PHE 4 HE2 PHE 4 -1.600 -9.771 -5.385 23 HE2 PHE 4 HE1 PHE 4 -2.487 -7.174 -2.086 24 HZ PHE 4 HZ PHE 4 -3.231 -8.843 -3.753 25 H GLU 5 H GLU 5 3.623 -8.509 -5.729 26 HA GLU 5 HA GLU 5 2.081 -10.948 -6.190 27 HB2 GLU 5 HB2 GLU 5 3.941 -9.314 -7.959 28 HB3 GLU 5 HB3 GLU 5 3.043 -10.752 -8.500 29 HG2 GLU 5 HG2 GLU 5 0.910 -9.673 -7.815 30 HG3 GLU 5 HG3 GLU 5 1.813 -8.210 -7.355 31 H LYS 6 H LYS 6 5.403 -10.289 -5.238 32 HA LYS 6 HA LYS 6 6.397 -12.808 -6.328 33 HB2 LYS 6 HB2 LYS 6 7.551 -10.795 -4.349 34 HB3 LYS 6 HB3 LYS 6 8.418 -12.194 -4.985 35 HG2 LYS 6 HG2 LYS 6 7.393 -9.825 -6.596 36 HG3 LYS 6 HG3 LYS 6 9.079 -10.227 -6.211 37 HD2 LYS 6 HD2 LYS 6 8.836 -12.357 -7.508 38 HD3 LYS 6 HD3 LYS 6 7.190 -11.836 -7.975 39 HE2 LYS 6 HE2 LYS 6 8.101 -9.799 -8.999 40 HE3 LYS 6 HE3 LYS 6 9.741 -10.275 -8.528 41 HZ1 LYS 6 HZ1 LYS 6 9.515 -12.216 -9.911 42 HZ2 LYS 6 HZ2 LYS 6 7.984 -11.790 -10.348 43 HZ3 LYS 6 HZ3 LYS 6 9.268 -10.860 -10.805 44 H GLN 7 H GLN 7 5.667 -11.546 -2.993 45 HA GLN 7 HA GLN 7 6.389 -13.940 -1.689 46 HB2 GLN 7 HB2 GLN 7 5.485 -11.419 -0.967 47 HB3 GLN 7 HB3 GLN 7 4.120 -12.438 -0.526 48 HG2 GLN 7 HG2 GLN 7 7.015 -12.761 0.341 49 HG3 GLN 7 HG3 GLN 7 5.659 -12.221 1.356 50 HE21 GLN 7 HE22 GLN 7 3.724 -13.883 1.391 51 HE22 GLN 7 HE21 GLN 7 4.188 -15.559 1.546 52 H LYS 8 H LYS 8 3.425 -12.941 -3.311 53 HA LYS 8 HA LYS 8 1.697 -15.025 -2.324 54 HB2 LYS 8 HB2 LYS 8 1.064 -12.771 -3.153 55 HB3 LYS 8 HB3 LYS 8 1.589 -13.232 -4.747 56 HG2 LYS 8 HG2 LYS 8 -0.171 -15.168 -4.549 57 HG3 LYS 8 HG3 LYS 8 -0.798 -14.262 -3.189 58 HD2 LYS 8 HD2 LYS 8 -2.032 -13.553 -5.155 59 HD3 LYS 8 HD3 LYS 8 -0.919 -12.223 -4.778 60 HE2 LYS 8 HE2 LYS 8 0.657 -12.881 -6.447 61 HE3 LYS 8 HE3 LYS 8 -0.104 -14.466 -6.640 62 HZ1 LYS 8 HZ1 LYS 8 -1.336 -11.884 -7.377 63 HZ2 LYS 8 HZ2 LYS 8 -0.657 -12.946 -8.435 64 HZ3 LYS 8 HZ3 LYS 8 -2.010 -13.368 -7.603 65 H GLU 9 H GLU 9 3.975 -14.788 -5.084 66 HA GLU 9 HA GLU 9 2.900 -17.241 -6.276 67 HB2 GLU 9 HB2 GLU 9 3.547 -15.263 -7.630 68 HB3 GLU 9 HB3 GLU 9 5.222 -15.427 -7.048 69 HG2 GLU 9 HG2 GLU 9 5.355 -17.663 -8.024 70 HG3 GLU 9 HG3 GLU 9 3.658 -17.550 -8.533 71 H GLN 10 H GLN 10 5.611 -16.102 -4.293 72 HA GLN 10 HA GLN 10 7.307 -18.392 -4.631 73 HB2 GLN 10 HB2 GLN 10 7.070 -16.202 -2.535 74 HB3 GLN 10 HB3 GLN 10 8.304 -17.478 -2.439 75 HG2 GLN 10 HG2 GLN 10 9.208 -16.853 -4.616 76 HG3 GLN 10 HG3 GLN 10 7.981 -15.614 -4.837 77 HE21 GLN 10 HE22 GLN 10 10.987 -15.446 -4.669 78 HE22 GLN 10 HE21 GLN 10 11.293 -14.271 -3.403 79 H GLY 11 H GLY 11 4.242 -18.415 -3.435 80 HA2 GLY 11 HA2 GLY 11 4.866 -20.725 -1.655 81 HA3 GLY 11 HA3 GLY 11 3.663 -19.519 -1.201 82 H ASN 12 H ASN 12 3.502 -19.806 -4.579 83 HA ASN 12 HA ASN 12 1.007 -21.182 -4.486 84 HB2 ASN 12 HB2 ASN 12 0.912 -20.780 -6.734 85 HB3 ASN 12 HB3 ASN 12 2.180 -19.626 -6.332 86 HD21 ASN 12 HD22 ASN 12 4.396 -20.217 -6.840 87 HD22 ASN 12 HD21 ASN 12 4.702 -21.419 -8.078 88 H SER 13 H SER 13 4.329 -22.265 -4.743 89 HA SER 13 HA SER 13 3.645 -24.969 -5.575 90 HB2 SER 13 HB2 SER 13 6.049 -25.407 -5.020 91 HB3 SER 13 HB3 SER 13 5.836 -24.032 -6.130 92 HG SER 13 HG SER 13 7.281 -23.572 -4.401 93 H LEU 14 H LEU 14 4.244 -23.282 -2.469 94 HA LEU 14 HA LEU 14 4.379 -25.598 -0.823 95 HB2 LEU 14 HB2 LEU 14 3.720 -22.662 -0.471 96 HB3 LEU 14 HB3 LEU 14 3.427 -23.778 0.852 97 HG LEU 14 HG LEU 14 5.751 -24.472 0.910 98 HD11 LEU 14 HD11 LEU 14 6.159 -22.490 -1.379 99 HD12 LEU 14 HD12 LEU 14 7.451 -23.265 -0.450 100 HD13 LEU 14 HD13 LEU 14 6.389 -24.256 -1.457 101 HD21 LEU 14 HD21 LEU 14 5.427 -21.444 0.802 102 HD22 LEU 14 HD22 LEU 14 5.006 -22.488 2.181 103 HD23 LEU 14 HD23 LEU 14 6.701 -22.331 1.672 104 H PHE 15 H PHE 15 1.684 -23.752 -2.203 105 HA PHE 15 HA PHE 15 -0.428 -25.013 -0.727 106 HB2 PHE 15 HB2 PHE 15 -0.739 -22.900 -1.876 107 HB3 PHE 15 HB3 PHE 15 -0.206 -23.597 -3.398 108 HD1 PHE 15 HD2 PHE 15 -2.890 -24.143 -0.819 109 HD2 PHE 15 HD1 PHE 15 -1.721 -24.282 -4.938 110 HE1 PHE 15 HE2 PHE 15 -5.239 -24.611 -1.462 111 HE2 PHE 15 HE1 PHE 15 -4.093 -24.727 -5.600 112 HZ PHE 15 HZ PHE 15 -5.848 -24.869 -3.843 113 H LYS 16 H LYS 16 1.700 -26.237 -3.070 114 HA LYS 16 HA LYS 16 -0.231 -28.360 -3.883 115 HB2 LYS 16 HB2 LYS 16 2.187 -27.279 -5.366 116 HB3 LYS 16 HB3 LYS 16 1.060 -28.527 -5.961 117 HG2 LYS 16 HG2 LYS 16 -0.794 -26.935 -5.947 118 HG3 LYS 16 HG3 LYS 16 0.216 -25.708 -5.170 119 HD2 LYS 16 HD2 LYS 16 1.745 -25.737 -7.162 120 HD3 LYS 16 HD3 LYS 16 0.558 -26.793 -7.980 121 HE2 LYS 16 HE2 LYS 16 -1.195 -25.048 -7.538 122 HE3 LYS 16 HE3 LYS 16 0.054 -24.020 -6.804 123 HZ1 LYS 16 HZ1 LYS 16 1.203 -23.953 -8.877 124 HZ2 LYS 16 HZ2 LYS 16 0.108 -24.954 -9.595 125 HZ3 LYS 16 HZ3 LYS 16 -0.350 -23.450 -9.109 126 H GLN 17 H GLN 17 2.490 -27.778 -1.937 127 HA GLN 17 HA GLN 17 3.794 -30.368 -2.356 128 HB2 GLN 17 HB2 GLN 17 4.192 -28.150 -0.360 129 HB3 GLN 17 HB3 GLN 17 5.077 -29.689 -0.332 130 HG2 GLN 17 HG2 GLN 17 5.723 -29.279 -2.756 131 HG3 GLN 17 HG3 GLN 17 5.067 -27.661 -2.575 132 HE21 GLN 17 HE22 GLN 17 5.794 -26.798 -0.143 133 HE22 GLN 17 HE21 GLN 17 7.525 -26.811 0.041 134 H GLY 18 H GLY 18 1.061 -29.231 -0.477 135 HA2 GLY 18 HA2 GLY 18 -0.399 -30.720 0.615 136 HA3 GLY 18 HA3 GLY 18 0.893 -31.918 0.764 137 H LEU 19 H LEU 19 1.489 -28.565 1.640 138 HA LEU 19 HA LEU 19 1.205 -29.183 4.527 139 HB2 LEU 19 HB2 LEU 19 3.373 -27.905 4.867 140 HB3 LEU 19 HB3 LEU 19 3.463 -29.558 4.259 141 HG LEU 19 HG LEU 19 3.829 -28.749 1.963 142 HD11 LEU 19 HD11 LEU 19 3.902 -25.981 3.238 143 HD12 LEU 19 HD12 LEU 19 4.353 -26.375 1.565 144 HD13 LEU 19 HD13 LEU 19 2.671 -26.572 2.094 145 HD21 LEU 19 HD21 LEU 19 6.105 -27.883 2.352 146 HD22 LEU 19 HD22 LEU 19 5.685 -27.533 4.049 147 HD23 LEU 19 HD23 LEU 19 5.721 -29.214 3.471 148 H TYR 20 H TYR 20 -0.741 -28.045 3.217 149 HA TYR 20 HA TYR 20 -0.777 -25.501 2.321 150 HB2 TYR 20 HB2 TYR 20 -2.953 -26.718 4.016 151 HB3 TYR 20 HB3 TYR 20 -3.142 -25.529 2.722 152 HD1 TYR 20 HD2 TYR 20 -2.504 -26.276 0.328 153 HD2 TYR 20 HD1 TYR 20 -3.085 -29.004 3.598 154 HE1 TYR 20 HE2 TYR 20 -2.967 -28.100 -1.278 155 HE2 TYR 20 HE1 TYR 20 -3.527 -30.839 2.005 156 HH TYR 20 HH TYR 20 -3.673 -31.457 -0.211 157 H ARG 21 H ARG 21 -0.422 -26.229 5.788 158 HA ARG 21 HA ARG 21 -1.625 -23.841 6.742 159 HB2 ARG 21 HB2 ARG 21 -0.198 -26.081 7.811 160 HB3 ARG 21 HB3 ARG 21 0.651 -24.633 8.378 161 HG2 ARG 21 HG2 ARG 21 -2.332 -25.181 8.650 162 HG3 ARG 21 HG3 ARG 21 -1.127 -25.327 9.943 163 HD2 ARG 21 HD2 ARG 21 -0.615 -22.940 9.801 164 HD3 ARG 21 HD3 ARG 21 -1.745 -22.742 8.454 165 HE ARG 21 HE ARG 21 -2.408 -22.972 11.287 166 HH11 ARG 21 HH11 ARG 21 -3.616 -23.351 7.990 167 HH12 ARG 21 HH12 ARG 21 -5.296 -23.200 8.466 168 HH21 ARG 21 HH21 ARG 21 -4.611 -22.777 11.869 169 HH22 ARG 21 HH22 ARG 21 -5.854 -22.885 10.635 170 H GLU 22 H GLU 22 1.502 -24.441 5.263 171 HA GLU 22 HA GLU 22 2.636 -21.839 5.959 172 HB2 GLU 22 HB2 GLU 22 3.272 -23.746 3.673 173 HB3 GLU 22 HB3 GLU 22 4.337 -22.483 4.322 174 HG2 GLU 22 HG2 GLU 22 3.351 -24.878 5.934 175 HG3 GLU 22 HG3 GLU 22 4.840 -24.838 5.014 176 H ALA 23 H ALA 23 0.837 -23.368 3.360 177 HA ALA 23 HA ALA 23 1.012 -21.260 1.435 178 HB1 ALA 23 HB1 ALA 23 0.626 -23.679 0.963 179 HB2 ALA 23 HB2 ALA 23 -1.008 -23.504 1.654 180 HB3 ALA 23 HB3 ALA 23 -0.577 -22.600 0.198 181 H VAL 24 H VAL 24 -0.702 -21.241 4.348 182 HA VAL 24 HA VAL 24 -2.947 -19.576 3.326 183 HB VAL 24 HB VAL 24 -1.908 -20.272 6.116 184 HG11 VAL 24 HG11 VAL 24 -4.105 -19.411 6.923 185 HG12 VAL 24 HG12 VAL 24 -3.163 -18.147 6.124 186 HG13 VAL 24 HG13 VAL 24 -4.517 -18.911 5.268 187 HG21 VAL 24 HG21 VAL 24 -4.355 -21.319 4.568 188 HG22 VAL 24 HG22 VAL 24 -2.891 -22.251 4.937 189 HG23 VAL 24 HG23 VAL 24 -3.953 -21.725 6.256 190 H HIS 25 H HIS 25 -0.033 -19.600 5.178 191 HA HIS 25 HA HIS 25 0.153 -16.842 5.907 192 HB2 HIS 25 HB2 HIS 25 1.333 -19.473 6.361 193 HB3 HIS 25 HB3 HIS 25 2.566 -18.294 6.143 194 HD2 HIS 25 HD2 HIS 25 2.914 -16.541 8.198 195 HE1 HIS 25 HE1 HIS 25 -0.251 -17.962 10.669 196 HE2 HIS 25 HE2 HIS 25 1.772 -16.403 10.555 197 H CYS 26 H CYS 26 0.384 -18.030 2.888 198 HA CYS 26 HA CYS 26 2.736 -16.348 2.159 199 HB2 CYS 26 HB2 CYS 26 3.051 -17.779 0.286 200 HB3 CYS 26 HB3 CYS 26 2.851 -18.814 1.726 201 HG CYS 26 HG CYS 26 0.576 -17.923 -0.504 202 H TYR 27 H TYR 27 -0.562 -16.555 2.065 203 HA TYR 27 HA TYR 27 -0.715 -14.518 -0.145 204 HB2 TYR 27 HB2 TYR 27 -2.962 -16.208 0.922 205 HB3 TYR 27 HB3 TYR 27 -2.998 -15.201 -0.525 206 HD1 TYR 27 HD1 TYR 27 -0.582 -16.031 -1.984 207 HD2 TYR 27 HD2 TYR 27 -3.359 -18.357 0.324 208 HE1 TYR 27 HE1 TYR 27 -0.048 -18.032 -3.350 209 HE2 TYR 27 HE2 TYR 27 -2.811 -20.364 -1.028 210 HH TYR 27 HH TYR 27 -0.453 -20.241 -3.732 211 H ASP 28 H ASP 28 -0.929 -14.996 3.225 212 HA ASP 28 HA ASP 28 -3.124 -13.229 3.831 213 HB2 ASP 28 HB2 ASP 28 -2.155 -15.071 5.266 214 HB3 ASP 28 HB3 ASP 28 -0.732 -14.064 5.529 215 H GLN 29 H GLN 29 0.291 -12.728 3.118 216 HA GLN 29 HA GLN 29 0.532 -10.241 4.511 217 HB2 GLN 29 HB2 GLN 29 2.631 -10.025 3.518 218 HB3 GLN 29 HB3 GLN 29 2.425 -11.754 3.814 219 HG2 GLN 29 HG2 GLN 29 1.854 -10.364 1.185 220 HG3 GLN 29 HG3 GLN 29 3.398 -11.126 1.558 221 HE21 GLN 29 HE22 GLN 29 1.749 -11.779 -0.654 222 HE22 GLN 29 HE21 GLN 29 1.231 -13.437 -0.500 223 H LEU 30 H LEU 30 -1.223 -11.064 1.747 224 HA LEU 30 HA LEU 30 -0.965 -8.475 0.372 225 HB2 LEU 30 HB2 LEU 30 -2.948 -10.761 0.008 226 HB3 LEU 30 HB3 LEU 30 -2.569 -9.485 -1.162 227 HG LEU 30 HG LEU 30 -0.760 -11.721 -0.162 228 HD11 LEU 30 HD11 LEU 30 -0.829 -12.334 -2.551 229 HD12 LEU 30 HD12 LEU 30 -2.400 -12.461 -1.757 230 HD13 LEU 30 HD13 LEU 30 -2.053 -11.080 -2.833 231 HD21 LEU 30 HD21 LEU 30 0.897 -10.876 -1.794 232 HD22 LEU 30 HD22 LEU 30 -0.142 -9.494 -2.114 233 HD23 LEU 30 HD23 LEU 30 0.594 -9.682 -0.515 234 H ILE 31 H ILE 31 -3.246 -10.201 2.471 235 HA ILE 31 HA ILE 31 -5.264 -8.140 2.371 236 HB ILE 31 HB ILE 31 -4.720 -10.423 4.314 237 HG12 ILE 31 HG12 ILE 31 -6.740 -10.460 2.051 238 HG13 ILE 31 HG13 ILE 31 -5.078 -10.951 1.796 239 HG21 ILE 31 HG21 ILE 31 -7.144 -10.285 4.849 240 HG22 ILE 31 HG22 ILE 31 -6.279 -8.814 5.304 241 HG23 ILE 31 HG23 ILE 31 -7.266 -8.822 3.833 242 HD11 ILE 31 HD11 ILE 31 -5.209 -12.585 3.583 243 HD12 ILE 31 HD12 ILE 31 -6.929 -12.185 3.820 244 HD13 ILE 31 HD13 ILE 31 -6.393 -12.899 2.280 245 H THR 32 H THR 32 -2.256 -8.580 3.877 246 HA THR 32 HA THR 32 -2.750 -6.650 6.077 247 HB THR 32 HB THR 32 -0.329 -8.348 5.391 248 HG1 THR 32 HG1 THR 32 -2.065 -9.629 5.965 249 HG21 THR 32 HG21 THR 32 0.257 -7.936 7.809 250 HG22 THR 32 HG22 THR 32 0.341 -6.488 6.796 251 HG23 THR 32 HG23 THR 32 -1.060 -6.736 7.869 252 H ALA 33 H ALA 33 -1.505 -6.711 2.829 253 HA ALA 33 HA ALA 33 0.101 -4.270 3.448 254 HB1 ALA 33 HB1 ALA 33 1.489 -4.841 1.494 255 HB2 ALA 33 HB2 ALA 33 1.475 -6.158 2.686 256 HB3 ALA 33 HB3 ALA 33 0.497 -6.279 1.192 257 H GLN 34 H GLN 34 -2.089 -5.770 1.007 258 HA GLN 34 HA GLN 34 -2.955 -3.087 0.189 259 HB2 GLN 34 HB2 GLN 34 -1.925 -5.095 -1.829 260 HB3 GLN 34 HB3 GLN 34 -2.559 -3.505 -2.194 261 HG2 GLN 34 HG2 GLN 34 0.009 -4.077 -0.646 262 HG3 GLN 34 HG3 GLN 34 -0.086 -3.654 -2.352 263 HE21 GLN 34 HE22 GLN 34 1.481 -2.087 -0.770 264 HE22 GLN 34 HE21 GLN 34 0.728 -0.524 -0.524 265 HA PRO 35 HA PRO 35 -5.995 -6.589 0.635 266 HB2 PRO 35 HB2 PRO 35 -7.768 -5.364 2.327 267 HB3 PRO 35 HB3 PRO 35 -6.231 -6.113 2.869 268 HG2 PRO 35 HG2 PRO 35 -6.732 -3.195 2.236 269 HG3 PRO 35 HG3 PRO 35 -6.008 -3.896 3.725 270 HD2 PRO 35 HD2 PRO 35 -4.455 -2.969 1.705 271 HD3 PRO 35 HD3 PRO 35 -4.017 -4.464 2.576 272 H GLN 36 H GLN 36 -5.971 -3.730 -1.064 273 HA GLN 36 HA GLN 36 -8.839 -3.439 -1.484 274 HB2 GLN 36 HB2 GLN 36 -6.873 -2.093 -3.296 275 HB3 GLN 36 HB3 GLN 36 -8.365 -1.489 -2.578 276 HG2 GLN 36 HG2 GLN 36 -6.749 -0.274 -1.431 277 HG3 GLN 36 HG3 GLN 36 -7.039 -1.612 -0.311 278 HE21 GLN 36 HE22 GLN 36 -4.687 -0.450 0.160 279 HE22 GLN 36 HE21 GLN 36 -3.352 -1.345 -0.553 280 H ASN 37 H ASN 37 -7.118 -5.916 -2.373 281 HA ASN 37 HA ASN 37 -8.193 -6.028 -5.151 282 HB2 ASN 37 HB2 ASN 37 -5.437 -6.922 -4.207 283 HB3 ASN 37 HB3 ASN 37 -6.110 -7.196 -5.825 284 HD21 ASN 37 HD22 ASN 37 -4.856 -4.753 -3.566 285 HD22 ASN 37 HD21 ASN 37 -4.616 -3.507 -4.769 286 HA PRO 38 HA PRO 38 -10.003 -9.715 -3.586 287 HB2 PRO 38 HB2 PRO 38 -10.913 -10.831 -5.860 288 HB3 PRO 38 HB3 PRO 38 -11.484 -9.228 -5.315 289 HG2 PRO 38 HG2 PRO 38 -9.253 -9.757 -7.298 290 HG3 PRO 38 HG3 PRO 38 -10.738 -8.767 -7.549 291 HD2 PRO 38 HD2 PRO 38 -8.488 -7.542 -6.721 292 HD3 PRO 38 HD3 PRO 38 -10.023 -7.152 -6.014 293 H VAL 39 H VAL 39 -7.190 -9.872 -5.720 294 HA VAL 39 HA VAL 39 -7.124 -12.723 -5.991 295 HB VAL 39 HB VAL 39 -5.933 -11.088 -7.422 296 HG11 VAL 39 HG11 VAL 39 -3.953 -10.879 -5.118 297 HG12 VAL 39 HG12 VAL 39 -3.786 -10.165 -6.738 298 HG13 VAL 39 HG13 VAL 39 -5.061 -9.586 -5.646 299 HG21 VAL 39 HG21 VAL 39 -3.933 -12.445 -7.745 300 HG22 VAL 39 HG22 VAL 39 -4.119 -13.152 -6.115 301 HG23 VAL 39 HG23 VAL 39 -5.326 -13.490 -7.382 302 H GLY 40 H GLY 40 -5.894 -10.492 -3.527 303 HA2 GLY 40 HA2 GLY 40 -4.422 -12.315 -1.924 304 HA3 GLY 40 HA3 GLY 40 -5.227 -10.830 -1.358 305 H TYR 41 H TYR 41 -7.783 -12.162 -2.597 306 HA TYR 41 HA TYR 41 -8.374 -14.041 -0.372 307 HB2 TYR 41 HB2 TYR 41 -10.482 -12.409 -1.759 308 HB3 TYR 41 HB3 TYR 41 -10.564 -13.212 -0.256 309 HD1 TYR 41 HD1 TYR 41 -9.080 -10.237 -1.890 310 HD2 TYR 41 HD2 TYR 41 -9.984 -12.198 1.812 311 HE1 TYR 41 HE1 TYR 41 -8.639 -8.120 -0.677 312 HE2 TYR 41 HE2 TYR 41 -9.523 -10.090 3.051 313 HH TYR 41 HH TYR 41 -8.622 -7.062 1.348 314 H SER 42 H SER 42 -7.315 -14.502 -3.181 315 HA SER 42 HA SER 42 -9.518 -16.307 -4.062 316 HB2 SER 42 HB2 SER 42 -9.286 -14.295 -5.543 317 HB3 SER 42 HB3 SER 42 -7.615 -14.799 -5.890 318 HG SER 42 HG SER 42 -8.494 -16.797 -6.644 319 H ASN 43 H ASN 43 -6.632 -16.212 -2.608 320 HA ASN 43 HA ASN 43 -5.951 -18.911 -3.661 321 HB2 ASN 43 HB2 ASN 43 -4.044 -16.630 -2.975 322 HB3 ASN 43 HB3 ASN 43 -3.567 -18.304 -3.247 323 HD21 ASN 43 HD22 ASN 43 -3.709 -19.244 -5.340 324 HD22 ASN 43 HD21 ASN 43 -3.858 -18.237 -6.768 325 H LYS 44 H LYS 44 -5.815 -16.550 -0.907 326 HA LYS 44 HA LYS 44 -5.313 -18.626 1.059 327 HB2 LYS 44 HB2 LYS 44 -4.924 -16.171 1.369 328 HB3 LYS 44 HB3 LYS 44 -6.642 -15.892 1.287 329 HG2 LYS 44 HG2 LYS 44 -6.970 -17.373 3.280 330 HG3 LYS 44 HG3 LYS 44 -5.211 -17.638 3.345 331 HD2 LYS 44 HD2 LYS 44 -4.850 -15.230 3.746 332 HD3 LYS 44 HD3 LYS 44 -6.599 -14.933 3.576 333 HE2 LYS 44 HE2 LYS 44 -6.992 -16.505 5.496 334 HE3 LYS 44 HE3 LYS 44 -5.236 -16.642 5.700 335 HZ1 LYS 44 HZ1 LYS 44 -6.785 -14.142 5.902 336 HZ2 LYS 44 HZ2 LYS 44 -6.200 -15.008 7.173 337 HZ3 LYS 44 HZ3 LYS 44 -5.157 -14.288 6.122 338 H ALA 45 H ALA 45 -8.117 -16.998 -0.306 339 HA ALA 45 HA ALA 45 -10.156 -18.384 1.137 340 HB1 ALA 45 HB1 ALA 45 -10.273 -17.135 -1.629 341 HB2 ALA 45 HB2 ALA 45 -11.648 -17.442 -0.557 342 HB3 ALA 45 HB3 ALA 45 -10.444 -16.213 -0.118 343 H MET 46 H MET 46 -7.891 -19.726 -0.852 344 HA MET 46 HA MET 46 -9.655 -21.996 -1.614 345 HB2 MET 46 HB2 MET 46 -8.993 -20.258 -3.505 346 HB3 MET 46 HB3 MET 46 -7.410 -21.058 -3.410 347 HG2 MET 46 HG2 MET 46 -8.578 -23.248 -3.795 348 HG3 MET 46 HG3 MET 46 -10.103 -22.364 -3.992 349 HE1 MET 46 HE1 MET 46 -9.566 -20.356 -7.283 350 HE2 MET 46 HE2 MET 46 -10.673 -20.763 -5.947 351 HE3 MET 46 HE3 MET 46 -9.234 -19.775 -5.645 352 H ALA 47 H ALA 47 -7.269 -21.006 0.335 353 HA ALA 47 HA ALA 47 -5.884 -23.642 0.169 354 HB1 ALA 47 HB1 ALA 47 -4.778 -20.991 1.144 355 HB2 ALA 47 HB2 ALA 47 -3.936 -22.557 1.186 356 HB3 ALA 47 HB3 ALA 47 -4.355 -21.822 -0.374 357 H LEU 48 H LEU 48 -7.609 -21.289 2.213 358 HA LEU 48 HA LEU 48 -7.197 -22.734 4.675 359 HB2 LEU 48 HB2 LEU 48 -9.339 -20.843 3.626 360 HB3 LEU 48 HB3 LEU 48 -9.464 -21.596 5.222 361 HG LEU 48 HG LEU 48 -7.100 -19.885 4.338 362 HD11 LEU 48 HD11 LEU 48 -9.179 -18.567 4.495 363 HD12 LEU 48 HD12 LEU 48 -9.509 -19.253 6.098 364 HD13 LEU 48 HD13 LEU 48 -8.109 -18.194 5.863 365 HD21 LEU 48 HD21 LEU 48 -6.650 -19.862 6.804 366 HD22 LEU 48 HD22 LEU 48 -7.961 -21.047 7.028 367 HD23 LEU 48 HD23 LEU 48 -6.509 -21.491 6.113 368 H ILE 49 H ILE 49 -9.468 -23.007 1.945 369 HA ILE 49 HA ILE 49 -11.196 -24.948 3.060 370 HB ILE 49 HB ILE 49 -11.683 -25.570 0.732 371 HG12 ILE 49 HG12 ILE 49 -9.713 -23.445 -0.065 372 HG13 ILE 49 HG13 ILE 49 -9.192 -25.097 0.027 373 HG21 ILE 49 HG21 ILE 49 -12.787 -23.622 1.793 374 HG22 ILE 49 HG22 ILE 49 -11.480 -22.571 1.214 375 HG23 ILE 49 HG23 ILE 49 -12.546 -23.369 0.052 376 HD11 ILE 49 HD11 ILE 49 -10.832 -25.890 -1.492 377 HD12 ILE 49 HD12 ILE 49 -11.474 -24.228 -1.723 378 HD13 ILE 49 HD13 ILE 49 -9.814 -24.647 -2.240 379 H LYS 50 H LYS 50 -7.938 -25.094 1.837 380 HA LYS 50 HA LYS 50 -8.081 -27.812 0.953 381 HB2 LYS 50 HB2 LYS 50 -6.420 -25.608 0.548 382 HB3 LYS 50 HB3 LYS 50 -5.395 -26.737 1.435 383 HG2 LYS 50 HG2 LYS 50 -5.024 -27.247 -0.806 384 HG3 LYS 50 HG3 LYS 50 -6.150 -28.510 -0.303 385 HD2 LYS 50 HD2 LYS 50 -6.805 -25.941 -1.819 386 HD3 LYS 50 HD3 LYS 50 -6.592 -27.519 -2.569 387 HE2 LYS 50 HE2 LYS 50 -8.691 -26.888 -0.484 388 HE3 LYS 50 HE3 LYS 50 -8.965 -26.785 -2.233 389 HZ1 LYS 50 HZ1 LYS 50 -8.156 -29.243 -0.794 390 HZ2 LYS 50 HZ2 LYS 50 -9.672 -28.922 -1.343 391 HZ3 LYS 50 HZ3 LYS 50 -8.440 -29.126 -2.409 392 H LEU 51 H LEU 51 -7.400 -26.260 4.031 393 HA LEU 51 HA LEU 51 -6.189 -28.700 5.193 394 HB2 LEU 51 HB2 LEU 51 -7.144 -26.049 6.405 395 HB3 LEU 51 HB3 LEU 51 -6.467 -27.386 7.328 396 HG LEU 51 HG LEU 51 -4.814 -25.732 7.131 397 HD11 LEU 51 HD11 LEU 51 -4.165 -28.054 5.280 398 HD12 LEU 51 HD12 LEU 51 -2.998 -27.057 6.189 399 HD13 LEU 51 HD13 LEU 51 -4.128 -28.107 7.055 400 HD21 LEU 51 HD21 LEU 51 -5.664 -24.627 5.105 401 HD22 LEU 51 HD22 LEU 51 -3.918 -24.927 5.040 402 HD23 LEU 51 HD23 LEU 51 -5.032 -25.957 4.110 403 H GLY 52 H GLY 52 -9.265 -26.924 5.028 404 HA2 GLY 52 HA2 GLY 52 -11.272 -28.459 5.300 405 HA3 GLY 52 HA3 GLY 52 -10.554 -28.890 6.867 406 H GLU 53 H GLU 53 -9.745 -25.690 6.344 407 HA GLU 53 HA GLU 53 -11.697 -24.765 8.299 408 HB2 GLU 53 HB2 GLU 53 -9.368 -23.376 6.908 409 HB3 GLU 53 HB3 GLU 53 -10.295 -22.722 8.267 410 HG2 GLU 53 HG2 GLU 53 -9.597 -24.552 9.712 411 HG3 GLU 53 HG3 GLU 53 -8.738 -25.333 8.375 412 H TYR 54 H TYR 54 -13.096 -25.469 6.014 413 HA TYR 54 HA TYR 54 -13.377 -23.528 3.997 414 HB2 TYR 54 HB2 TYR 54 -15.401 -25.407 5.232 415 HB3 TYR 54 HB3 TYR 54 -15.696 -24.478 3.770 416 HD1 TYR 54 HD2 TYR 54 -13.833 -27.315 5.226 417 HD2 TYR 54 HD1 TYR 54 -14.703 -25.079 1.664 418 HE1 TYR 54 HE2 TYR 54 -12.864 -29.141 3.839 419 HE2 TYR 54 HE1 TYR 54 -13.743 -26.897 0.275 420 HH TYR 54 HH TYR 54 -12.758 -28.968 0.271 421 H THR 55 H THR 55 -14.891 -23.679 7.251 422 HA THR 55 HA THR 55 -16.791 -21.586 6.845 423 HB THR 55 HB THR 55 -15.352 -22.611 9.321 424 HG1 THR 55 HG1 THR 55 -17.329 -23.731 9.568 425 HG21 THR 55 HG21 THR 55 -16.295 -20.395 9.825 426 HG22 THR 55 HG22 THR 55 -17.825 -20.838 9.042 427 HG23 THR 55 HG23 THR 55 -17.324 -21.642 10.554 428 H GLN 56 H GLN 56 -13.340 -21.593 7.710 429 HA GLN 56 HA GLN 56 -13.275 -18.742 8.310 430 HB2 GLN 56 HB2 GLN 56 -11.078 -20.796 7.887 431 HB3 GLN 56 HB3 GLN 56 -10.849 -19.129 8.417 432 HG2 GLN 56 HG2 GLN 56 -10.855 -20.144 10.429 433 HG3 GLN 56 HG3 GLN 56 -12.565 -19.763 10.323 434 HE21 GLN 56 HE22 GLN 56 -10.982 -21.888 11.817 435 HE22 GLN 56 HE21 GLN 56 -11.733 -23.406 11.360 436 H ALA 57 H ALA 57 -13.324 -20.666 5.445 437 HA ALA 57 HA ALA 57 -11.547 -18.925 3.893 438 HB1 ALA 57 HB1 ALA 57 -11.749 -21.398 3.507 439 HB2 ALA 57 HB2 ALA 57 -13.431 -21.170 3.015 440 HB3 ALA 57 HB3 ALA 57 -12.133 -20.431 2.060 441 H ILE 58 H ILE 58 -15.001 -19.251 4.594 442 HA ILE 58 HA ILE 58 -15.954 -17.685 2.371 443 HB ILE 58 HB ILE 58 -17.321 -17.805 5.067 444 HG12 ILE 58 HG12 ILE 58 -17.072 -20.064 3.051 445 HG13 ILE 58 HG13 ILE 58 -16.585 -20.080 4.754 446 HG21 ILE 58 HG21 ILE 58 -18.196 -16.507 3.098 447 HG22 ILE 58 HG22 ILE 58 -18.327 -18.050 2.213 448 HG23 ILE 58 HG23 ILE 58 -19.311 -17.762 3.668 449 HD11 ILE 58 HD11 ILE 58 -19.416 -19.855 3.695 450 HD12 ILE 58 HD12 ILE 58 -18.689 -21.209 4.610 451 HD13 ILE 58 HD13 ILE 58 -18.939 -19.643 5.404 452 H GLN 59 H GLN 59 -14.794 -17.030 5.650 453 HA GLN 59 HA GLN 59 -15.613 -14.313 5.871 454 HB2 GLN 59 HB2 GLN 59 -13.307 -15.814 7.174 455 HB3 GLN 59 HB3 GLN 59 -13.943 -14.244 7.705 456 HG2 GLN 59 HG2 GLN 59 -16.148 -15.254 8.153 457 HG3 GLN 59 HG3 GLN 59 -15.570 -16.816 7.557 458 HE21 GLN 59 HE22 GLN 59 -15.654 -18.073 9.375 459 HE22 GLN 59 HE21 GLN 59 -14.782 -17.716 10.857 460 H MET 60 H MET 60 -13.381 -15.699 3.750 461 HA MET 60 HA MET 60 -11.941 -13.122 3.403 462 HB2 MET 60 HB2 MET 60 -11.277 -15.922 2.417 463 HB3 MET 60 HB3 MET 60 -10.273 -14.496 2.153 464 HG2 MET 60 HG2 MET 60 -10.989 -15.361 4.966 465 HG3 MET 60 HG3 MET 60 -9.742 -16.205 4.067 466 HE1 MET 60 HE1 MET 60 -10.279 -12.197 3.856 467 HE2 MET 60 HE2 MET 60 -10.871 -12.748 5.440 468 HE3 MET 60 HE3 MET 60 -9.383 -11.761 5.312 469 H CYS 61 H CYS 61 -14.075 -15.547 1.902 470 HA CYS 61 HA CYS 61 -13.889 -14.506 -0.764 471 HB2 CYS 61 HB2 CYS 61 -16.108 -16.008 0.714 472 HB3 CYS 61 HB3 CYS 61 -16.105 -15.689 -1.028 473 HG CYS 61 HG CYS 61 -13.793 -17.261 0.748 474 H GLN 62 H GLN 62 -16.089 -13.775 2.015 475 HA GLN 62 HA GLN 62 -17.578 -11.773 0.584 476 HB2 GLN 62 HB2 GLN 62 -17.090 -12.095 3.578 477 HB3 GLN 62 HB3 GLN 62 -18.423 -11.200 2.816 478 HG2 GLN 62 HG2 GLN 62 -19.391 -13.256 1.947 479 HG3 GLN 62 HG3 GLN 62 -17.985 -14.186 2.460 480 HE21 GLN 62 HE22 GLN 62 -19.657 -15.492 3.510 481 HE22 GLN 62 HE21 GLN 62 -20.221 -14.999 5.079 482 H GLN 63 H GLN 63 -14.337 -11.776 1.424 483 HA GLN 63 HA GLN 63 -14.278 -8.822 1.818 484 HB2 GLN 63 HB2 GLN 63 -12.273 -10.969 2.588 485 HB3 GLN 63 HB3 GLN 63 -12.025 -9.240 2.821 486 HG2 GLN 63 HG2 GLN 63 -14.392 -10.700 4.063 487 HG3 GLN 63 HG3 GLN 63 -12.805 -10.630 4.817 488 HE21 GLN 63 HE22 GLN 63 -13.390 -9.411 6.595 489 HE22 GLN 63 HE21 GLN 63 -13.854 -7.730 6.473 490 H GLY 64 H GLY 64 -13.878 -11.242 -0.481 491 HA2 GLY 64 HA2 GLY 64 -11.807 -9.665 -1.970 492 HA3 GLY 64 HA3 GLY 64 -12.228 -11.373 -2.246 493 H LEU 65 H LEU 65 -15.105 -11.069 -2.024 494 HA LEU 65 HA LEU 65 -15.814 -10.210 -4.658 495 HB2 LEU 65 HB2 LEU 65 -17.310 -10.875 -2.100 496 HB3 LEU 65 HB3 LEU 65 -18.184 -10.351 -3.528 497 HG LEU 65 HG LEU 65 -16.229 -12.697 -3.599 498 HD11 LEU 65 HD11 LEU 65 -19.250 -12.691 -3.233 499 HD12 LEU 65 HD12 LEU 65 -18.228 -14.127 -3.471 500 HD13 LEU 65 HD13 LEU 65 -18.058 -13.155 -2.000 501 HD21 LEU 65 HD21 LEU 65 -17.492 -13.272 -5.641 502 HD22 LEU 65 HD22 LEU 65 -18.466 -11.798 -5.456 503 HD23 LEU 65 HD23 LEU 65 -16.725 -11.688 -5.787 504 H ARG 66 H ARG 66 -14.953 -8.365 -1.956 505 HA ARG 66 HA ARG 66 -16.623 -6.033 -2.550 506 HB2 ARG 66 HB2 ARG 66 -14.141 -6.364 -0.793 507 HB3 ARG 66 HB3 ARG 66 -15.266 -4.998 -0.784 508 HG2 ARG 66 HG2 ARG 66 -17.087 -6.523 -0.023 509 HG3 ARG 66 HG3 ARG 66 -15.928 -7.872 -0.022 510 HD2 ARG 66 HD2 ARG 66 -16.154 -6.998 2.238 511 HD3 ARG 66 HD3 ARG 66 -14.527 -6.648 1.627 512 HE ARG 66 HE ARG 66 -16.316 -4.458 1.096 513 HH11 ARG 66 HH11 ARG 66 -14.511 -6.015 3.707 514 HH12 ARG 66 HH12 ARG 66 -14.358 -4.532 4.635 515 HH21 ARG 66 HH21 ARG 66 -16.105 -2.552 2.322 516 HH22 ARG 66 HH22 ARG 66 -15.263 -2.582 3.853 517 H TYR 67 H TYR 67 -14.092 -7.469 -4.160 518 HA TYR 67 HA TYR 67 -12.869 -4.900 -5.041 519 HB2 TYR 67 HB2 TYR 67 -11.423 -7.355 -4.041 520 HB3 TYR 67 HB3 TYR 67 -10.648 -5.943 -4.759 521 HD1 TYR 67 HD2 TYR 67 -11.481 -3.603 -3.656 522 HD2 TYR 67 HD1 TYR 67 -11.400 -7.444 -1.739 523 HE1 TYR 67 HE2 TYR 67 -11.440 -2.486 -1.439 524 HE2 TYR 67 HE1 TYR 67 -11.358 -6.340 0.490 525 HH TYR 67 HH TYR 67 -11.339 -4.355 1.633 526 H THR 68 H THR 68 -14.657 -7.409 -6.000 527 HA THR 68 HA THR 68 -13.205 -7.840 -8.560 528 HB THR 68 HB THR 68 -14.886 -9.668 -8.871 529 HG1 THR 68 HG1 THR 68 -16.486 -8.881 -7.469 530 HG21 THR 68 HG21 THR 68 -13.309 -9.827 -6.286 531 HG22 THR 68 HG22 THR 68 -13.839 -11.184 -7.296 532 HG23 THR 68 HG23 THR 68 -12.617 -10.044 -7.907 533 H SER 69 H SER 69 -14.672 -5.365 -7.700 534 HA SER 69 HA SER 69 -17.191 -5.169 -8.993 535 HB2 SER 69 HB2 SER 69 -15.150 -3.036 -8.258 536 HB3 SER 69 HB3 SER 69 -16.860 -2.749 -8.633 537 HG SER 69 HG SER 69 -16.481 -2.917 -6.371 538 H THR 70 H THR 70 -14.476 -5.904 -10.652 539 HA THR 70 HA THR 70 -15.376 -4.444 -13.048 540 HB THR 70 HB THR 70 -13.798 -2.884 -12.156 541 HG1 THR 70 HG1 THR 70 -12.276 -2.903 -13.795 542 HG21 THR 70 HG21 THR 70 -11.889 -5.248 -11.894 543 HG22 THR 70 HG22 THR 70 -11.442 -3.535 -11.685 544 HG23 THR 70 HG23 THR 70 -12.597 -4.286 -10.564 545 H ALA 71 H ALA 71 -14.211 -5.168 -14.990 546 HA ALA 71 HA ALA 71 -14.407 -7.990 -15.235 547 HB1 ALA 71 HB1 ALA 71 -13.172 -5.886 -17.058 548 HB2 ALA 71 HB2 ALA 71 -13.652 -7.529 -17.554 549 HB3 ALA 71 HB3 ALA 71 -14.890 -6.364 -17.020 550 H GLU 72 H GLU 72 -11.752 -6.080 -14.114 551 HA GLU 72 HA GLU 72 -9.581 -7.671 -15.071 552 HB2 GLU 72 HB2 GLU 72 -9.840 -6.050 -12.534 553 HB3 GLU 72 HB3 GLU 72 -8.318 -6.643 -13.207 554 HG2 GLU 72 HG2 GLU 72 -10.220 -4.673 -14.558 555 HG3 GLU 72 HG3 GLU 72 -8.698 -4.270 -13.752 556 H HIS 73 H HIS 73 -12.108 -8.508 -12.974 557 HA HIS 73 HA HIS 73 -10.584 -10.824 -11.924 558 HB2 HIS 73 HB2 HIS 73 -12.451 -9.228 -10.156 559 HB3 HIS 73 HB3 HIS 73 -11.283 -10.454 -9.687 560 HD2 HIS 73 HD2 HIS 73 -11.710 -6.759 -10.043 561 HE1 HIS 73 HE1 HIS 73 -7.523 -7.315 -9.531 562 HE2 HIS 73 HE2 HIS 73 -9.408 -5.599 -9.574 563 H VAL 74 H VAL 74 -12.631 -10.389 -14.071 564 HA VAL 74 HA VAL 74 -15.254 -10.880 -13.309 565 HB VAL 74 HB VAL 74 -14.396 -10.248 -15.550 566 HG11 VAL 74 HG11 VAL 74 -12.568 -11.915 -15.738 567 HG12 VAL 74 HG12 VAL 74 -13.772 -13.208 -15.871 568 HG13 VAL 74 HG13 VAL 74 -13.673 -11.962 -17.127 569 HG21 VAL 74 HG21 VAL 74 -16.731 -11.027 -15.216 570 HG22 VAL 74 HG22 VAL 74 -16.101 -11.437 -16.829 571 HG23 VAL 74 HG23 VAL 74 -16.207 -12.692 -15.583 572 H ALA 75 H ALA 75 -12.605 -13.217 -13.400 573 HA ALA 75 HA ALA 75 -14.449 -15.501 -13.146 574 HB1 ALA 75 HB1 ALA 75 -11.413 -15.285 -12.875 575 HB2 ALA 75 HB2 ALA 75 -12.352 -16.796 -12.933 576 HB3 ALA 75 HB3 ALA 75 -12.304 -15.724 -14.351 577 H ILE 76 H ILE 76 -12.159 -13.676 -11.006 578 HA ILE 76 HA ILE 76 -12.630 -15.296 -8.703 579 HB ILE 76 HB ILE 76 -11.821 -12.364 -8.936 580 HG12 ILE 76 HG12 ILE 76 -10.141 -14.891 -8.642 581 HG13 ILE 76 HG13 ILE 76 -10.287 -13.926 -10.109 582 HG21 ILE 76 HG21 ILE 76 -11.561 -14.321 -6.623 583 HG22 ILE 76 HG22 ILE 76 -10.890 -12.681 -6.666 584 HG23 ILE 76 HG23 ILE 76 -12.636 -12.902 -6.682 585 HD11 ILE 76 HD11 ILE 76 -9.346 -11.955 -8.916 586 HD12 ILE 76 HD12 ILE 76 -9.042 -12.996 -7.506 587 HD13 ILE 76 HD13 ILE 76 -8.223 -13.329 -9.041 588 H ARG 77 H ARG 77 -14.385 -12.640 -10.213 589 HA ARG 77 HA ARG 77 -16.135 -11.857 -8.162 590 HB2 ARG 77 HB2 ARG 77 -15.778 -10.805 -10.415 591 HB3 ARG 77 HB3 ARG 77 -16.655 -12.154 -11.152 592 HG2 ARG 77 HG2 ARG 77 -18.674 -11.535 -9.836 593 HG3 ARG 77 HG3 ARG 77 -17.781 -10.159 -9.147 594 HD2 ARG 77 HD2 ARG 77 -17.410 -9.284 -11.429 595 HD3 ARG 77 HD3 ARG 77 -18.231 -10.703 -12.104 596 HE ARG 77 HE ARG 77 -20.309 -9.834 -11.484 597 HH11 ARG 77 HH11 ARG 77 -17.722 -7.793 -10.174 598 HH12 ARG 77 HH12 ARG 77 -18.823 -6.504 -9.742 599 HH21 ARG 77 HH21 ARG 77 -21.695 -8.141 -10.908 600 HH22 ARG 77 HH22 ARG 77 -21.057 -6.688 -10.177 601 H SER 78 H SER 78 -15.944 -14.851 -9.876 602 HA SER 78 HA SER 78 -18.607 -15.697 -8.784 603 HB2 SER 78 HB2 SER 78 -17.188 -16.540 -11.348 604 HB3 SER 78 HB3 SER 78 -18.706 -17.241 -10.737 605 HG SER 78 HG SER 78 -19.080 -15.581 -12.276 606 H LYS 79 H LYS 79 -15.143 -16.326 -8.841 607 HA LYS 79 HA LYS 79 -15.481 -19.108 -8.026 608 HB2 LYS 79 HB2 LYS 79 -13.130 -17.185 -8.139 609 HB3 LYS 79 HB3 LYS 79 -12.993 -18.781 -7.425 610 HG2 LYS 79 HG2 LYS 79 -13.721 -18.168 -10.312 611 HG3 LYS 79 HG3 LYS 79 -12.219 -18.872 -9.707 612 HD2 LYS 79 HD2 LYS 79 -14.979 -20.132 -9.839 613 HD3 LYS 79 HD3 LYS 79 -13.453 -20.700 -10.554 614 HE2 LYS 79 HE2 LYS 79 -12.580 -20.994 -8.171 615 HE3 LYS 79 HE3 LYS 79 -14.235 -20.659 -7.611 616 HZ1 LYS 79 HZ1 LYS 79 -13.844 -23.013 -7.836 617 HZ2 LYS 79 HZ2 LYS 79 -14.990 -22.535 -8.904 618 HZ3 LYS 79 HZ3 LYS 79 -13.466 -22.844 -9.429 619 H LEU 80 H LEU 80 -15.222 -15.926 -6.356 620 HA LEU 80 HA LEU 80 -14.794 -17.271 -3.789 621 HB2 LEU 80 HB2 LEU 80 -15.582 -14.417 -4.481 622 HB3 LEU 80 HB3 LEU 80 -15.016 -14.992 -2.895 623 HG LEU 80 HG LEU 80 -13.456 -14.869 -5.503 624 HD11 LEU 80 HD11 LEU 80 -13.688 -12.748 -4.270 625 HD12 LEU 80 HD12 LEU 80 -13.060 -13.543 -2.798 626 HD13 LEU 80 HD13 LEU 80 -12.016 -13.340 -4.222 627 HD21 LEU 80 HD21 LEU 80 -11.541 -15.738 -4.267 628 HD22 LEU 80 HD22 LEU 80 -12.572 -16.036 -2.843 629 HD23 LEU 80 HD23 LEU 80 -12.823 -16.941 -4.354 630 H GLN 81 H GLN 81 -17.480 -16.239 -5.833 631 HA GLN 81 HA GLN 81 -19.516 -16.584 -3.803 632 HB2 GLN 81 HB2 GLN 81 -19.316 -16.204 -6.771 633 HB3 GLN 81 HB3 GLN 81 -20.751 -17.034 -6.206 634 HG2 GLN 81 HG2 GLN 81 -19.820 -14.287 -5.332 635 HG3 GLN 81 HG3 GLN 81 -21.249 -14.680 -6.311 636 HE21 GLN 81 HE22 GLN 81 -22.301 -16.909 -4.869 637 HE22 GLN 81 HE21 GLN 81 -22.790 -16.343 -3.281 638 H TYR 82 H TYR 82 -17.959 -18.642 -6.300 639 HA TYR 82 HA TYR 82 -19.626 -20.918 -6.060 640 HB2 TYR 82 HB2 TYR 82 -18.007 -20.741 -7.866 641 HB3 TYR 82 HB3 TYR 82 -16.708 -20.432 -6.746 642 HD1 TYR 82 HD1 TYR 82 -18.935 -23.077 -8.084 643 HD2 TYR 82 HD2 TYR 82 -15.513 -22.177 -5.634 644 HE1 TYR 82 HE1 TYR 82 -18.336 -25.484 -8.044 645 HE2 TYR 82 HE2 TYR 82 -14.919 -24.586 -5.576 646 HH TYR 82 HH TYR 82 -16.859 -27.067 -7.282 647 H ARG 83 H ARG 83 -16.576 -20.088 -4.231 648 HA ARG 83 HA ARG 83 -16.811 -22.575 -2.776 649 HB2 ARG 83 HB2 ARG 83 -14.646 -21.450 -3.179 650 HB3 ARG 83 HB3 ARG 83 -15.149 -20.090 -2.166 651 HG2 ARG 83 HG2 ARG 83 -13.682 -21.715 -0.970 652 HG3 ARG 83 HG3 ARG 83 -15.261 -21.516 -0.201 653 HD2 ARG 83 HD2 ARG 83 -14.665 -23.874 -0.225 654 HD3 ARG 83 HD3 ARG 83 -16.041 -23.627 -1.297 655 HE ARG 83 HE ARG 83 -13.555 -23.441 -2.755 656 HH11 ARG 83 HH11 ARG 83 -15.791 -25.751 -1.287 657 HH12 ARG 83 HH12 ARG 83 -15.291 -27.068 -2.317 658 HH21 ARG 83 HH21 ARG 83 -12.921 -25.182 -4.089 659 HH22 ARG 83 HH22 ARG 83 -13.676 -26.740 -3.909 660 H LEU 84 H LEU 84 -17.896 -19.235 -2.236 661 HA LEU 84 HA LEU 84 -18.730 -19.602 0.472 662 HB2 LEU 84 HB2 LEU 84 -18.317 -17.451 -0.619 663 HB3 LEU 84 HB3 LEU 84 -19.687 -17.691 -1.699 664 HG LEU 84 HG LEU 84 -20.218 -17.889 1.237 665 HD11 LEU 84 HD11 LEU 84 -18.646 -15.969 1.035 666 HD12 LEU 84 HD12 LEU 84 -19.722 -15.240 -0.185 667 HD13 LEU 84 HD13 LEU 84 -20.288 -15.455 1.491 668 HD21 LEU 84 HD21 LEU 84 -21.662 -16.476 -1.032 669 HD22 LEU 84 HD22 LEU 84 -22.057 -18.100 -0.417 670 HD23 LEU 84 HD23 LEU 84 -22.258 -16.681 0.630 671 H GLU 85 H GLU 85 -19.956 -20.682 -2.588 672 HA GLU 85 HA GLU 85 -22.703 -21.120 -1.663 673 HB2 GLU 85 HB2 GLU 85 -21.168 -21.254 -4.236 674 HB3 GLU 85 HB3 GLU 85 -22.635 -22.201 -4.122 675 HG2 GLU 85 HG2 GLU 85 -23.948 -20.241 -3.520 676 HG3 GLU 85 HG3 GLU 85 -22.489 -19.249 -3.399 677 H LEU 86 H LEU 86 -19.830 -22.769 -1.148 678 HA LEU 86 HA LEU 86 -21.352 -25.331 -0.829 679 HB2 LEU 86 HB2 LEU 86 -18.517 -24.875 -1.847 680 HB3 LEU 86 HB3 LEU 86 -19.016 -26.387 -1.096 681 HG LEU 86 HG LEU 86 -19.075 -26.786 -3.366 682 HD11 LEU 86 HD11 LEU 86 -21.967 -26.207 -2.605 683 HD12 LEU 86 HD12 LEU 86 -21.395 -27.370 -3.814 684 HD13 LEU 86 HD13 LEU 86 -21.040 -27.639 -2.093 685 HD21 LEU 86 HD21 LEU 86 -20.775 -24.305 -3.792 686 HD22 LEU 86 HD22 LEU 86 -19.063 -24.512 -4.225 687 HD23 LEU 86 HD23 LEU 86 -20.303 -25.492 -5.030 688 H ALA 87 H ALA 87 -18.864 -23.089 0.419 689 HA ALA 87 HA ALA 87 -17.959 -24.808 2.517 690 HB1 ALA 87 HB1 ALA 87 -17.008 -22.708 3.437 691 HB2 ALA 87 HB2 ALA 87 -16.639 -22.929 1.714 692 HB3 ALA 87 HB3 ALA 87 -17.916 -21.781 2.210 693 H GLN 88 H GLN 88 -20.980 -23.190 2.187 694 HA GLN 88 HA GLN 88 -21.433 -22.606 4.973 695 HB2 GLN 88 HB2 GLN 88 -23.254 -22.906 2.556 696 HB3 GLN 88 HB3 GLN 88 -23.798 -22.373 4.152 697 HG2 GLN 88 HG2 GLN 88 -22.213 -20.483 4.096 698 HG3 GLN 88 HG3 GLN 88 -21.643 -20.992 2.505 699 HE21 GLN 88 HE22 GLN 88 -22.789 -18.405 3.163 700 HE22 GLN 88 HE21 GLN 88 -24.261 -18.254 2.228 701 H GLY 89 H GLY 89 -20.859 -25.518 3.579 702 HA2 GLY 89 HA2 GLY 89 -22.158 -26.950 5.746 703 HA3 GLY 89 HA3 GLY 89 -22.883 -27.262 4.154 704 H ALA 90 H ALA 90 -20.212 -26.949 2.741 705 HA ALA 90 HA ALA 90 -19.475 -29.675 2.736 706 HB1 ALA 90 HB1 ALA 90 -17.921 -27.231 1.800 707 HB2 ALA 90 HB2 ALA 90 -17.608 -28.919 1.321 708 HB3 ALA 90 HB3 ALA 90 -19.131 -28.134 0.849 709 H VAL 91 H VAL 91 -18.515 -27.106 4.891 710 HA VAL 91 HA VAL 91 -15.996 -28.051 5.761 711 HB VAL 91 HB VAL 91 -17.188 -25.885 6.286 712 HG11 VAL 91 HG11 VAL 91 -18.523 -27.519 8.465 713 HG12 VAL 91 HG12 VAL 91 -18.628 -25.762 8.241 714 HG13 VAL 91 HG13 VAL 91 -19.339 -26.850 7.031 715 HG21 VAL 91 HG21 VAL 91 -15.081 -26.608 7.392 716 HG22 VAL 91 HG22 VAL 91 -16.109 -25.650 8.476 717 HG23 VAL 91 HG23 VAL 91 -16.036 -27.409 8.664 718 H GLY 92 H GLY 92 -19.130 -29.475 6.144 719 HA2 GLY 92 HA2 GLY 92 -18.005 -31.640 7.754 720 HA3 GLY 92 HA3 GLY 92 -19.199 -30.646 8.610 721 H SER 93 H SER 93 -19.396 -31.320 5.116 722 HA SER 93 HA SER 93 -21.504 -33.357 5.610 723 HB2 SER 93 HB2 SER 93 -21.818 -30.891 3.853 724 HB3 SER 93 HB3 SER 93 -22.945 -32.256 3.936 725 HG SER 93 HG SER 93 -22.230 -30.468 6.024 726 H VAL 94 H VAL 94 -22.120 -34.518 3.657 727 HA VAL 94 HA VAL 94 -20.178 -34.462 1.493 728 HB VAL 94 HB VAL 94 -20.855 -37.100 2.769 729 HG11 VAL 94 HG11 VAL 94 -19.897 -37.070 0.478 730 HG12 VAL 94 HG12 VAL 94 -18.535 -36.104 1.062 731 HG13 VAL 94 HG13 VAL 94 -18.754 -37.778 1.635 732 HG21 VAL 94 HG21 VAL 94 -18.666 -37.003 3.945 733 HG22 VAL 94 HG22 VAL 94 -18.498 -35.296 3.431 734 HG23 VAL 94 HG23 VAL 94 -19.798 -35.777 4.552 735 H GLN 95 H GLN 95 -22.754 -33.507 1.600 736 HA GLN 95 HA GLN 95 -24.333 -35.400 -0.027 737 HB2 GLN 95 HB2 GLN 95 -25.030 -33.457 2.191 738 HB3 GLN 95 HB3 GLN 95 -26.189 -34.283 1.274 739 HG2 GLN 95 HG2 GLN 95 -26.082 -35.895 2.880 740 HG3 GLN 95 HG3 GLN 95 -24.641 -36.423 1.952 741 HE21 GLN 95 HE22 GLN 95 -25.275 -33.600 4.057 742 HE22 GLN 95 HE21 GLN 95 -23.871 -33.842 5.039 743 H ILE 96 H ILE 96 -22.518 -32.687 -0.247 744 HA ILE 96 HA ILE 96 -24.208 -31.557 -2.380 745 HB ILE 96 HB ILE 96 -23.674 -29.262 -1.609 746 HG12 ILE 96 HG12 ILE 96 -22.700 -30.630 0.942 747 HG13 ILE 96 HG13 ILE 96 -21.645 -29.874 -0.267 748 HG21 ILE 96 HG21 ILE 96 -25.827 -30.408 -1.060 749 HG22 ILE 96 HG22 ILE 96 -25.130 -30.877 0.511 750 HG23 ILE 96 HG23 ILE 96 -25.364 -29.162 0.112 751 HD11 ILE 96 HD11 ILE 96 -22.815 -27.700 0.098 752 HD12 ILE 96 HD12 ILE 96 -23.780 -28.462 1.389 753 HD13 ILE 96 HD13 ILE 96 -22.023 -28.320 1.565 754 HA PRO 97 HA PRO 97 -19.463 -31.164 -3.065 755 HB2 PRO 97 HB2 PRO 97 -18.411 -33.578 -3.722 756 HB3 PRO 97 HB3 PRO 97 -18.573 -33.050 -2.012 757 HG2 PRO 97 HG2 PRO 97 -20.474 -34.805 -3.594 758 HG3 PRO 97 HG3 PRO 97 -19.763 -35.133 -1.977 759 HD2 PRO 97 HD2 PRO 97 -22.239 -34.058 -2.261 760 HD3 PRO 97 HD3 PRO 97 -21.135 -33.531 -0.947 761 H VAL 98 H VAL 98 -18.328 -31.461 -5.176 762 HA VAL 98 HA VAL 98 -20.051 -32.363 -7.380 763 HB VAL 98 HB VAL 98 -20.570 -29.953 -6.858 764 HG11 VAL 98 HG11 VAL 98 -17.781 -29.425 -7.953 765 HG12 VAL 98 HG12 VAL 98 -18.992 -28.219 -7.484 766 HG13 VAL 98 HG13 VAL 98 -18.261 -29.254 -6.245 767 HG21 VAL 98 HG21 VAL 98 -19.358 -30.370 -9.618 768 HG22 VAL 98 HG22 VAL 98 -20.965 -30.944 -9.099 769 HG23 VAL 98 HG23 VAL 98 -20.610 -29.207 -9.142 770 H VAL 99 H VAL 99 -17.298 -32.812 -5.920 771 HA VAL 99 HA VAL 99 -15.768 -33.265 -8.409 772 HB VAL 99 HB VAL 99 -13.705 -32.476 -7.292 773 HG11 VAL 99 HG11 VAL 99 -15.864 -30.337 -7.363 774 HG12 VAL 99 HG12 VAL 99 -14.112 -30.079 -7.496 775 HG13 VAL 99 HG13 VAL 99 -14.980 -30.955 -8.782 776 HG21 VAL 99 HG21 VAL 99 -13.835 -31.100 -5.265 777 HG22 VAL 99 HG22 VAL 99 -15.583 -31.396 -5.143 778 HG23 VAL 99 HG23 VAL 99 -14.435 -32.741 -4.935 779 H GLU 100 H GLU 100 -17.308 -34.748 -6.052 780 HA GLU 100 HA GLU 100 -15.369 -36.326 -4.699 781 HB2 GLU 100 HB2 GLU 100 -17.243 -37.774 -4.133 782 HB3 GLU 100 HB3 GLU 100 -17.711 -36.072 -3.974 783 HG2 GLU 100 HG2 GLU 100 -18.792 -36.171 -6.217 784 HG3 GLU 100 HG3 GLU 100 -18.347 -37.884 -6.342 785 H VAL 101 H VAL 101 -15.064 -38.692 -4.935 786 HA VAL 101 HA VAL 101 -15.302 -39.744 -7.665 787 HB VAL 101 HB VAL 101 -13.155 -38.453 -7.316 788 HG11 VAL 101 HG11 VAL 101 -11.343 -39.509 -6.066 789 HG12 VAL 101 HG12 VAL 101 -12.705 -39.142 -4.992 790 HG13 VAL 101 HG13 VAL 101 -12.427 -40.813 -5.548 791 HG21 VAL 101 HG21 VAL 101 -11.761 -40.093 -8.480 792 HG22 VAL 101 HG22 VAL 101 -12.815 -41.416 -7.937 793 HG23 VAL 101 HG23 VAL 101 -13.427 -40.192 -9.082 794 H ASP 102 H ASP 102 -14.728 -42.110 -7.714 795 HA ASP 102 HA ASP 102 -14.845 -43.515 -5.115 796 HB2 ASP 102 HB2 ASP 102 -16.871 -43.802 -7.374 797 HB3 ASP 102 HB3 ASP 102 -16.696 -44.934 -6.030 798 H GLU 103 H GLU 103 -14.538 -45.898 -5.469 799 HA GLU 103 HA GLU 103 -13.055 -46.537 -7.949 800 HB2 GLU 103 HB2 GLU 103 -12.077 -47.298 -5.183 801 HB3 GLU 103 HB3 GLU 103 -11.234 -47.438 -6.726 802 HG2 GLU 103 HG2 GLU 103 -11.352 -44.903 -6.890 803 HG3 GLU 103 HG3 GLU 103 -11.919 -44.887 -5.217 804 H LEU 104 H LEU 104 -12.339 -49.027 -7.584 805 HA LEU 104 HA LEU 104 -14.784 -50.534 -7.663 806 HB2 LEU 104 HB2 LEU 104 -11.883 -51.408 -7.540 807 HB3 LEU 104 HB3 LEU 104 -13.203 -52.471 -7.872 808 HG LEU 104 HG LEU 104 -12.150 -52.002 -9.912 809 HD11 LEU 104 HD11 LEU 104 -14.006 -51.135 -11.234 810 HD12 LEU 104 HD12 LEU 104 -14.620 -52.167 -9.925 811 HD13 LEU 104 HD13 LEU 104 -14.728 -50.386 -9.796 812 HD21 LEU 104 HD21 LEU 104 -12.710 -49.033 -9.582 813 HD22 LEU 104 HD22 LEU 104 -11.120 -49.796 -9.284 814 HD23 LEU 104 HD23 LEU 104 -11.851 -49.839 -10.904 815 HA PRO 105 HA PRO 105 -15.111 -51.713 -3.466 816 HB2 PRO 105 HB2 PRO 105 -16.466 -54.061 -3.568 817 HB3 PRO 105 HB3 PRO 105 -17.144 -52.561 -4.274 818 HG2 PRO 105 HG2 PRO 105 -15.726 -54.818 -5.695 819 HG3 PRO 105 HG3 PRO 105 -17.222 -53.965 -6.178 820 HD2 PRO 105 HD2 PRO 105 -14.673 -53.406 -7.101 821 HD3 PRO 105 HD3 PRO 105 -15.979 -52.206 -7.124 822 H GLU 106 H GLU 106 -12.583 -52.746 -5.021 823 HA GLU 106 HA GLU 106 -10.783 -54.050 -4.662 824 HB2 GLU 106 HB2 GLU 106 -11.040 -52.759 -2.483 825 HB3 GLU 106 HB3 GLU 106 -11.648 -54.262 -1.769 826 HG2 GLU 106 HG2 GLU 106 -9.519 -55.393 -2.367 827 HG3 GLU 106 HG3 GLU 106 -8.960 -53.913 -3.171 828 H GLY 107 H GLY 107 -13.412 -55.331 -5.333 829 HA2 GLY 107 HA2 GLY 107 -12.520 -58.107 -4.966 830 HA3 GLY 107 HA3 GLY 107 -14.127 -57.691 -4.337 831 H TYR 108 H TYR 108 -13.058 -55.889 -7.090 832 HA TYR 108 HA TYR 108 -15.185 -56.759 -8.749 833 HB2 TYR 108 HB2 TYR 108 -14.170 -55.353 -10.444 834 HB3 TYR 108 HB3 TYR 108 -14.230 -54.542 -8.884 835 HD1 TYR 108 HD1 TYR 108 -12.061 -54.588 -7.439 836 HD2 TYR 108 HD2 TYR 108 -12.173 -55.453 -11.643 837 HE1 TYR 108 HE1 TYR 108 -9.636 -54.065 -7.597 838 HE2 TYR 108 HE2 TYR 108 -9.753 -54.915 -11.820 839 HH TYR 108 HH TYR 108 -7.820 -53.875 -8.971 840 H ASP 109 H ASP 109 -14.701 -57.433 -11.108 841 HA ASP 109 HA ASP 109 -13.693 -60.107 -10.988 842 HB2 ASP 109 HB2 ASP 109 -14.654 -58.424 -13.314 843 HB3 ASP 109 HB3 ASP 109 -14.398 -60.177 -13.366 844 H ARG 110 H ARG 110 -11.715 -57.867 -10.646 845 HA ARG 110 HA ARG 110 -9.659 -57.212 -11.291 846 HB2 ARG 110 HB2 ARG 110 -9.470 -59.695 -10.660 847 HB3 ARG 110 HB3 ARG 110 -9.271 -59.972 -12.396 848 HG2 ARG 110 HG2 ARG 110 -7.088 -59.822 -11.286 849 HG3 ARG 110 HG3 ARG 110 -7.291 -58.459 -12.395 850 HD2 ARG 110 HD2 ARG 110 -6.295 -57.759 -10.262 851 HD3 ARG 110 HD3 ARG 110 -7.865 -56.985 -10.521 852 HE ARG 110 HE ARG 110 -8.276 -59.378 -9.036 853 HH11 ARG 110 HH11 ARG 110 -6.830 -56.183 -8.657 854 HH12 ARG 110 HH12 ARG 110 -7.093 -56.125 -6.938 855 HH21 ARG 110 HH21 ARG 110 -8.614 -59.286 -6.781 856 HH22 ARG 110 HH22 ARG 110 -8.117 -57.886 -5.877 857 H SER 111 H SER 111 -11.861 -56.980 -13.346 858 HA SER 111 HA SER 111 -10.128 -56.331 -15.654 859 HB2 SER 111 HB2 SER 111 -12.696 -57.969 -15.848 860 HB3 SER 111 HB3 SER 111 -11.733 -57.353 -17.207 861 HG SER 111 HG SER 111 -10.911 -59.215 -15.222 Start of MODEL 8 1 H1 SER 2 H1 SER 2 5.364 -0.556 -2.179 2 H2 SER 2 H2 SER 2 4.595 -2.005 -2.188 3 H3 SER 2 H3 SER 2 5.360 -1.471 -3.547 4 HA SER 2 HA SER 2 7.487 -1.578 -2.462 5 HB2 SER 2 HB2 SER 2 7.606 -2.741 -0.257 6 HB3 SER 2 HB3 SER 2 6.832 -1.143 -0.207 7 HG SER 2 HG SER 2 5.641 -2.722 0.951 8 H GLN 3 H GLN 3 5.370 -4.285 -1.369 9 HA GLN 3 HA GLN 3 6.187 -5.924 -3.675 10 HB2 GLN 3 HB2 GLN 3 8.062 -6.142 -2.065 11 HB3 GLN 3 HB3 GLN 3 6.920 -6.616 -0.790 12 HG2 GLN 3 HG2 GLN 3 6.311 -8.632 -2.036 13 HG3 GLN 3 HG3 GLN 3 7.360 -8.149 -3.387 14 HE21 GLN 3 HE22 GLN 3 7.215 -10.263 -0.880 15 HE22 GLN 3 HE21 GLN 3 8.916 -10.385 -0.487 16 H PHE 4 H PHE 4 4.777 -7.704 -3.985 17 HA PHE 4 HA PHE 4 2.724 -8.341 -1.990 18 HB2 PHE 4 HB2 PHE 4 1.838 -6.291 -2.994 19 HB3 PHE 4 HB3 PHE 4 2.083 -6.920 -4.601 20 HD1 PHE 4 HD2 PHE 4 0.736 -9.099 -5.237 21 HD2 PHE 4 HD1 PHE 4 -0.223 -6.512 -1.942 22 HE1 PHE 4 HE2 PHE 4 -1.562 -10.010 -5.212 23 HE2 PHE 4 HE1 PHE 4 -2.549 -7.390 -1.945 24 HZ PHE 4 HZ PHE 4 -3.226 -9.122 -3.582 25 H GLU 5 H GLU 5 3.557 -8.554 -5.520 26 HA GLU 5 HA GLU 5 2.206 -11.117 -5.736 27 HB2 GLU 5 HB2 GLU 5 4.049 -9.611 -7.647 28 HB3 GLU 5 HB3 GLU 5 3.140 -11.078 -8.055 29 HG2 GLU 5 HG2 GLU 5 1.018 -9.913 -7.508 30 HG3 GLU 5 HG3 GLU 5 1.925 -8.431 -7.157 31 H LYS 6 H LYS 6 5.531 -10.132 -5.041 32 HA LYS 6 HA LYS 6 6.858 -12.488 -5.968 33 HB2 LYS 6 HB2 LYS 6 7.946 -10.376 -5.489 34 HB3 LYS 6 HB3 LYS 6 7.630 -10.614 -3.756 35 HG2 LYS 6 HG2 LYS 6 9.036 -12.564 -3.668 36 HG3 LYS 6 HG3 LYS 6 9.103 -12.668 -5.448 37 HD2 LYS 6 HD2 LYS 6 10.283 -10.542 -5.555 38 HD3 LYS 6 HD3 LYS 6 10.218 -10.394 -3.777 39 HE2 LYS 6 HE2 LYS 6 11.544 -12.486 -3.573 40 HE3 LYS 6 HE3 LYS 6 11.589 -12.638 -5.335 41 HZ1 LYS 6 HZ1 LYS 6 12.748 -10.416 -3.784 42 HZ2 LYS 6 HZ2 LYS 6 13.595 -11.634 -4.492 43 HZ3 LYS 6 HZ3 LYS 6 12.779 -10.553 -5.423 44 H GLN 7 H GLN 7 5.538 -11.637 -2.712 45 HA GLN 7 HA GLN 7 6.429 -14.078 -1.513 46 HB2 GLN 7 HB2 GLN 7 5.386 -11.631 -0.688 47 HB3 GLN 7 HB3 GLN 7 4.057 -12.737 -0.348 48 HG2 GLN 7 HG2 GLN 7 6.929 -12.943 0.612 49 HG3 GLN 7 HG3 GLN 7 5.505 -12.563 1.598 50 HE21 GLN 7 HE22 GLN 7 3.695 -14.335 1.471 51 HE22 GLN 7 HE21 GLN 7 4.261 -15.988 1.532 52 H LYS 8 H LYS 8 3.451 -13.048 -3.132 53 HA LYS 8 HA LYS 8 1.801 -15.263 -2.306 54 HB2 LYS 8 HB2 LYS 8 1.064 -12.981 -2.978 55 HB3 LYS 8 HB3 LYS 8 1.597 -13.323 -4.599 56 HG2 LYS 8 HG2 LYS 8 -0.073 -15.362 -4.463 57 HG3 LYS 8 HG3 LYS 8 -0.734 -14.517 -3.073 58 HD2 LYS 8 HD2 LYS 8 -2.011 -13.793 -4.989 59 HD3 LYS 8 HD3 LYS 8 -0.916 -12.445 -4.627 60 HE2 LYS 8 HE2 LYS 8 0.664 -13.155 -6.322 61 HE3 LYS 8 HE3 LYS 8 -0.196 -14.676 -6.563 62 HZ1 LYS 8 HZ1 LYS 8 -1.255 -11.981 -7.180 63 HZ2 LYS 8 HZ2 LYS 8 -0.691 -13.064 -8.283 64 HZ3 LYS 8 HZ3 LYS 8 -2.057 -13.405 -7.426 65 H GLU 9 H GLU 9 3.880 -14.634 -5.194 66 HA GLU 9 HA GLU 9 2.906 -16.996 -6.556 67 HB2 GLU 9 HB2 GLU 9 3.715 -14.935 -7.675 68 HB3 GLU 9 HB3 GLU 9 5.344 -15.223 -7.009 69 HG2 GLU 9 HG2 GLU 9 5.458 -17.367 -8.200 70 HG3 GLU 9 HG3 GLU 9 3.804 -17.132 -8.799 71 H GLN 10 H GLN 10 5.672 -16.162 -4.455 72 HA GLN 10 HA GLN 10 7.139 -18.585 -4.974 73 HB2 GLN 10 HB2 GLN 10 7.275 -16.475 -2.802 74 HB3 GLN 10 HB3 GLN 10 8.372 -17.874 -2.864 75 HG2 GLN 10 HG2 GLN 10 9.083 -17.255 -5.141 76 HG3 GLN 10 HG3 GLN 10 8.043 -15.830 -5.106 77 HE21 GLN 10 HE22 GLN 10 10.973 -15.970 -5.441 78 HE22 GLN 10 HE21 GLN 10 11.664 -15.064 -4.106 79 H GLY 11 H GLY 11 4.159 -18.321 -3.591 80 HA2 GLY 11 HA2 GLY 11 4.664 -20.748 -1.935 81 HA3 GLY 11 HA3 GLY 11 3.540 -19.502 -1.413 82 H ASN 12 H ASN 12 3.224 -19.571 -4.762 83 HA ASN 12 HA ASN 12 0.708 -20.905 -4.666 84 HB2 ASN 12 HB2 ASN 12 0.539 -20.322 -6.847 85 HB3 ASN 12 HB3 ASN 12 1.904 -19.280 -6.459 86 HD21 ASN 12 HD22 ASN 12 4.038 -20.031 -7.129 87 HD22 ASN 12 HD21 ASN 12 4.172 -21.168 -8.450 88 H SER 13 H SER 13 4.005 -22.027 -5.143 89 HA SER 13 HA SER 13 3.160 -24.675 -6.041 90 HB2 SER 13 HB2 SER 13 5.274 -23.611 -6.819 91 HB3 SER 13 HB3 SER 13 5.892 -23.656 -5.153 92 HG SER 13 HG SER 13 5.690 -25.945 -5.236 93 H LEU 14 H LEU 14 4.136 -23.108 -2.974 94 HA LEU 14 HA LEU 14 4.524 -25.451 -1.431 95 HB2 LEU 14 HB2 LEU 14 3.480 -22.670 -0.737 96 HB3 LEU 14 HB3 LEU 14 3.976 -23.863 0.440 97 HG LEU 14 HG LEU 14 5.774 -22.579 -1.645 98 HD11 LEU 14 HD11 LEU 14 5.096 -21.126 0.263 99 HD12 LEU 14 HD12 LEU 14 5.664 -22.367 1.396 100 HD13 LEU 14 HD13 LEU 14 6.825 -21.534 0.331 101 HD21 LEU 14 HD21 LEU 14 6.532 -24.852 -1.241 102 HD22 LEU 14 HD22 LEU 14 7.606 -23.724 -0.401 103 HD23 LEU 14 HD23 LEU 14 6.380 -24.627 0.529 104 H PHE 15 H PHE 15 1.627 -23.618 -2.379 105 HA PHE 15 HA PHE 15 -0.279 -24.987 -0.767 106 HB2 PHE 15 HB2 PHE 15 -0.803 -22.909 -1.879 107 HB3 PHE 15 HB3 PHE 15 -0.348 -23.564 -3.439 108 HD1 PHE 15 HD1 PHE 15 -2.643 -24.717 -0.684 109 HD2 PHE 15 HD2 PHE 15 -2.103 -23.821 -4.845 110 HE1 PHE 15 HE1 PHE 15 -5.003 -25.368 -1.119 111 HE2 PHE 15 HE2 PHE 15 -4.490 -24.428 -5.287 112 HZ PHE 15 HZ PHE 15 -5.922 -25.206 -3.433 113 H LYS 16 H LYS 16 1.517 -25.959 -3.579 114 HA LYS 16 HA LYS 16 -0.404 -28.142 -4.170 115 HB2 LYS 16 HB2 LYS 16 1.902 -27.023 -5.805 116 HB3 LYS 16 HB3 LYS 16 0.731 -28.251 -6.343 117 HG2 LYS 16 HG2 LYS 16 -1.116 -26.670 -6.123 118 HG3 LYS 16 HG3 LYS 16 -0.048 -25.459 -5.393 119 HD2 LYS 16 HD2 LYS 16 1.292 -25.398 -7.507 120 HD3 LYS 16 HD3 LYS 16 0.055 -26.452 -8.254 121 HE2 LYS 16 HE2 LYS 16 -1.684 -24.756 -7.614 122 HE3 LYS 16 HE3 LYS 16 -0.398 -23.713 -6.967 123 HZ1 LYS 16 HZ1 LYS 16 0.558 -23.598 -9.142 124 HZ2 LYS 16 HZ2 LYS 16 -0.582 -24.603 -9.770 125 HZ3 LYS 16 HZ3 LYS 16 -1.016 -23.114 -9.216 126 H GLN 17 H GLN 17 2.424 -27.627 -2.403 127 HA GLN 17 HA GLN 17 3.668 -30.208 -2.906 128 HB2 GLN 17 HB2 GLN 17 4.086 -28.114 -0.767 129 HB3 GLN 17 HB3 GLN 17 4.992 -29.631 -0.882 130 HG2 GLN 17 HG2 GLN 17 5.463 -28.919 -3.350 131 HG3 GLN 17 HG3 GLN 17 5.003 -27.299 -2.789 132 HE21 GLN 17 HE22 GLN 17 5.989 -27.137 -0.254 133 HE22 GLN 17 HE21 GLN 17 7.726 -27.324 -0.269 134 H GLY 18 H GLY 18 0.954 -29.127 -0.997 135 HA2 GLY 18 HA2 GLY 18 -0.532 -30.641 0.030 136 HA3 GLY 18 HA3 GLY 18 0.754 -31.857 0.132 137 H LEU 19 H LEU 19 1.310 -28.524 1.161 138 HA LEU 19 HA LEU 19 1.016 -29.276 4.002 139 HB2 LEU 19 HB2 LEU 19 3.223 -28.090 4.436 140 HB3 LEU 19 HB3 LEU 19 3.252 -29.723 3.754 141 HG LEU 19 HG LEU 19 3.685 -28.841 1.510 142 HD11 LEU 19 HD11 LEU 19 3.857 -26.138 2.900 143 HD12 LEU 19 HD12 LEU 19 4.337 -26.476 1.227 144 HD13 LEU 19 HD13 LEU 19 2.633 -26.614 1.704 145 HD21 LEU 19 HD21 LEU 19 5.527 -29.454 3.031 146 HD22 LEU 19 HD22 LEU 19 5.994 -28.111 1.961 147 HD23 LEU 19 HD23 LEU 19 5.563 -27.797 3.660 148 H TYR 20 H TYR 20 -0.907 -28.048 2.851 149 HA TYR 20 HA TYR 20 -0.982 -25.460 2.078 150 HB2 TYR 20 HB2 TYR 20 -3.049 -26.666 3.926 151 HB3 TYR 20 HB3 TYR 20 -3.327 -25.515 2.634 152 HD1 TYR 20 HD2 TYR 20 -1.896 -26.712 0.337 153 HD2 TYR 20 HD1 TYR 20 -4.215 -28.576 3.447 154 HE1 TYR 20 HE2 TYR 20 -2.388 -28.625 -1.161 155 HE2 TYR 20 HE1 TYR 20 -4.730 -30.470 1.945 156 HH TYR 20 HH TYR 20 -4.379 -31.416 -0.117 157 H ARG 21 H ARG 21 -0.474 -26.417 5.477 158 HA ARG 21 HA ARG 21 -1.487 -24.084 6.683 159 HB2 ARG 21 HB2 ARG 21 -0.128 -26.445 7.467 160 HB3 ARG 21 HB3 ARG 21 0.879 -25.113 8.054 161 HG2 ARG 21 HG2 ARG 21 -2.102 -25.477 8.569 162 HG3 ARG 21 HG3 ARG 21 -0.797 -25.784 9.735 163 HD2 ARG 21 HD2 ARG 21 -0.150 -23.426 9.710 164 HD3 ARG 21 HD3 ARG 21 -1.373 -23.076 8.479 165 HE ARG 21 HE ARG 21 -1.812 -23.489 11.342 166 HH11 ARG 21 HH11 ARG 21 -3.266 -23.375 8.128 167 HH12 ARG 21 HH12 ARG 21 -4.900 -23.186 8.739 168 HH21 ARG 21 HH21 ARG 21 -3.967 -23.179 12.107 169 HH22 ARG 21 HH22 ARG 21 -5.284 -23.039 10.958 170 H GLU 22 H GLU 22 1.503 -24.613 4.920 171 HA GLU 22 HA GLU 22 2.768 -22.123 5.820 172 HB2 GLU 22 HB2 GLU 22 3.279 -23.877 3.380 173 HB3 GLU 22 HB3 GLU 22 4.387 -22.667 4.052 174 HG2 GLU 22 HG2 GLU 22 3.443 -25.151 5.551 175 HG3 GLU 22 HG3 GLU 22 4.902 -25.057 4.587 176 H ALA 23 H ALA 23 0.939 -23.365 3.071 177 HA ALA 23 HA ALA 23 1.256 -21.119 1.342 178 HB1 ALA 23 HB1 ALA 23 -0.838 -23.304 1.384 179 HB2 ALA 23 HB2 ALA 23 -0.460 -22.227 0.020 180 HB3 ALA 23 HB3 ALA 23 0.762 -23.395 0.605 181 H VAL 24 H VAL 24 -0.917 -21.551 4.076 182 HA VAL 24 HA VAL 24 -2.965 -19.665 3.129 183 HB VAL 24 HB VAL 24 -2.039 -20.540 5.913 184 HG11 VAL 24 HG11 VAL 24 -4.597 -19.089 5.061 185 HG12 VAL 24 HG12 VAL 24 -4.237 -19.684 6.697 186 HG13 VAL 24 HG13 VAL 24 -3.256 -18.383 6.000 187 HG21 VAL 24 HG21 VAL 24 -3.026 -22.399 4.551 188 HG22 VAL 24 HG22 VAL 24 -4.106 -21.956 5.888 189 HG23 VAL 24 HG23 VAL 24 -4.457 -21.411 4.233 190 H HIS 25 H HIS 25 -0.142 -19.824 5.082 191 HA HIS 25 HA HIS 25 0.126 -17.122 5.959 192 HB2 HIS 25 HB2 HIS 25 1.172 -19.825 6.304 193 HB3 HIS 25 HB3 HIS 25 2.469 -18.716 6.147 194 HD2 HIS 25 HD2 HIS 25 3.021 -17.316 8.402 195 HE1 HIS 25 HE1 HIS 25 -0.509 -18.302 10.579 196 HE2 HIS 25 HE2 HIS 25 1.766 -17.145 10.706 197 H CYS 26 H CYS 26 0.312 -18.174 2.915 198 HA CYS 26 HA CYS 26 2.664 -16.484 2.213 199 HB2 CYS 26 HB2 CYS 26 1.579 -19.014 0.934 200 HB3 CYS 26 HB3 CYS 26 2.634 -17.878 0.092 201 HG CYS 26 HG CYS 26 3.145 -19.406 2.983 202 H TYR 27 H TYR 27 -0.628 -16.558 2.212 203 HA TYR 27 HA TYR 27 -0.736 -14.617 -0.068 204 HB2 TYR 27 HB2 TYR 27 -2.995 -16.359 0.922 205 HB3 TYR 27 HB3 TYR 27 -3.005 -15.342 -0.522 206 HD1 TYR 27 HD2 TYR 27 -0.399 -16.172 -1.793 207 HD2 TYR 27 HD1 TYR 27 -3.445 -18.453 0.199 208 HE1 TYR 27 HE2 TYR 27 0.205 -18.167 -3.157 209 HE2 TYR 27 HE1 TYR 27 -2.844 -20.453 -1.154 210 HH TYR 27 HH TYR 27 -1.514 -21.288 -2.809 211 H ASP 28 H ASP 28 -1.031 -15.124 3.288 212 HA ASP 28 HA ASP 28 -3.231 -13.371 3.874 213 HB2 ASP 28 HB2 ASP 28 -2.269 -15.198 5.328 214 HB3 ASP 28 HB3 ASP 28 -0.852 -14.188 5.605 215 H GLN 29 H GLN 29 0.222 -12.880 3.248 216 HA GLN 29 HA GLN 29 0.435 -10.375 4.607 217 HB2 GLN 29 HB2 GLN 29 2.553 -10.173 3.646 218 HB3 GLN 29 HB3 GLN 29 2.335 -11.898 3.962 219 HG2 GLN 29 HG2 GLN 29 1.818 -10.543 1.311 220 HG3 GLN 29 HG3 GLN 29 3.356 -11.308 1.717 221 HE21 GLN 29 HE22 GLN 29 1.691 -11.959 -0.518 222 HE22 GLN 29 HE21 GLN 29 1.177 -13.620 -0.362 223 H LEU 30 H LEU 30 -1.292 -11.201 1.844 224 HA LEU 30 HA LEU 30 -0.985 -8.647 0.424 225 HB2 LEU 30 HB2 LEU 30 -2.991 -10.926 0.097 226 HB3 LEU 30 HB3 LEU 30 -2.602 -9.680 -1.094 227 HG LEU 30 HG LEU 30 -0.805 -11.894 -0.046 228 HD11 LEU 30 HD11 LEU 30 -2.478 -12.641 -1.619 229 HD12 LEU 30 HD12 LEU 30 -2.061 -11.327 -2.751 230 HD13 LEU 30 HD13 LEU 30 -0.896 -12.610 -2.387 231 HD21 LEU 30 HD21 LEU 30 0.569 -9.887 -0.450 232 HD22 LEU 30 HD22 LEU 30 0.847 -11.101 -1.711 233 HD23 LEU 30 HD23 LEU 30 -0.177 -9.716 -2.051 234 H ILE 31 H ILE 31 -3.246 -10.264 2.608 235 HA ILE 31 HA ILE 31 -5.310 -8.248 2.331 236 HB ILE 31 HB ILE 31 -4.816 -10.481 4.331 237 HG12 ILE 31 HG12 ILE 31 -6.767 -10.588 2.009 238 HG13 ILE 31 HG13 ILE 31 -5.091 -11.032 1.796 239 HG21 ILE 31 HG21 ILE 31 -7.339 -8.900 3.757 240 HG22 ILE 31 HG22 ILE 31 -7.279 -10.359 4.772 241 HG23 ILE 31 HG23 ILE 31 -6.419 -8.901 5.273 242 HD11 ILE 31 HD11 ILE 31 -6.344 -13.019 2.257 243 HD12 ILE 31 HD12 ILE 31 -5.229 -12.663 3.600 244 HD13 ILE 31 HD13 ILE 31 -6.963 -12.306 3.781 245 H THR 32 H THR 32 -2.366 -8.628 4.005 246 HA THR 32 HA THR 32 -2.991 -6.608 6.085 247 HB THR 32 HB THR 32 -0.565 -8.359 5.577 248 HG1 THR 32 HG1 THR 32 -1.394 -9.494 7.363 249 HG21 THR 32 HG21 THR 32 -1.266 -6.543 7.924 250 HG22 THR 32 HG22 THR 32 0.022 -7.771 7.952 251 HG23 THR 32 HG23 THR 32 0.139 -6.405 6.836 252 H ALA 33 H ALA 33 -1.624 -6.814 2.906 253 HA ALA 33 HA ALA 33 -0.081 -4.301 3.406 254 HB1 ALA 33 HB1 ALA 33 0.256 -6.383 1.201 255 HB2 ALA 33 HB2 ALA 33 1.227 -4.918 1.406 256 HB3 ALA 33 HB3 ALA 33 1.289 -6.199 2.640 257 H GLN 34 H GLN 34 -2.015 -5.924 0.807 258 HA GLN 34 HA GLN 34 -3.057 -3.250 0.101 259 HB2 GLN 34 HB2 GLN 34 -2.077 -5.147 -2.017 260 HB3 GLN 34 HB3 GLN 34 -2.542 -3.477 -2.221 261 HG2 GLN 34 HG2 GLN 34 -0.044 -4.525 -0.835 262 HG3 GLN 34 HG3 GLN 34 -0.137 -3.736 -2.413 263 HE21 GLN 34 HE22 GLN 34 -1.960 -1.591 -1.730 264 HE22 GLN 34 HE21 GLN 34 -1.139 -0.550 -0.578 265 HA PRO 35 HA PRO 35 -6.070 -6.789 0.481 266 HB2 PRO 35 HB2 PRO 35 -7.879 -5.538 2.121 267 HB3 PRO 35 HB3 PRO 35 -6.373 -6.329 2.700 268 HG2 PRO 35 HG2 PRO 35 -6.803 -3.396 2.103 269 HG3 PRO 35 HG3 PRO 35 -6.115 -4.142 3.591 270 HD2 PRO 35 HD2 PRO 35 -4.496 -3.212 1.637 271 HD3 PRO 35 HD3 PRO 35 -4.119 -4.753 2.471 272 H GLN 36 H GLN 36 -6.029 -3.835 -1.122 273 HA GLN 36 HA GLN 36 -8.859 -3.552 -1.657 274 HB2 GLN 36 HB2 GLN 36 -6.750 -2.329 -3.429 275 HB3 GLN 36 HB3 GLN 36 -8.300 -1.677 -2.900 276 HG2 GLN 36 HG2 GLN 36 -6.827 -0.414 -1.616 277 HG3 GLN 36 HG3 GLN 36 -7.205 -1.744 -0.498 278 HE21 GLN 36 HE22 GLN 36 -5.039 -0.851 0.413 279 HE22 GLN 36 HE21 GLN 36 -3.590 -1.623 -0.226 280 H ASN 37 H ASN 37 -7.200 -6.103 -2.417 281 HA ASN 37 HA ASN 37 -8.186 -6.281 -5.229 282 HB2 ASN 37 HB2 ASN 37 -5.470 -7.192 -4.198 283 HB3 ASN 37 HB3 ASN 37 -6.080 -7.422 -5.844 284 HD21 ASN 37 HD22 ASN 37 -4.898 -5.040 -3.466 285 HD22 ASN 37 HD21 ASN 37 -4.607 -3.769 -4.631 286 HA PRO 38 HA PRO 38 -10.002 -9.945 -3.536 287 HB2 PRO 38 HB2 PRO 38 -10.961 -11.085 -5.768 288 HB3 PRO 38 HB3 PRO 38 -11.522 -9.478 -5.228 289 HG2 PRO 38 HG2 PRO 38 -9.337 -10.024 -7.261 290 HG3 PRO 38 HG3 PRO 38 -10.824 -9.035 -7.490 291 HD2 PRO 38 HD2 PRO 38 -8.552 -7.800 -6.718 292 HD3 PRO 38 HD3 PRO 38 -10.072 -7.407 -5.974 293 H VAL 39 H VAL 39 -7.213 -10.058 -5.661 294 HA VAL 39 HA VAL 39 -7.099 -12.884 -6.063 295 HB VAL 39 HB VAL 39 -5.883 -11.159 -7.367 296 HG11 VAL 39 HG11 VAL 39 -3.777 -10.259 -6.564 297 HG12 VAL 39 HG12 VAL 39 -5.075 -9.776 -5.456 298 HG13 VAL 39 HG13 VAL 39 -3.960 -11.091 -5.007 299 HG21 VAL 39 HG21 VAL 39 -5.279 -13.559 -7.442 300 HG22 VAL 39 HG22 VAL 39 -3.889 -12.493 -7.722 301 HG23 VAL 39 HG23 VAL 39 -4.090 -13.286 -6.139 302 H GLY 40 H GLY 40 -5.958 -10.777 -3.458 303 HA2 GLY 40 HA2 GLY 40 -4.525 -12.677 -1.908 304 HA3 GLY 40 HA3 GLY 40 -5.286 -11.189 -1.319 305 H TYR 41 H TYR 41 -7.900 -12.379 -2.563 306 HA TYR 41 HA TYR 41 -8.522 -14.331 -0.409 307 HB2 TYR 41 HB2 TYR 41 -10.626 -12.650 -1.740 308 HB3 TYR 41 HB3 TYR 41 -10.698 -13.466 -0.240 309 HD1 TYR 41 HD2 TYR 41 -9.077 -10.520 -1.865 310 HD2 TYR 41 HD1 TYR 41 -10.216 -12.418 1.815 311 HE1 TYR 41 HE2 TYR 41 -8.598 -8.416 -0.638 312 HE2 TYR 41 HE1 TYR 41 -9.732 -10.319 3.046 313 HH TYR 41 HH TYR 41 -9.078 -8.126 2.899 314 H SER 42 H SER 42 -7.432 -14.692 -3.199 315 HA SER 42 HA SER 42 -9.582 -16.511 -4.175 316 HB2 SER 42 HB2 SER 42 -9.345 -14.439 -5.583 317 HB3 SER 42 HB3 SER 42 -7.668 -14.930 -5.935 318 HG SER 42 HG SER 42 -9.110 -15.667 -7.531 319 H ASN 43 H ASN 43 -6.691 -16.327 -2.687 320 HA ASN 43 HA ASN 43 -5.846 -18.967 -3.765 321 HB2 ASN 43 HB2 ASN 43 -4.111 -16.566 -3.040 322 HB3 ASN 43 HB3 ASN 43 -3.506 -18.214 -3.290 323 HD21 ASN 43 HD22 ASN 43 -4.756 -15.321 -4.849 324 HD22 ASN 43 HD21 ASN 43 -4.459 -15.852 -6.491 325 H LYS 44 H LYS 44 -5.785 -16.607 -0.986 326 HA LYS 44 HA LYS 44 -5.275 -18.672 0.979 327 HB2 LYS 44 HB2 LYS 44 -4.987 -16.199 1.301 328 HB3 LYS 44 HB3 LYS 44 -6.708 -15.995 1.192 329 HG2 LYS 44 HG2 LYS 44 -7.008 -17.497 3.180 330 HG3 LYS 44 HG3 LYS 44 -5.249 -17.690 3.274 331 HD2 LYS 44 HD2 LYS 44 -4.980 -15.277 3.693 332 HD3 LYS 44 HD3 LYS 44 -6.729 -15.038 3.489 333 HE2 LYS 44 HE2 LYS 44 -7.128 -16.601 5.408 334 HE3 LYS 44 HE3 LYS 44 -5.374 -16.751 5.627 335 HZ1 LYS 44 HZ1 LYS 44 -6.913 -14.246 5.832 336 HZ2 LYS 44 HZ2 LYS 44 -6.346 -15.122 7.105 337 HZ3 LYS 44 HZ3 LYS 44 -5.292 -14.390 6.076 338 H ALA 45 H ALA 45 -8.126 -17.144 -0.435 339 HA ALA 45 HA ALA 45 -10.107 -18.640 0.989 340 HB1 ALA 45 HB1 ALA 45 -10.287 -17.387 -1.772 341 HB2 ALA 45 HB2 ALA 45 -11.633 -17.762 -0.689 342 HB3 ALA 45 HB3 ALA 45 -10.486 -16.474 -0.252 343 H MET 46 H MET 46 -7.779 -19.951 -0.933 344 HA MET 46 HA MET 46 -9.530 -22.201 -1.756 345 HB2 MET 46 HB2 MET 46 -8.891 -20.452 -3.624 346 HB3 MET 46 HB3 MET 46 -7.294 -21.223 -3.546 347 HG2 MET 46 HG2 MET 46 -8.418 -23.435 -3.942 348 HG3 MET 46 HG3 MET 46 -9.963 -22.579 -4.106 349 HE1 MET 46 HE1 MET 46 -9.177 -19.960 -5.747 350 HE2 MET 46 HE2 MET 46 -9.521 -20.544 -7.389 351 HE3 MET 46 HE3 MET 46 -10.600 -20.991 -6.049 352 H ALA 47 H ALA 47 -7.049 -21.230 0.138 353 HA ALA 47 HA ALA 47 -5.837 -23.957 0.054 354 HB1 ALA 47 HB1 ALA 47 -4.453 -21.316 0.710 355 HB2 ALA 47 HB2 ALA 47 -3.712 -22.923 0.797 356 HB3 ALA 47 HB3 ALA 47 -4.229 -22.271 -0.777 357 H LEU 48 H LEU 48 -7.219 -21.301 1.923 358 HA LEU 48 HA LEU 48 -6.662 -22.499 4.503 359 HB2 LEU 48 HB2 LEU 48 -7.038 -20.064 4.089 360 HB3 LEU 48 HB3 LEU 48 -8.704 -20.417 3.585 361 HG LEU 48 HG LEU 48 -9.235 -21.213 5.840 362 HD11 LEU 48 HD11 LEU 48 -7.568 -20.890 7.674 363 HD12 LEU 48 HD12 LEU 48 -7.038 -22.118 6.515 364 HD13 LEU 48 HD13 LEU 48 -6.334 -20.486 6.458 365 HD21 LEU 48 HD21 LEU 48 -9.483 -18.823 5.328 366 HD22 LEU 48 HD22 LEU 48 -8.910 -19.020 7.004 367 HD23 LEU 48 HD23 LEU 48 -7.772 -18.544 5.735 368 H ILE 49 H ILE 49 -9.121 -22.732 1.976 369 HA ILE 49 HA ILE 49 -11.070 -24.212 3.465 370 HB ILE 49 HB ILE 49 -11.810 -25.006 1.231 371 HG12 ILE 49 HG12 ILE 49 -9.651 -23.203 0.147 372 HG13 ILE 49 HG13 ILE 49 -9.360 -24.914 0.325 373 HG21 ILE 49 HG21 ILE 49 -11.257 -22.009 1.416 374 HG22 ILE 49 HG22 ILE 49 -12.511 -22.784 0.422 375 HG23 ILE 49 HG23 ILE 49 -12.620 -22.869 2.186 376 HD11 ILE 49 HD11 ILE 49 -10.060 -24.498 -1.932 377 HD12 ILE 49 HD12 ILE 49 -11.186 -25.546 -1.053 378 HD13 ILE 49 HD13 ILE 49 -11.601 -23.824 -1.362 379 H LYS 50 H LYS 50 -7.987 -24.947 2.025 380 HA LYS 50 HA LYS 50 -8.546 -27.664 1.348 381 HB2 LYS 50 HB2 LYS 50 -6.690 -25.829 0.595 382 HB3 LYS 50 HB3 LYS 50 -5.728 -26.755 1.752 383 HG2 LYS 50 HG2 LYS 50 -5.314 -27.908 -0.191 384 HG3 LYS 50 HG3 LYS 50 -6.712 -28.831 0.388 385 HD2 LYS 50 HD2 LYS 50 -6.700 -26.564 -1.660 386 HD3 LYS 50 HD3 LYS 50 -6.846 -28.294 -2.021 387 HE2 LYS 50 HE2 LYS 50 -8.981 -28.283 -0.632 388 HE3 LYS 50 HE3 LYS 50 -8.848 -26.504 -0.601 389 HZ1 LYS 50 HZ1 LYS 50 -10.242 -27.265 -2.389 390 HZ2 LYS 50 HZ2 LYS 50 -8.900 -26.518 -2.993 391 HZ3 LYS 50 HZ3 LYS 50 -9.014 -28.160 -3.032 392 H LEU 51 H LEU 51 -8.285 -26.288 4.334 393 HA LEU 51 HA LEU 51 -6.897 -28.613 5.583 394 HB2 LEU 51 HB2 LEU 51 -6.921 -25.663 6.300 395 HB3 LEU 51 HB3 LEU 51 -6.341 -26.912 7.405 396 HG LEU 51 HG LEU 51 -5.205 -26.556 4.609 397 HD11 LEU 51 HD11 LEU 51 -4.869 -24.508 5.932 398 HD12 LEU 51 HD12 LEU 51 -4.211 -25.480 7.281 399 HD13 LEU 51 HD13 LEU 51 -3.345 -25.384 5.726 400 HD21 LEU 51 HD21 LEU 51 -4.822 -28.780 5.640 401 HD22 LEU 51 HD22 LEU 51 -3.310 -27.849 5.646 402 HD23 LEU 51 HD23 LEU 51 -4.256 -27.994 7.134 403 H GLY 52 H GLY 52 -9.886 -27.074 5.172 404 HA2 GLY 52 HA2 GLY 52 -11.880 -27.941 6.112 405 HA3 GLY 52 HA3 GLY 52 -10.985 -28.468 7.543 406 H GLU 53 H GLU 53 -9.828 -25.426 7.025 407 HA GLU 53 HA GLU 53 -11.447 -24.310 9.172 408 HB2 GLU 53 HB2 GLU 53 -9.163 -23.102 7.550 409 HB3 GLU 53 HB3 GLU 53 -9.859 -22.429 9.027 410 HG2 GLU 53 HG2 GLU 53 -9.200 -24.426 10.296 411 HG3 GLU 53 HG3 GLU 53 -8.541 -25.166 8.828 412 H TYR 54 H TYR 54 -13.097 -24.828 6.987 413 HA TYR 54 HA TYR 54 -13.396 -22.793 5.058 414 HB2 TYR 54 HB2 TYR 54 -15.364 -24.688 6.377 415 HB3 TYR 54 HB3 TYR 54 -15.829 -23.587 5.081 416 HD1 TYR 54 HD2 TYR 54 -15.013 -23.852 2.809 417 HD2 TYR 54 HD1 TYR 54 -13.997 -26.663 5.898 418 HE1 TYR 54 HE2 TYR 54 -14.274 -25.481 1.086 419 HE2 TYR 54 HE1 TYR 54 -13.228 -28.285 4.180 420 HH TYR 54 HH TYR 54 -12.938 -28.690 1.940 421 H THR 55 H THR 55 -14.420 -22.892 8.461 422 HA THR 55 HA THR 55 -16.384 -20.874 8.408 423 HB THR 55 HB THR 55 -14.306 -21.552 10.521 424 HG1 THR 55 HG1 THR 55 -16.011 -22.854 11.324 425 HG21 THR 55 HG21 THR 55 -16.014 -20.616 12.108 426 HG22 THR 55 HG22 THR 55 -15.427 -19.380 10.987 427 HG23 THR 55 HG23 THR 55 -17.013 -20.133 10.720 428 H GLN 56 H GLN 56 -12.842 -20.667 8.238 429 HA GLN 56 HA GLN 56 -12.857 -17.741 8.596 430 HB2 GLN 56 HB2 GLN 56 -10.712 -19.827 8.171 431 HB3 GLN 56 HB3 GLN 56 -10.408 -18.079 8.168 432 HG2 GLN 56 HG2 GLN 56 -9.971 -18.982 10.347 433 HG3 GLN 56 HG3 GLN 56 -11.333 -17.857 10.416 434 HE21 GLN 56 HE22 GLN 56 -10.547 -21.373 10.179 435 HE22 GLN 56 HE21 GLN 56 -11.929 -21.910 11.114 436 H ALA 57 H ALA 57 -12.700 -20.203 6.017 437 HA ALA 57 HA ALA 57 -11.579 -18.482 3.995 438 HB1 ALA 57 HB1 ALA 57 -11.514 -20.966 3.936 439 HB2 ALA 57 HB2 ALA 57 -13.285 -20.999 3.762 440 HB3 ALA 57 HB3 ALA 57 -12.276 -20.281 2.482 441 H ILE 58 H ILE 58 -14.911 -19.310 4.981 442 HA ILE 58 HA ILE 58 -16.347 -17.979 2.867 443 HB ILE 58 HB ILE 58 -16.850 -18.532 5.871 444 HG12 ILE 58 HG12 ILE 58 -17.900 -20.018 3.438 445 HG13 ILE 58 HG13 ILE 58 -16.464 -20.516 4.329 446 HG21 ILE 58 HG21 ILE 58 -18.434 -16.770 4.791 447 HG22 ILE 58 HG22 ILE 58 -19.077 -18.168 3.889 448 HG23 ILE 58 HG23 ILE 58 -19.149 -18.146 5.645 449 HD11 ILE 58 HD11 ILE 58 -17.840 -20.652 6.422 450 HD12 ILE 58 HD12 ILE 58 -19.289 -20.315 5.446 451 HD13 ILE 58 HD13 ILE 58 -18.364 -21.790 5.162 452 H GLN 59 H GLN 59 -14.968 -16.811 6.020 453 HA GLN 59 HA GLN 59 -16.140 -14.201 5.753 454 HB2 GLN 59 HB2 GLN 59 -13.705 -15.171 7.319 455 HB3 GLN 59 HB3 GLN 59 -14.470 -13.576 7.499 456 HG2 GLN 59 HG2 GLN 59 -16.588 -14.664 8.170 457 HG3 GLN 59 HG3 GLN 59 -15.855 -16.257 7.967 458 HE21 GLN 59 HE22 GLN 59 -15.204 -17.186 9.829 459 HE22 GLN 59 HE21 GLN 59 -14.657 -16.322 11.258 460 H MET 60 H MET 60 -13.220 -15.755 4.476 461 HA MET 60 HA MET 60 -12.040 -13.228 3.615 462 HB2 MET 60 HB2 MET 60 -11.453 -16.123 2.896 463 HB3 MET 60 HB3 MET 60 -10.446 -14.760 2.405 464 HG2 MET 60 HG2 MET 60 -11.047 -15.194 5.331 465 HG3 MET 60 HG3 MET 60 -9.871 -16.217 4.520 466 HE1 MET 60 HE1 MET 60 -10.800 -12.608 5.643 467 HE2 MET 60 HE2 MET 60 -9.349 -11.659 5.196 468 HE3 MET 60 HE3 MET 60 -10.439 -12.228 3.937 469 H CYS 61 H CYS 61 -14.221 -15.691 2.260 470 HA CYS 61 HA CYS 61 -13.906 -14.875 -0.460 471 HB2 CYS 61 HB2 CYS 61 -16.149 -16.288 1.047 472 HB3 CYS 61 HB3 CYS 61 -16.166 -16.050 -0.705 473 HG CYS 61 HG CYS 61 -13.802 -17.498 1.086 474 H GLN 62 H GLN 62 -16.180 -13.865 2.154 475 HA GLN 62 HA GLN 62 -17.541 -11.964 0.426 476 HB2 GLN 62 HB2 GLN 62 -17.537 -12.310 3.452 477 HB3 GLN 62 HB3 GLN 62 -18.707 -11.359 2.508 478 HG2 GLN 62 HG2 GLN 62 -19.484 -13.387 1.351 479 HG3 GLN 62 HG3 GLN 62 -18.228 -14.344 2.134 480 HE21 GLN 62 HE22 GLN 62 -19.745 -15.745 2.927 481 HE22 GLN 62 HE21 GLN 62 -20.820 -15.316 4.221 482 H GLN 63 H GLN 63 -14.458 -11.899 1.681 483 HA GLN 63 HA GLN 63 -14.483 -8.935 2.010 484 HB2 GLN 63 HB2 GLN 63 -12.568 -11.111 2.918 485 HB3 GLN 63 HB3 GLN 63 -12.153 -9.393 2.990 486 HG2 GLN 63 HG2 GLN 63 -14.708 -10.395 4.288 487 HG3 GLN 63 HG3 GLN 63 -13.143 -10.567 5.093 488 HE21 GLN 63 HE22 GLN 63 -13.253 -9.106 6.722 489 HE22 GLN 63 HE21 GLN 63 -13.499 -7.390 6.490 490 H GLY 64 H GLY 64 -14.043 -11.259 -0.336 491 HA2 GLY 64 HA2 GLY 64 -11.947 -9.633 -1.722 492 HA3 GLY 64 HA3 GLY 64 -12.257 -11.355 -1.998 493 H LEU 65 H LEU 65 -15.221 -11.059 -1.879 494 HA LEU 65 HA LEU 65 -15.800 -10.246 -4.562 495 HB2 LEU 65 HB2 LEU 65 -17.444 -10.834 -2.080 496 HB3 LEU 65 HB3 LEU 65 -18.221 -10.319 -3.575 497 HG LEU 65 HG LEU 65 -16.360 -12.736 -3.426 498 HD11 LEU 65 HD11 LEU 65 -18.359 -13.065 -2.005 499 HD12 LEU 65 HD12 LEU 65 -19.403 -12.564 -3.356 500 HD13 LEU 65 HD13 LEU 65 -18.449 -14.061 -3.470 501 HD21 LEU 65 HD21 LEU 65 -16.572 -11.802 -5.677 502 HD22 LEU 65 HD22 LEU 65 -17.482 -13.323 -5.554 503 HD23 LEU 65 HD23 LEU 65 -18.349 -11.767 -5.520 504 H ARG 66 H ARG 66 -15.006 -8.387 -1.873 505 HA ARG 66 HA ARG 66 -16.626 -6.037 -2.517 506 HB2 ARG 66 HB2 ARG 66 -14.146 -6.362 -0.769 507 HB3 ARG 66 HB3 ARG 66 -15.268 -4.992 -0.756 508 HG2 ARG 66 HG2 ARG 66 -17.080 -6.530 0.028 509 HG3 ARG 66 HG3 ARG 66 -15.904 -7.858 0.048 510 HD2 ARG 66 HD2 ARG 66 -16.126 -6.960 2.292 511 HD3 ARG 66 HD3 ARG 66 -14.510 -6.583 1.662 512 HE ARG 66 HE ARG 66 -16.350 -4.438 1.106 513 HH11 ARG 66 HH11 ARG 66 -14.477 -5.891 3.732 514 HH12 ARG 66 HH12 ARG 66 -14.336 -4.393 4.622 515 HH21 ARG 66 HH21 ARG 66 -16.147 -2.500 2.284 516 HH22 ARG 66 HH22 ARG 66 -15.304 -2.480 3.813 517 H TYR 67 H TYR 67 -14.160 -7.520 -4.132 518 HA TYR 67 HA TYR 67 -12.832 -5.012 -5.007 519 HB2 TYR 67 HB2 TYR 67 -11.490 -7.533 -4.020 520 HB3 TYR 67 HB3 TYR 67 -10.651 -6.161 -4.728 521 HD1 TYR 67 HD1 TYR 67 -11.487 -3.790 -3.592 522 HD2 TYR 67 HD2 TYR 67 -11.371 -7.648 -1.708 523 HE1 TYR 67 HE1 TYR 67 -11.421 -2.694 -1.368 524 HE2 TYR 67 HE2 TYR 67 -11.306 -6.569 0.520 525 HH TYR 67 HH TYR 67 -11.332 -2.996 0.906 526 H THR 68 H THR 68 -14.823 -7.171 -6.064 527 HA THR 68 HA THR 68 -13.348 -7.792 -8.581 528 HB THR 68 HB THR 68 -15.013 -9.643 -8.824 529 HG1 THR 68 HG1 THR 68 -16.189 -10.203 -6.982 530 HG21 THR 68 HG21 THR 68 -13.355 -9.709 -6.288 531 HG22 THR 68 HG22 THR 68 -13.920 -11.124 -7.197 532 HG23 THR 68 HG23 THR 68 -12.737 -10.007 -7.926 533 H SER 69 H SER 69 -14.890 -5.342 -7.719 534 HA SER 69 HA SER 69 -17.395 -5.259 -9.116 535 HB2 SER 69 HB2 SER 69 -15.519 -3.073 -8.125 536 HB3 SER 69 HB3 SER 69 -17.166 -2.801 -8.741 537 HG SER 69 HG SER 69 -16.420 -4.415 -6.511 538 H THR 70 H THR 70 -14.608 -5.857 -10.642 539 HA THR 70 HA THR 70 -15.404 -4.323 -13.027 540 HB THR 70 HB THR 70 -13.894 -2.771 -11.997 541 HG1 THR 70 HG1 THR 70 -12.306 -2.697 -13.575 542 HG21 THR 70 HG21 THR 70 -12.735 -4.218 -10.428 543 HG22 THR 70 HG22 THR 70 -11.962 -5.105 -11.759 544 HG23 THR 70 HG23 THR 70 -11.546 -3.402 -11.456 545 H ALA 71 H ALA 71 -14.154 -4.964 -14.945 546 HA ALA 71 HA ALA 71 -14.288 -7.777 -15.286 547 HB1 ALA 71 HB1 ALA 71 -13.470 -7.227 -17.552 548 HB2 ALA 71 HB2 ALA 71 -14.748 -6.103 -17.028 549 HB3 ALA 71 HB3 ALA 71 -13.040 -5.591 -16.995 550 H GLU 72 H GLU 72 -11.717 -5.869 -13.992 551 HA GLU 72 HA GLU 72 -9.477 -7.366 -14.958 552 HB2 GLU 72 HB2 GLU 72 -9.849 -5.840 -12.379 553 HB3 GLU 72 HB3 GLU 72 -8.298 -6.378 -13.017 554 HG2 GLU 72 HG2 GLU 72 -10.190 -4.405 -14.357 555 HG3 GLU 72 HG3 GLU 72 -8.703 -3.996 -13.496 556 H HIS 73 H HIS 73 -12.044 -8.345 -13.006 557 HA HIS 73 HA HIS 73 -10.503 -10.640 -11.930 558 HB2 HIS 73 HB2 HIS 73 -12.492 -9.096 -10.235 559 HB3 HIS 73 HB3 HIS 73 -11.352 -10.329 -9.718 560 HD2 HIS 73 HD2 HIS 73 -11.778 -6.642 -9.933 561 HE1 HIS 73 HE1 HIS 73 -7.609 -7.181 -9.349 562 HE2 HIS 73 HE2 HIS 73 -9.512 -5.477 -9.356 563 H VAL 74 H VAL 74 -12.469 -10.204 -14.150 564 HA VAL 74 HA VAL 74 -15.107 -10.762 -13.523 565 HB VAL 74 HB VAL 74 -14.166 -10.060 -15.689 566 HG11 VAL 74 HG11 VAL 74 -13.523 -13.005 -16.080 567 HG12 VAL 74 HG12 VAL 74 -13.376 -11.725 -17.298 568 HG13 VAL 74 HG13 VAL 74 -12.330 -11.704 -15.869 569 HG21 VAL 74 HG21 VAL 74 -16.504 -10.860 -15.475 570 HG22 VAL 74 HG22 VAL 74 -15.812 -11.220 -17.071 571 HG23 VAL 74 HG23 VAL 74 -15.958 -12.508 -15.857 572 H ALA 75 H ALA 75 -12.422 -13.065 -13.558 573 HA ALA 75 HA ALA 75 -14.288 -15.357 -13.398 574 HB1 ALA 75 HB1 ALA 75 -12.202 -15.537 -14.708 575 HB2 ALA 75 HB2 ALA 75 -11.240 -15.184 -13.254 576 HB3 ALA 75 HB3 ALA 75 -12.200 -16.679 -13.342 577 H ILE 76 H ILE 76 -11.924 -13.612 -11.285 578 HA ILE 76 HA ILE 76 -12.261 -15.320 -9.019 579 HB ILE 76 HB ILE 76 -11.471 -12.389 -9.263 580 HG12 ILE 76 HG12 ILE 76 -9.830 -14.931 -9.024 581 HG13 ILE 76 HG13 ILE 76 -9.977 -13.910 -10.453 582 HG21 ILE 76 HG21 ILE 76 -11.204 -14.294 -6.911 583 HG22 ILE 76 HG22 ILE 76 -10.480 -12.671 -7.004 584 HG23 ILE 76 HG23 ILE 76 -12.232 -12.843 -6.979 585 HD11 ILE 76 HD11 ILE 76 -7.882 -13.405 -9.408 586 HD12 ILE 76 HD12 ILE 76 -8.959 -12.013 -9.182 587 HD13 ILE 76 HD13 ILE 76 -8.649 -13.134 -7.839 588 H ARG 77 H ARG 77 -14.140 -12.644 -10.347 589 HA ARG 77 HA ARG 77 -15.809 -11.968 -8.196 590 HB2 ARG 77 HB2 ARG 77 -15.617 -10.854 -10.434 591 HB3 ARG 77 HB3 ARG 77 -16.434 -12.243 -11.169 592 HG2 ARG 77 HG2 ARG 77 -18.452 -11.778 -9.785 593 HG3 ARG 77 HG3 ARG 77 -17.615 -10.372 -9.076 594 HD2 ARG 77 HD2 ARG 77 -17.402 -9.370 -11.315 595 HD3 ARG 77 HD3 ARG 77 -18.101 -10.824 -12.048 596 HE ARG 77 HE ARG 77 -20.234 -10.151 -11.418 597 HH11 ARG 77 HH11 ARG 77 -17.838 -8.065 -9.836 598 HH12 ARG 77 HH12 ARG 77 -19.045 -6.950 -9.255 599 HH21 ARG 77 HH21 ARG 77 -21.760 -8.666 -10.650 600 HH22 ARG 77 HH22 ARG 77 -21.260 -7.272 -9.730 601 H SER 78 H SER 78 -15.603 -14.919 -10.010 602 HA SER 78 HA SER 78 -18.222 -15.821 -8.907 603 HB2 SER 78 HB2 SER 78 -16.653 -16.755 -11.339 604 HB3 SER 78 HB3 SER 78 -18.170 -17.493 -10.743 605 HG SER 78 HG SER 78 -18.493 -15.913 -12.414 606 H LYS 79 H LYS 79 -14.788 -16.242 -8.527 607 HA LYS 79 HA LYS 79 -15.063 -19.046 -7.740 608 HB2 LYS 79 HB2 LYS 79 -12.775 -17.052 -7.479 609 HB3 LYS 79 HB3 LYS 79 -12.691 -18.749 -7.010 610 HG2 LYS 79 HG2 LYS 79 -13.050 -17.630 -9.802 611 HG3 LYS 79 HG3 LYS 79 -11.690 -18.560 -9.170 612 HD2 LYS 79 HD2 LYS 79 -14.490 -19.536 -9.837 613 HD3 LYS 79 HD3 LYS 79 -12.944 -20.042 -10.539 614 HE2 LYS 79 HE2 LYS 79 -12.316 -20.904 -8.205 615 HE3 LYS 79 HE3 LYS 79 -14.018 -20.617 -7.754 616 HZ1 LYS 79 HZ1 LYS 79 -13.660 -22.881 -8.475 617 HZ2 LYS 79 HZ2 LYS 79 -14.670 -22.102 -9.522 618 HZ3 LYS 79 HZ3 LYS 79 -13.097 -22.378 -9.931 619 H LEU 80 H LEU 80 -14.941 -15.849 -6.090 620 HA LEU 80 HA LEU 80 -14.875 -17.073 -3.450 621 HB2 LEU 80 HB2 LEU 80 -15.268 -14.270 -4.554 622 HB3 LEU 80 HB3 LEU 80 -15.450 -14.650 -2.833 623 HG LEU 80 HG LEU 80 -13.153 -15.384 -2.665 624 HD11 LEU 80 HD11 LEU 80 -12.987 -14.866 -5.658 625 HD12 LEU 80 HD12 LEU 80 -11.576 -15.062 -4.608 626 HD13 LEU 80 HD13 LEU 80 -12.703 -16.409 -4.807 627 HD21 LEU 80 HD21 LEU 80 -13.608 -12.994 -2.448 628 HD22 LEU 80 HD22 LEU 80 -12.035 -13.240 -3.241 629 HD23 LEU 80 HD23 LEU 80 -13.446 -12.773 -4.212 630 H GLN 81 H GLN 81 -17.135 -16.958 -5.879 631 HA GLN 81 HA GLN 81 -19.445 -16.962 -4.008 632 HB2 GLN 81 HB2 GLN 81 -18.992 -16.311 -6.849 633 HB3 GLN 81 HB3 GLN 81 -20.360 -17.413 -6.604 634 HG2 GLN 81 HG2 GLN 81 -20.006 -14.814 -5.064 635 HG3 GLN 81 HG3 GLN 81 -21.059 -14.997 -6.468 636 HE21 GLN 81 HE22 GLN 81 -21.083 -15.060 -3.137 637 HE22 GLN 81 HE21 GLN 81 -22.511 -16.061 -2.931 638 H TYR 82 H TYR 82 -17.765 -18.895 -6.541 639 HA TYR 82 HA TYR 82 -19.437 -21.172 -6.420 640 HB2 TYR 82 HB2 TYR 82 -17.794 -20.844 -8.210 641 HB3 TYR 82 HB3 TYR 82 -16.505 -20.672 -7.042 642 HD1 TYR 82 HD2 TYR 82 -18.964 -23.139 -8.400 643 HD2 TYR 82 HD1 TYR 82 -15.236 -22.533 -6.351 644 HE1 TYR 82 HE2 TYR 82 -18.491 -25.572 -8.555 645 HE2 TYR 82 HE1 TYR 82 -14.739 -24.966 -6.517 646 HH TYR 82 HH TYR 82 -15.469 -27.021 -7.237 647 H ARG 83 H ARG 83 -16.486 -20.369 -4.451 648 HA ARG 83 HA ARG 83 -16.780 -22.967 -3.128 649 HB2 ARG 83 HB2 ARG 83 -14.557 -21.764 -3.727 650 HB3 ARG 83 HB3 ARG 83 -14.873 -20.763 -2.297 651 HG2 ARG 83 HG2 ARG 83 -13.449 -22.609 -1.652 652 HG3 ARG 83 HG3 ARG 83 -15.049 -22.903 -0.951 653 HD2 ARG 83 HD2 ARG 83 -15.566 -24.407 -2.890 654 HD3 ARG 83 HD3 ARG 83 -13.923 -24.135 -3.502 655 HE ARG 83 HE ARG 83 -13.729 -25.055 -0.828 656 HH11 ARG 83 HH11 ARG 83 -14.808 -26.211 -3.995 657 HH12 ARG 83 HH12 ARG 83 -14.467 -27.885 -3.635 658 HH21 ARG 83 HH21 ARG 83 -13.340 -27.290 -0.368 659 HH22 ARG 83 HH22 ARG 83 -13.625 -28.481 -1.609 660 H LEU 84 H LEU 84 -17.695 -19.629 -2.576 661 HA LEU 84 HA LEU 84 -18.357 -19.951 0.213 662 HB2 LEU 84 HB2 LEU 84 -17.863 -17.797 -0.900 663 HB3 LEU 84 HB3 LEU 84 -19.285 -17.991 -1.934 664 HG LEU 84 HG LEU 84 -20.729 -17.895 0.098 665 HD11 LEU 84 HD11 LEU 84 -18.138 -17.263 1.547 666 HD12 LEU 84 HD12 LEU 84 -19.788 -17.196 2.212 667 HD13 LEU 84 HD13 LEU 84 -19.103 -18.754 1.732 668 HD21 LEU 84 HD21 LEU 84 -20.192 -15.839 -1.186 669 HD22 LEU 84 HD22 LEU 84 -20.403 -15.499 0.545 670 HD23 LEU 84 HD23 LEU 84 -18.762 -15.575 -0.156 671 H GLU 85 H GLU 85 -19.832 -20.675 -2.862 672 HA GLU 85 HA GLU 85 -22.541 -21.111 -1.933 673 HB2 GLU 85 HB2 GLU 85 -20.953 -21.456 -4.464 674 HB3 GLU 85 HB3 GLU 85 -22.397 -22.414 -4.315 675 HG2 GLU 85 HG2 GLU 85 -23.726 -20.371 -3.791 676 HG3 GLU 85 HG3 GLU 85 -22.279 -19.386 -4.033 677 H LEU 86 H LEU 86 -19.699 -22.808 -1.322 678 HA LEU 86 HA LEU 86 -21.189 -25.381 -1.047 679 HB2 LEU 86 HB2 LEU 86 -18.373 -24.960 -2.120 680 HB3 LEU 86 HB3 LEU 86 -19.065 -26.533 -1.721 681 HG LEU 86 HG LEU 86 -20.180 -24.644 -3.843 682 HD11 LEU 86 HD11 LEU 86 -18.535 -27.191 -4.092 683 HD12 LEU 86 HD12 LEU 86 -19.231 -26.260 -5.438 684 HD13 LEU 86 HD13 LEU 86 -17.958 -25.536 -4.425 685 HD21 LEU 86 HD21 LEU 86 -21.463 -26.654 -4.540 686 HD22 LEU 86 HD22 LEU 86 -20.816 -27.545 -3.140 687 HD23 LEU 86 HD23 LEU 86 -21.903 -26.151 -2.899 688 H ALA 87 H ALA 87 -19.016 -23.005 0.327 689 HA ALA 87 HA ALA 87 -17.799 -24.667 2.303 690 HB1 ALA 87 HB1 ALA 87 -18.498 -21.699 2.375 691 HB2 ALA 87 HB2 ALA 87 -17.328 -22.536 3.424 692 HB3 ALA 87 HB3 ALA 87 -17.012 -22.391 1.686 693 H GLN 88 H GLN 88 -20.946 -23.021 2.081 694 HA GLN 88 HA GLN 88 -21.683 -23.407 4.837 695 HB2 GLN 88 HB2 GLN 88 -23.240 -22.793 2.292 696 HB3 GLN 88 HB3 GLN 88 -23.953 -22.774 3.915 697 HG2 GLN 88 HG2 GLN 88 -21.587 -21.049 3.066 698 HG3 GLN 88 HG3 GLN 88 -23.263 -20.507 3.067 699 HE21 GLN 88 HE22 GLN 88 -21.629 -18.994 4.509 700 HE22 GLN 88 HE21 GLN 88 -21.832 -19.268 6.225 701 H GLY 89 H GLY 89 -20.972 -25.724 2.704 702 HA2 GLY 89 HA2 GLY 89 -22.946 -27.619 3.838 703 HA3 GLY 89 HA3 GLY 89 -22.682 -27.565 2.082 704 H ALA 90 H ALA 90 -19.905 -26.813 4.016 705 HA ALA 90 HA ALA 90 -18.974 -29.620 4.098 706 HB1 ALA 90 HB1 ALA 90 -17.478 -27.373 2.684 707 HB2 ALA 90 HB2 ALA 90 -16.883 -29.034 2.935 708 HB3 ALA 90 HB3 ALA 90 -18.283 -28.735 1.887 709 H VAL 91 H VAL 91 -19.128 -26.450 5.425 710 HA VAL 91 HA VAL 91 -16.770 -26.490 7.039 711 HB VAL 91 HB VAL 91 -18.157 -24.530 6.410 712 HG11 VAL 91 HG11 VAL 91 -20.399 -25.503 6.779 713 HG12 VAL 91 HG12 VAL 91 -20.085 -25.545 8.535 714 HG13 VAL 91 HG13 VAL 91 -20.181 -23.994 7.675 715 HG21 VAL 91 HG21 VAL 91 -16.545 -24.432 8.307 716 HG22 VAL 91 HG22 VAL 91 -17.921 -23.338 8.512 717 HG23 VAL 91 HG23 VAL 91 -17.866 -24.866 9.419 718 H GLY 92 H GLY 92 -19.686 -28.259 7.175 719 HA2 GLY 92 HA2 GLY 92 -18.983 -29.386 9.805 720 HA3 GLY 92 HA3 GLY 92 -20.553 -28.572 9.694 721 H SER 93 H SER 93 -19.091 -30.396 7.009 722 HA SER 93 HA SER 93 -20.938 -32.668 7.478 723 HB2 SER 93 HB2 SER 93 -20.757 -31.095 4.884 724 HB3 SER 93 HB3 SER 93 -21.678 -32.590 5.139 725 HG SER 93 HG SER 93 -22.077 -30.118 6.496 726 H VAL 94 H VAL 94 -20.545 -34.309 5.537 727 HA VAL 94 HA VAL 94 -17.671 -34.550 4.964 728 HB VAL 94 HB VAL 94 -19.257 -36.672 6.430 729 HG11 VAL 94 HG11 VAL 94 -16.320 -36.504 5.619 730 HG12 VAL 94 HG12 VAL 94 -17.065 -37.818 6.562 731 HG13 VAL 94 HG13 VAL 94 -17.548 -37.558 4.870 732 HG21 VAL 94 HG21 VAL 94 -18.715 -34.833 7.951 733 HG22 VAL 94 HG22 VAL 94 -17.683 -36.233 8.300 734 HG23 VAL 94 HG23 VAL 94 -17.022 -34.846 7.402 735 H GLN 95 H GLN 95 -17.694 -34.755 2.886 736 HA GLN 95 HA GLN 95 -19.377 -36.808 1.595 737 HB2 GLN 95 HB2 GLN 95 -19.931 -35.284 -0.240 738 HB3 GLN 95 HB3 GLN 95 -20.508 -34.658 1.327 739 HG2 GLN 95 HG2 GLN 95 -17.890 -33.710 0.191 740 HG3 GLN 95 HG3 GLN 95 -19.431 -32.974 -0.278 741 HE21 GLN 95 HE22 GLN 95 -16.931 -32.680 1.921 742 HE22 GLN 95 HE21 GLN 95 -17.821 -31.923 3.222 743 H ILE 96 H ILE 96 -16.479 -36.329 2.465 744 HA ILE 96 HA ILE 96 -15.209 -37.294 -0.021 745 HB ILE 96 HB ILE 96 -13.230 -35.831 0.477 746 HG12 ILE 96 HG12 ILE 96 -15.155 -34.373 2.335 747 HG13 ILE 96 HG13 ILE 96 -13.774 -35.359 2.851 748 HG21 ILE 96 HG21 ILE 96 -14.116 -33.873 -0.633 749 HG22 ILE 96 HG22 ILE 96 -14.941 -35.302 -1.280 750 HG23 ILE 96 HG23 ILE 96 -15.767 -34.261 -0.102 751 HD11 ILE 96 HD11 ILE 96 -13.641 -32.810 1.188 752 HD12 ILE 96 HD12 ILE 96 -13.142 -33.020 2.881 753 HD13 ILE 96 HD13 ILE 96 -12.245 -33.837 1.584 754 HA PRO 97 HA PRO 97 -13.383 -40.114 2.841 755 HB2 PRO 97 HB2 PRO 97 -10.923 -40.627 1.788 756 HB3 PRO 97 HB3 PRO 97 -12.442 -41.175 1.012 757 HG2 PRO 97 HG2 PRO 97 -10.815 -38.702 0.371 758 HG3 PRO 97 HG3 PRO 97 -11.454 -39.926 -0.774 759 HD2 PRO 97 HD2 PRO 97 -12.766 -37.594 -0.326 760 HD3 PRO 97 HD3 PRO 97 -13.670 -39.126 -0.526 761 H VAL 98 H VAL 98 -11.496 -40.476 4.296 762 HA VAL 98 HA VAL 98 -9.991 -38.045 4.966 763 HB VAL 98 HB VAL 98 -12.230 -37.932 6.104 764 HG11 VAL 98 HG11 VAL 98 -11.170 -40.313 7.687 765 HG12 VAL 98 HG12 VAL 98 -12.642 -39.390 8.039 766 HG13 VAL 98 HG13 VAL 98 -12.532 -40.342 6.548 767 HG21 VAL 98 HG21 VAL 98 -10.276 -36.735 6.970 768 HG22 VAL 98 HG22 VAL 98 -11.354 -37.270 8.276 769 HG23 VAL 98 HG23 VAL 98 -9.841 -38.138 7.962 770 H VAL 99 H VAL 99 -10.218 -41.335 4.592 771 HA VAL 99 HA VAL 99 -9.002 -43.141 5.105 772 HB VAL 99 HB VAL 99 -6.646 -42.918 4.494 773 HG11 VAL 99 HG11 VAL 99 -8.523 -41.182 2.831 774 HG12 VAL 99 HG12 VAL 99 -7.041 -41.977 2.257 775 HG13 VAL 99 HG13 VAL 99 -8.428 -42.960 2.781 776 HG21 VAL 99 HG21 VAL 99 -6.150 -40.751 5.648 777 HG22 VAL 99 HG22 VAL 99 -5.675 -40.744 3.939 778 HG23 VAL 99 HG23 VAL 99 -7.148 -39.904 4.441 779 H GLU 100 H GLU 100 -9.719 -41.735 7.627 780 HA GLU 100 HA GLU 100 -7.701 -43.152 9.266 781 HB2 GLU 100 HB2 GLU 100 -7.503 -41.372 10.811 782 HB3 GLU 100 HB3 GLU 100 -7.272 -40.672 9.195 783 HG2 GLU 100 HG2 GLU 100 -9.613 -39.883 9.198 784 HG3 GLU 100 HG3 GLU 100 -9.857 -40.589 10.803 785 H VAL 101 H VAL 101 -8.548 -43.328 11.606 786 HA VAL 101 HA VAL 101 -11.464 -43.703 11.718 787 HB VAL 101 HB VAL 101 -10.230 -45.720 10.795 788 HG11 VAL 101 HG11 VAL 101 -9.258 -45.996 13.661 789 HG12 VAL 101 HG12 VAL 101 -9.053 -47.185 12.356 790 HG13 VAL 101 HG13 VAL 101 -8.243 -45.606 12.251 791 HG21 VAL 101 HG21 VAL 101 -11.725 -46.225 13.397 792 HG22 VAL 101 HG22 VAL 101 -12.500 -45.846 11.845 793 HG23 VAL 101 HG23 VAL 101 -11.551 -47.330 12.030 794 H ASP 102 H ASP 102 -12.046 -44.497 14.043 795 HA ASP 102 HA ASP 102 -10.176 -43.494 16.103 796 HB2 ASP 102 HB2 ASP 102 -11.620 -41.610 15.350 797 HB3 ASP 102 HB3 ASP 102 -13.038 -42.560 15.800 798 H GLU 103 H GLU 103 -11.088 -43.989 18.342 799 HA GLU 103 HA GLU 103 -11.744 -46.788 18.466 800 HB2 GLU 103 HB2 GLU 103 -11.808 -44.731 20.683 801 HB3 GLU 103 HB3 GLU 103 -11.667 -46.482 20.852 802 HG2 GLU 103 HG2 GLU 103 -9.609 -44.651 19.564 803 HG3 GLU 103 HG3 GLU 103 -9.484 -45.444 21.137 804 H LEU 104 H LEU 104 -13.455 -47.237 20.417 805 HA LEU 104 HA LEU 104 -15.961 -47.157 19.177 806 HB2 LEU 104 HB2 LEU 104 -16.741 -48.221 21.160 807 HB3 LEU 104 HB3 LEU 104 -15.171 -48.850 20.785 808 HG LEU 104 HG LEU 104 -15.828 -46.768 22.925 809 HD11 LEU 104 HD11 LEU 104 -15.060 -49.699 23.163 810 HD12 LEU 104 HD12 LEU 104 -15.376 -48.584 24.506 811 HD13 LEU 104 HD13 LEU 104 -16.689 -49.035 23.403 812 HD21 LEU 104 HD21 LEU 104 -13.516 -46.432 22.247 813 HD22 LEU 104 HD22 LEU 104 -13.523 -47.290 23.786 814 HD23 LEU 104 HD23 LEU 104 -13.205 -48.189 22.287 815 HA PRO 105 HA PRO 105 -17.755 -43.365 20.547 816 HB2 PRO 105 HB2 PRO 105 -20.390 -43.879 20.223 817 HB3 PRO 105 HB3 PRO 105 -19.255 -43.965 18.837 818 HG2 PRO 105 HG2 PRO 105 -20.315 -46.240 20.531 819 HG3 PRO 105 HG3 PRO 105 -20.221 -46.145 18.739 820 HD2 PRO 105 HD2 PRO 105 -18.335 -47.368 20.353 821 HD3 PRO 105 HD3 PRO 105 -17.932 -46.692 18.760 822 H GLU 106 H GLU 106 -17.214 -45.640 22.634 823 HA GLU 106 HA GLU 106 -17.682 -46.195 24.757 824 HB2 GLU 106 HB2 GLU 106 -17.052 -43.723 24.861 825 HB3 GLU 106 HB3 GLU 106 -18.778 -43.392 25.113 826 HG2 GLU 106 HG2 GLU 106 -18.734 -44.848 27.133 827 HG3 GLU 106 HG3 GLU 106 -17.037 -45.235 26.820 828 H GLY 107 H GLY 107 -19.738 -46.754 22.769 829 HA2 GLY 107 HA2 GLY 107 -21.897 -47.457 24.582 830 HA3 GLY 107 HA3 GLY 107 -22.346 -46.225 23.388 831 H TYR 108 H TYR 108 -19.929 -48.570 22.401 832 HA TYR 108 HA TYR 108 -21.566 -49.491 20.256 833 HB2 TYR 108 HB2 TYR 108 -19.726 -50.888 19.684 834 HB3 TYR 108 HB3 TYR 108 -19.132 -49.313 20.147 835 HD1 TYR 108 HD2 TYR 108 -19.780 -50.753 23.276 836 HD2 TYR 108 HD1 TYR 108 -17.137 -51.132 19.893 837 HE1 TYR 108 HE2 TYR 108 -18.135 -51.890 24.691 838 HE2 TYR 108 HE1 TYR 108 -15.444 -52.213 21.344 839 HH TYR 108 HH TYR 108 -14.927 -52.943 23.450 840 H ASP 109 H ASP 109 -21.504 -52.050 19.856 841 HA ASP 109 HA ASP 109 -23.572 -53.016 21.582 842 HB2 ASP 109 HB2 ASP 109 -22.066 -54.358 19.329 843 HB3 ASP 109 HB3 ASP 109 -23.560 -54.965 20.046 844 H ARG 110 H ARG 110 -20.751 -52.743 22.701 845 HA ARG 110 HA ARG 110 -20.668 -55.384 24.045 846 HB2 ARG 110 HB2 ARG 110 -18.322 -54.017 22.708 847 HB3 ARG 110 HB3 ARG 110 -18.173 -55.343 23.869 848 HG2 ARG 110 HG2 ARG 110 -19.555 -56.780 22.395 849 HG3 ARG 110 HG3 ARG 110 -19.661 -55.452 21.214 850 HD2 ARG 110 HD2 ARG 110 -17.194 -55.439 21.009 851 HD3 ARG 110 HD3 ARG 110 -17.086 -56.768 22.181 852 HE ARG 110 HE ARG 110 -17.919 -56.928 19.367 853 HH11 ARG 110 HH11 ARG 110 -17.853 -58.568 22.505 854 HH12 ARG 110 HH12 ARG 110 -18.068 -60.153 21.805 855 HH21 ARG 110 HH21 ARG 110 -18.185 -59.009 18.492 856 HH22 ARG 110 HH22 ARG 110 -18.254 -60.399 19.545 857 H SER 111 H SER 111 -21.391 -52.388 24.564 858 HA SER 111 HA SER 111 -19.655 -51.300 26.488 859 HB2 SER 111 HB2 SER 111 -22.694 -51.170 26.363 860 HB3 SER 111 HB3 SER 111 -21.639 -50.077 27.283 861 HG SER 111 HG SER 111 -21.783 -50.415 24.468 Start of MODEL 9 1 H1 SER 2 H1 SER 2 8.133 -3.209 -2.897 2 H2 SER 2 H2 SER 2 7.654 -2.067 -3.977 3 H3 SER 2 H3 SER 2 8.748 -3.203 -4.418 4 HA SER 2 HA SER 2 5.954 -3.720 -3.685 5 HB2 SER 2 HB2 SER 2 7.325 -3.805 -6.403 6 HB3 SER 2 HB3 SER 2 5.643 -4.262 -6.083 7 HG SER 2 HG SER 2 5.227 -2.138 -5.453 8 H GLN 3 H GLN 3 5.569 -5.750 -3.033 9 HA GLN 3 HA GLN 3 7.259 -7.948 -4.034 10 HB2 GLN 3 HB2 GLN 3 8.266 -6.948 -1.924 11 HB3 GLN 3 HB3 GLN 3 6.822 -7.513 -1.058 12 HG2 GLN 3 HG2 GLN 3 7.363 -9.852 -1.704 13 HG3 GLN 3 HG3 GLN 3 8.738 -9.276 -2.653 14 HE21 GLN 3 HE22 GLN 3 9.920 -10.855 -1.232 15 HE22 GLN 3 HE21 GLN 3 10.478 -10.269 0.323 16 H PHE 4 H PHE 4 4.248 -6.722 -3.598 17 HA PHE 4 HA PHE 4 2.711 -8.650 -2.281 18 HB2 PHE 4 HB2 PHE 4 1.936 -6.455 -3.012 19 HB3 PHE 4 HB3 PHE 4 2.105 -6.903 -4.692 20 HD1 PHE 4 HD2 PHE 4 0.684 -9.102 -5.410 21 HD2 PHE 4 HD1 PHE 4 -0.180 -6.528 -2.072 22 HE1 PHE 4 HE2 PHE 4 -1.642 -9.918 -5.395 23 HE2 PHE 4 HE1 PHE 4 -2.535 -7.304 -2.099 24 HZ PHE 4 HZ PHE 4 -3.269 -8.999 -3.754 25 H GLU 5 H GLU 5 3.601 -8.499 -5.774 26 HA GLU 5 HA GLU 5 2.216 -11.022 -6.271 27 HB2 GLU 5 HB2 GLU 5 3.913 -9.222 -8.044 28 HB3 GLU 5 HB3 GLU 5 3.073 -10.685 -8.597 29 HG2 GLU 5 HG2 GLU 5 0.913 -9.738 -7.823 30 HG3 GLU 5 HG3 GLU 5 1.751 -8.251 -7.334 31 H LYS 6 H LYS 6 5.194 -10.377 -4.867 32 HA LYS 6 HA LYS 6 6.561 -12.655 -6.194 33 HB2 LYS 6 HB2 LYS 6 7.390 -10.417 -4.314 34 HB3 LYS 6 HB3 LYS 6 8.377 -11.868 -4.491 35 HG2 LYS 6 HG2 LYS 6 9.187 -10.108 -5.951 36 HG3 LYS 6 HG3 LYS 6 8.616 -11.495 -6.891 37 HD2 LYS 6 HD2 LYS 6 6.552 -10.321 -7.460 38 HD3 LYS 6 HD3 LYS 6 7.007 -8.956 -6.396 39 HE2 LYS 6 HE2 LYS 6 8.998 -8.538 -7.797 40 HE3 LYS 6 HE3 LYS 6 8.564 -9.912 -8.842 41 HZ1 LYS 6 HZ1 LYS 6 6.538 -8.760 -9.403 42 HZ2 LYS 6 HZ2 LYS 6 6.939 -7.485 -8.441 43 HZ3 LYS 6 HZ3 LYS 6 7.841 -7.831 -9.769 44 H GLN 7 H GLN 7 5.805 -11.527 -2.815 45 HA GLN 7 HA GLN 7 6.553 -13.990 -1.628 46 HB2 GLN 7 HB2 GLN 7 5.768 -11.467 -0.781 47 HB3 GLN 7 HB3 GLN 7 4.397 -12.460 -0.291 48 HG2 GLN 7 HG2 GLN 7 7.325 -12.921 0.389 49 HG3 GLN 7 HG3 GLN 7 6.071 -12.344 1.498 50 HE21 GLN 7 HE22 GLN 7 4.078 -13.905 1.679 51 HE22 GLN 7 HE21 GLN 7 4.458 -15.609 1.742 52 H LYS 8 H LYS 8 3.506 -12.878 -3.043 53 HA LYS 8 HA LYS 8 1.797 -14.914 -1.955 54 HB2 LYS 8 HB2 LYS 8 1.117 -12.691 -2.854 55 HB3 LYS 8 HB3 LYS 8 1.640 -13.184 -4.431 56 HG2 LYS 8 HG2 LYS 8 -0.127 -15.158 -4.102 57 HG3 LYS 8 HG3 LYS 8 -0.763 -14.098 -2.846 58 HD2 LYS 8 HD2 LYS 8 -1.943 -13.501 -4.852 59 HD3 LYS 8 HD3 LYS 8 -0.751 -12.223 -4.603 60 HE2 LYS 8 HE2 LYS 8 -0.629 -12.838 -6.928 61 HE3 LYS 8 HE3 LYS 8 0.821 -13.465 -6.153 62 HZ1 LYS 8 HZ1 LYS 8 -1.596 -15.019 -6.825 63 HZ2 LYS 8 HZ2 LYS 8 -0.119 -15.128 -7.559 64 HZ3 LYS 8 HZ3 LYS 8 -0.301 -15.614 -5.998 65 H GLU 9 H GLU 9 3.280 -14.521 -5.262 66 HA GLU 9 HA GLU 9 2.306 -17.008 -6.208 67 HB2 GLU 9 HB2 GLU 9 3.024 -14.853 -7.425 68 HB3 GLU 9 HB3 GLU 9 4.692 -15.403 -7.198 69 HG2 GLU 9 HG2 GLU 9 3.890 -16.041 -9.384 70 HG3 GLU 9 HG3 GLU 9 4.135 -17.491 -8.393 71 H GLN 10 H GLN 10 5.242 -16.104 -4.417 72 HA GLN 10 HA GLN 10 6.735 -18.484 -5.063 73 HB2 GLN 10 HB2 GLN 10 6.930 -16.361 -2.908 74 HB3 GLN 10 HB3 GLN 10 8.022 -17.762 -2.948 75 HG2 GLN 10 HG2 GLN 10 8.794 -17.204 -5.172 76 HG3 GLN 10 HG3 GLN 10 7.623 -15.892 -5.319 77 HE21 GLN 10 HE22 GLN 10 10.220 -15.268 -5.788 78 HE22 GLN 10 HE21 GLN 10 10.895 -14.340 -4.461 79 H GLY 11 H GLY 11 3.829 -18.317 -3.479 80 HA2 GLY 11 HA2 GLY 11 4.498 -20.756 -1.889 81 HA3 GLY 11 HA3 GLY 11 3.329 -19.557 -1.332 82 H ASN 12 H ASN 12 2.966 -19.658 -4.690 83 HA ASN 12 HA ASN 12 0.498 -21.096 -4.539 84 HB2 ASN 12 HB2 ASN 12 0.257 -20.520 -6.722 85 HB3 ASN 12 HB3 ASN 12 1.564 -19.400 -6.351 86 HD21 ASN 12 HD22 ASN 12 3.708 -19.960 -7.100 87 HD22 ASN 12 HD21 ASN 12 3.903 -21.099 -8.413 88 H SER 13 H SER 13 3.834 -22.056 -5.069 89 HA SER 13 HA SER 13 3.132 -24.731 -6.002 90 HB2 SER 13 HB2 SER 13 5.590 -25.108 -5.832 91 HB3 SER 13 HB3 SER 13 5.194 -23.660 -6.781 92 HG SER 13 HG SER 13 6.853 -23.285 -5.238 93 H LEU 14 H LEU 14 4.057 -23.154 -2.922 94 HA LEU 14 HA LEU 14 4.446 -25.505 -1.382 95 HB2 LEU 14 HB2 LEU 14 3.395 -22.734 -0.669 96 HB3 LEU 14 HB3 LEU 14 3.936 -23.927 0.488 97 HG LEU 14 HG LEU 14 5.660 -22.621 -1.638 98 HD11 LEU 14 HD11 LEU 14 5.022 -21.162 0.263 99 HD12 LEU 14 HD12 LEU 14 5.608 -22.390 1.400 100 HD13 LEU 14 HD13 LEU 14 6.753 -21.567 0.313 101 HD21 LEU 14 HD21 LEU 14 6.361 -24.638 0.533 102 HD22 LEU 14 HD22 LEU 14 6.453 -24.902 -1.224 103 HD23 LEU 14 HD23 LEU 14 7.539 -23.741 -0.447 104 H PHE 15 H PHE 15 1.562 -23.653 -2.326 105 HA PHE 15 HA PHE 15 -0.342 -25.063 -0.723 106 HB2 PHE 15 HB2 PHE 15 -0.868 -22.930 -1.704 107 HB3 PHE 15 HB3 PHE 15 -0.437 -23.493 -3.314 108 HD1 PHE 15 HD1 PHE 15 -2.786 -24.529 -0.564 109 HD2 PHE 15 HD2 PHE 15 -2.116 -23.942 -4.755 110 HE1 PHE 15 HE1 PHE 15 -5.163 -25.125 -1.015 111 HE2 PHE 15 HE2 PHE 15 -4.512 -24.491 -5.225 112 HZ PHE 15 HZ PHE 15 -6.023 -25.069 -3.354 113 H LYS 16 H LYS 16 1.490 -26.030 -3.467 114 HA LYS 16 HA LYS 16 -0.472 -28.185 -4.109 115 HB2 LYS 16 HB2 LYS 16 1.803 -27.031 -5.751 116 HB3 LYS 16 HB3 LYS 16 0.691 -28.317 -6.281 117 HG2 LYS 16 HG2 LYS 16 -1.227 -26.820 -6.093 118 HG3 LYS 16 HG3 LYS 16 -0.230 -25.554 -5.361 119 HD2 LYS 16 HD2 LYS 16 1.145 -25.491 -7.480 120 HD3 LYS 16 HD3 LYS 16 -0.078 -26.558 -8.221 121 HE2 LYS 16 HE2 LYS 16 -1.836 -24.881 -7.598 122 HE3 LYS 16 HE3 LYS 16 -0.559 -23.821 -6.954 123 HZ1 LYS 16 HZ1 LYS 16 -0.736 -24.714 -9.754 124 HZ2 LYS 16 HZ2 LYS 16 -1.184 -23.231 -9.195 125 HZ3 LYS 16 HZ3 LYS 16 0.391 -23.683 -9.123 126 H GLN 17 H GLN 17 2.346 -27.643 -2.335 127 HA GLN 17 HA GLN 17 3.562 -30.262 -2.797 128 HB2 GLN 17 HB2 GLN 17 4.023 -28.120 -0.709 129 HB3 GLN 17 HB3 GLN 17 4.910 -29.655 -0.799 130 HG2 GLN 17 HG2 GLN 17 5.376 -28.993 -3.284 131 HG3 GLN 17 HG3 GLN 17 4.939 -27.360 -2.744 132 HE21 GLN 17 HE22 GLN 17 5.941 -27.173 -0.218 133 HE22 GLN 17 HE21 GLN 17 7.672 -27.398 -0.231 134 H GLY 18 H GLY 18 0.846 -29.101 -0.974 135 HA2 GLY 18 HA2 GLY 18 -0.674 -30.514 0.102 136 HA3 GLY 18 HA3 GLY 18 0.557 -31.771 0.243 137 H LEU 19 H LEU 19 1.266 -28.457 1.197 138 HA LEU 19 HA LEU 19 0.940 -29.135 4.054 139 HB2 LEU 19 HB2 LEU 19 3.153 -27.972 4.461 140 HB3 LEU 19 HB3 LEU 19 3.177 -29.596 3.775 141 HG LEU 19 HG LEU 19 3.591 -28.692 1.523 142 HD11 LEU 19 HD11 LEU 19 3.807 -26.020 2.965 143 HD12 LEU 19 HD12 LEU 19 4.281 -26.329 1.276 144 HD13 LEU 19 HD13 LEU 19 2.579 -26.462 1.765 145 HD21 LEU 19 HD21 LEU 19 5.433 -29.367 3.023 146 HD22 LEU 19 HD22 LEU 19 5.917 -28.020 1.979 147 HD23 LEU 19 HD23 LEU 19 5.503 -27.718 3.681 148 H TYR 20 H TYR 20 -0.965 -27.919 2.818 149 HA TYR 20 HA TYR 20 -0.996 -25.346 1.993 150 HB2 TYR 20 HB2 TYR 20 -3.110 -26.501 3.801 151 HB3 TYR 20 HB3 TYR 20 -3.350 -25.388 2.469 152 HD1 TYR 20 HD1 TYR 20 -2.064 -26.551 0.181 153 HD2 TYR 20 HD2 TYR 20 -4.067 -28.534 3.424 154 HE1 TYR 20 HE1 TYR 20 -2.576 -28.452 -1.294 155 HE2 TYR 20 HE2 TYR 20 -4.591 -30.447 1.950 156 HH TYR 20 HH TYR 20 -3.527 -30.537 -1.491 157 H ARG 21 H ARG 21 -0.659 -26.300 5.398 158 HA ARG 21 HA ARG 21 -1.702 -23.996 6.641 159 HB2 ARG 21 HB2 ARG 21 -1.070 -26.120 7.708 160 HB3 ARG 21 HB3 ARG 21 0.644 -25.759 7.467 161 HG2 ARG 21 HG2 ARG 21 -1.183 -23.890 9.035 162 HG3 ARG 21 HG3 ARG 21 -0.394 -25.290 9.778 163 HD2 ARG 21 HD2 ARG 21 1.811 -24.437 8.993 164 HD3 ARG 21 HD3 ARG 21 1.006 -22.968 8.426 165 HE ARG 21 HE ARG 21 0.244 -23.221 11.081 166 HH11 ARG 21 HH11 ARG 21 3.304 -22.947 9.297 167 HH12 ARG 21 HH12 ARG 21 4.109 -22.115 10.604 168 HH21 ARG 21 HH21 ARG 21 1.338 -22.151 12.763 169 HH22 ARG 21 HH22 ARG 21 3.011 -21.689 12.569 170 H GLU 22 H GLU 22 1.504 -24.582 5.185 171 HA GLU 22 HA GLU 22 2.654 -22.059 5.999 172 HB2 GLU 22 HB2 GLU 22 3.285 -23.786 3.577 173 HB3 GLU 22 HB3 GLU 22 4.384 -22.653 4.371 174 HG2 GLU 22 HG2 GLU 22 3.229 -25.140 5.712 175 HG3 GLU 22 HG3 GLU 22 4.755 -25.065 4.858 176 H ALA 23 H ALA 23 0.883 -23.286 3.212 177 HA ALA 23 HA ALA 23 1.259 -21.056 1.467 178 HB1 ALA 23 HB1 ALA 23 -0.453 -22.098 0.143 179 HB2 ALA 23 HB2 ALA 23 0.668 -23.338 0.778 180 HB3 ALA 23 HB3 ALA 23 -0.947 -23.129 1.502 181 H VAL 24 H VAL 24 -0.852 -21.426 4.256 182 HA VAL 24 HA VAL 24 -2.860 -19.463 3.383 183 HB VAL 24 HB VAL 24 -1.937 -20.375 6.159 184 HG11 VAL 24 HG11 VAL 24 -4.476 -18.919 5.267 185 HG12 VAL 24 HG12 VAL 24 -4.171 -19.534 6.906 186 HG13 VAL 24 HG13 VAL 24 -3.158 -18.236 6.247 187 HG21 VAL 24 HG21 VAL 24 -2.892 -22.260 4.834 188 HG22 VAL 24 HG22 VAL 24 -4.015 -21.792 6.121 189 HG23 VAL 24 HG23 VAL 24 -4.321 -21.285 4.440 190 H HIS 25 H HIS 25 -0.042 -19.757 5.302 191 HA HIS 25 HA HIS 25 0.345 -17.131 6.309 192 HB2 HIS 25 HB2 HIS 25 1.364 -19.860 6.394 193 HB3 HIS 25 HB3 HIS 25 2.668 -18.768 6.253 194 HD2 HIS 25 HD2 HIS 25 3.167 -17.238 8.502 195 HE1 HIS 25 HE1 HIS 25 0.077 -18.893 10.920 196 HE2 HIS 25 HE2 HIS 25 2.145 -17.387 10.914 197 H CYS 26 H CYS 26 0.394 -17.975 3.179 198 HA CYS 26 HA CYS 26 2.677 -16.185 2.493 199 HB2 CYS 26 HB2 CYS 26 1.819 -18.828 1.265 200 HB3 CYS 26 HB3 CYS 26 2.739 -17.612 0.365 201 HG CYS 26 HG CYS 26 4.341 -19.512 1.284 202 H TYR 27 H TYR 27 -0.623 -16.542 2.442 203 HA TYR 27 HA TYR 27 -0.835 -14.674 0.117 204 HB2 TYR 27 HB2 TYR 27 -2.995 -16.463 1.220 205 HB3 TYR 27 HB3 TYR 27 -3.102 -15.453 -0.223 206 HD1 TYR 27 HD2 TYR 27 -0.476 -16.202 -1.563 207 HD2 TYR 27 HD1 TYR 27 -3.469 -18.543 0.446 208 HE1 TYR 27 HE2 TYR 27 0.117 -18.170 -2.965 209 HE2 TYR 27 HE1 TYR 27 -2.866 -20.525 -0.935 210 HH TYR 27 HH TYR 27 -1.567 -21.319 -2.624 211 H ASP 28 H ASP 28 -0.870 -14.826 3.457 212 HA ASP 28 HA ASP 28 -3.222 -13.180 3.958 213 HB2 ASP 28 HB2 ASP 28 -2.219 -14.908 5.508 214 HB3 ASP 28 HB3 ASP 28 -0.826 -13.853 5.725 215 H GLN 29 H GLN 29 0.206 -12.639 3.260 216 HA GLN 29 HA GLN 29 0.276 -10.069 4.547 217 HB2 GLN 29 HB2 GLN 29 2.464 -9.879 3.811 218 HB3 GLN 29 HB3 GLN 29 2.244 -11.586 4.186 219 HG2 GLN 29 HG2 GLN 29 2.043 -10.345 1.452 220 HG3 GLN 29 HG3 GLN 29 3.507 -11.121 2.054 221 HE21 GLN 29 HE22 GLN 29 2.100 -11.817 -0.343 222 HE22 GLN 29 HE21 GLN 29 1.498 -13.445 -0.188 223 H LEU 30 H LEU 30 -1.137 -11.105 1.601 224 HA LEU 30 HA LEU 30 -0.900 -8.528 0.222 225 HB2 LEU 30 HB2 LEU 30 -2.798 -10.892 -0.148 226 HB3 LEU 30 HB3 LEU 30 -2.621 -9.530 -1.254 227 HG LEU 30 HG LEU 30 -1.305 -11.021 -2.345 228 HD11 LEU 30 HD11 LEU 30 0.722 -10.208 -0.215 229 HD12 LEU 30 HD12 LEU 30 1.085 -10.839 -1.821 230 HD13 LEU 30 HD13 LEU 30 0.307 -9.257 -1.644 231 HD21 LEU 30 HD21 LEU 30 -0.690 -12.290 0.333 232 HD22 LEU 30 HD22 LEU 30 -1.877 -12.838 -0.870 233 HD23 LEU 30 HD23 LEU 30 -0.153 -12.901 -1.235 234 H ILE 31 H ILE 31 -3.228 -10.218 2.321 235 HA ILE 31 HA ILE 31 -5.247 -8.166 2.117 236 HB ILE 31 HB ILE 31 -4.718 -10.366 4.151 237 HG12 ILE 31 HG12 ILE 31 -6.826 -10.508 1.990 238 HG13 ILE 31 HG13 ILE 31 -5.166 -10.922 1.606 239 HG21 ILE 31 HG21 ILE 31 -7.243 -8.744 3.641 240 HG22 ILE 31 HG22 ILE 31 -7.170 -10.196 4.667 241 HG23 ILE 31 HG23 ILE 31 -6.262 -8.744 5.129 242 HD11 ILE 31 HD11 ILE 31 -6.781 -12.198 3.811 243 HD12 ILE 31 HD12 ILE 31 -6.392 -12.922 2.225 244 HD13 ILE 31 HD13 ILE 31 -5.096 -12.559 3.391 245 H THR 32 H THR 32 -2.260 -8.513 3.719 246 HA THR 32 HA THR 32 -2.881 -6.537 5.849 247 HB THR 32 HB THR 32 -0.407 -8.212 5.300 248 HG1 THR 32 HG1 THR 32 -2.167 -9.483 5.866 249 HG21 THR 32 HG21 THR 32 -1.239 -6.515 7.690 250 HG22 THR 32 HG22 THR 32 0.074 -7.708 7.728 251 HG23 THR 32 HG23 THR 32 0.201 -6.296 6.672 252 H ALA 33 H ALA 33 -1.539 -6.651 2.655 253 HA ALA 33 HA ALA 33 0.011 -4.170 3.258 254 HB1 ALA 33 HB1 ALA 33 0.519 -6.231 1.066 255 HB2 ALA 33 HB2 ALA 33 1.486 -4.777 1.391 256 HB3 ALA 33 HB3 ALA 33 1.430 -6.078 2.594 257 H GLN 34 H GLN 34 -2.082 -5.784 0.806 258 HA GLN 34 HA GLN 34 -2.972 -3.140 -0.121 259 HB2 GLN 34 HB2 GLN 34 -1.890 -5.182 -2.069 260 HB3 GLN 34 HB3 GLN 34 -2.501 -3.601 -2.470 261 HG2 GLN 34 HG2 GLN 34 0.017 -4.145 -0.857 262 HG3 GLN 34 HG3 GLN 34 -0.031 -3.783 -2.576 263 HE21 GLN 34 HE22 GLN 34 1.505 -2.165 -1.016 264 HE22 GLN 34 HE21 GLN 34 0.755 -0.591 -0.841 265 HA PRO 35 HA PRO 35 -6.004 -6.650 0.364 266 HB2 PRO 35 HB2 PRO 35 -7.828 -5.352 1.941 267 HB3 PRO 35 HB3 PRO 35 -6.314 -6.103 2.566 268 HG2 PRO 35 HG2 PRO 35 -6.772 -3.192 1.837 269 HG3 PRO 35 HG3 PRO 35 -6.091 -3.862 3.359 270 HD2 PRO 35 HD2 PRO 35 -4.475 -3.000 1.358 271 HD3 PRO 35 HD3 PRO 35 -4.067 -4.479 2.289 272 H GLN 36 H GLN 36 -5.955 -3.757 -1.358 273 HA GLN 36 HA GLN 36 -8.790 -3.493 -1.871 274 HB2 GLN 36 HB2 GLN 36 -6.790 -2.270 -3.740 275 HB3 GLN 36 HB3 GLN 36 -8.281 -1.613 -3.074 276 HG2 GLN 36 HG2 GLN 36 -6.672 -0.350 -1.973 277 HG3 GLN 36 HG3 GLN 36 -6.992 -1.631 -0.788 278 HE21 GLN 36 HE22 GLN 36 -4.653 -0.466 -0.336 279 HE22 GLN 36 HE21 GLN 36 -3.302 -1.392 -0.988 280 H ASN 37 H ASN 37 -7.024 -6.014 -2.651 281 HA ASN 37 HA ASN 37 -8.147 -6.260 -5.395 282 HB2 ASN 37 HB2 ASN 37 -5.360 -7.039 -4.485 283 HB3 ASN 37 HB3 ASN 37 -6.053 -7.411 -6.071 284 HD21 ASN 37 HD22 ASN 37 -4.792 -4.830 -3.973 285 HD22 ASN 37 HD21 ASN 37 -4.642 -3.639 -5.247 286 HA PRO 38 HA PRO 38 -9.868 -9.935 -3.632 287 HB2 PRO 38 HB2 PRO 38 -10.821 -11.115 -5.856 288 HB3 PRO 38 HB3 PRO 38 -11.427 -9.524 -5.309 289 HG2 PRO 38 HG2 PRO 38 -9.257 -10.010 -7.372 290 HG3 PRO 38 HG3 PRO 38 -10.779 -9.066 -7.575 291 HD2 PRO 38 HD2 PRO 38 -8.544 -7.753 -6.853 292 HD3 PRO 38 HD3 PRO 38 -10.064 -7.418 -6.062 293 H VAL 39 H VAL 39 -7.088 -10.068 -5.798 294 HA VAL 39 HA VAL 39 -6.922 -12.913 -6.054 295 HB VAL 39 HB VAL 39 -5.709 -11.240 -7.429 296 HG11 VAL 39 HG11 VAL 39 -3.618 -10.260 -6.630 297 HG12 VAL 39 HG12 VAL 39 -4.972 -9.723 -5.604 298 HG13 VAL 39 HG13 VAL 39 -3.858 -10.980 -5.029 299 HG21 VAL 39 HG21 VAL 39 -3.926 -13.281 -6.035 300 HG22 VAL 39 HG22 VAL 39 -5.031 -13.614 -7.395 301 HG23 VAL 39 HG23 VAL 39 -3.623 -12.545 -7.632 302 H GLY 40 H GLY 40 -5.982 -10.661 -3.511 303 HA2 GLY 40 HA2 GLY 40 -4.419 -12.444 -1.902 304 HA3 GLY 40 HA3 GLY 40 -5.270 -10.981 -1.356 305 H TYR 41 H TYR 41 -7.758 -12.391 -2.664 306 HA TYR 41 HA TYR 41 -8.381 -14.242 -0.428 307 HB2 TYR 41 HB2 TYR 41 -10.548 -12.683 -1.801 308 HB3 TYR 41 HB3 TYR 41 -10.534 -13.397 -0.262 309 HD1 TYR 41 HD2 TYR 41 -8.783 -10.557 -2.004 310 HD2 TYR 41 HD1 TYR 41 -10.347 -12.151 1.655 311 HE1 TYR 41 HE2 TYR 41 -8.300 -8.412 -0.867 312 HE2 TYR 41 HE1 TYR 41 -9.863 -10.016 2.809 313 HH TYR 41 HH TYR 41 -9.067 -7.893 2.602 314 H SER 42 H SER 42 -7.287 -14.654 -3.231 315 HA SER 42 HA SER 42 -9.476 -16.432 -4.209 316 HB2 SER 42 HB2 SER 42 -9.046 -14.445 -5.669 317 HB3 SER 42 HB3 SER 42 -7.383 -15.016 -5.895 318 HG SER 42 HG SER 42 -8.278 -16.970 -6.738 319 H ASN 43 H ASN 43 -6.598 -16.388 -2.630 320 HA ASN 43 HA ASN 43 -5.985 -19.146 -3.560 321 HB2 ASN 43 HB2 ASN 43 -4.031 -16.901 -2.910 322 HB3 ASN 43 HB3 ASN 43 -3.590 -18.601 -3.122 323 HD21 ASN 43 HD22 ASN 43 -3.902 -19.620 -5.220 324 HD22 ASN 43 HD21 ASN 43 -3.921 -18.629 -6.663 325 H LYS 44 H LYS 44 -5.882 -16.698 -0.867 326 HA LYS 44 HA LYS 44 -5.352 -18.737 1.130 327 HB2 LYS 44 HB2 LYS 44 -5.031 -16.199 1.298 328 HB3 LYS 44 HB3 LYS 44 -6.765 -16.071 1.454 329 HG2 LYS 44 HG2 LYS 44 -6.692 -17.587 3.441 330 HG3 LYS 44 HG3 LYS 44 -4.922 -17.668 3.294 331 HD2 LYS 44 HD2 LYS 44 -4.745 -15.247 3.671 332 HD3 LYS 44 HD3 LYS 44 -6.514 -15.108 3.687 333 HE2 LYS 44 HE2 LYS 44 -6.542 -16.743 5.617 334 HE3 LYS 44 HE3 LYS 44 -4.780 -16.593 5.690 335 HZ1 LYS 44 HZ1 LYS 44 -5.067 -14.229 6.079 336 HZ2 LYS 44 HZ2 LYS 44 -6.708 -14.379 5.980 337 HZ3 LYS 44 HZ3 LYS 44 -5.891 -15.093 7.211 338 H ALA 45 H ALA 45 -8.179 -17.175 -0.282 339 HA ALA 45 HA ALA 45 -10.187 -18.533 1.253 340 HB1 ALA 45 HB1 ALA 45 -10.389 -17.367 -1.548 341 HB2 ALA 45 HB2 ALA 45 -11.718 -17.628 -0.404 342 HB3 ALA 45 HB3 ALA 45 -10.482 -16.386 -0.069 343 H MET 46 H MET 46 -7.938 -19.937 -0.689 344 HA MET 46 HA MET 46 -9.730 -22.189 -1.417 345 HB2 MET 46 HB2 MET 46 -9.037 -20.491 -3.332 346 HB3 MET 46 HB3 MET 46 -7.489 -21.337 -3.246 347 HG2 MET 46 HG2 MET 46 -8.899 -22.340 -4.954 348 HG3 MET 46 HG3 MET 46 -8.676 -23.488 -3.634 349 HE1 MET 46 HE1 MET 46 -11.132 -20.333 -3.813 350 HE2 MET 46 HE2 MET 46 -11.049 -21.005 -5.458 351 HE3 MET 46 HE3 MET 46 -12.562 -21.105 -4.527 352 H ALA 47 H ALA 47 -7.269 -21.196 0.469 353 HA ALA 47 HA ALA 47 -6.041 -23.907 0.426 354 HB1 ALA 47 HB1 ALA 47 -4.725 -21.282 1.213 355 HB2 ALA 47 HB2 ALA 47 -3.982 -22.895 1.289 356 HB3 ALA 47 HB3 ALA 47 -4.429 -22.199 -0.283 357 H LEU 48 H LEU 48 -7.689 -21.412 2.279 358 HA LEU 48 HA LEU 48 -7.287 -22.630 4.874 359 HB2 LEU 48 HB2 LEU 48 -9.424 -20.851 3.634 360 HB3 LEU 48 HB3 LEU 48 -9.523 -21.400 5.314 361 HG LEU 48 HG LEU 48 -7.139 -19.867 4.212 362 HD11 LEU 48 HD11 LEU 48 -9.160 -18.478 4.076 363 HD12 LEU 48 HD12 LEU 48 -9.600 -18.928 5.737 364 HD13 LEU 48 HD13 LEU 48 -8.159 -17.928 5.430 365 HD21 LEU 48 HD21 LEU 48 -6.680 -21.210 6.250 366 HD22 LEU 48 HD22 LEU 48 -6.714 -19.479 6.636 367 HD23 LEU 48 HD23 LEU 48 -8.110 -20.500 7.040 368 H ILE 49 H ILE 49 -9.616 -23.043 2.185 369 HA ILE 49 HA ILE 49 -11.340 -24.883 3.463 370 HB ILE 49 HB ILE 49 -11.913 -25.620 1.173 371 HG12 ILE 49 HG12 ILE 49 -9.974 -23.529 0.223 372 HG13 ILE 49 HG13 ILE 49 -9.431 -25.168 0.409 373 HG21 ILE 49 HG21 ILE 49 -12.825 -23.453 0.438 374 HG22 ILE 49 HG22 ILE 49 -12.975 -23.613 2.201 375 HG23 ILE 49 HG23 ILE 49 -11.697 -22.595 1.504 376 HD11 ILE 49 HD11 ILE 49 -10.089 -24.868 -1.875 377 HD12 ILE 49 HD12 ILE 49 -11.079 -26.073 -1.034 378 HD13 ILE 49 HD13 ILE 49 -11.738 -24.433 -1.361 379 H LYS 50 H LYS 50 -8.135 -25.167 2.163 380 HA LYS 50 HA LYS 50 -8.350 -27.937 1.451 381 HB2 LYS 50 HB2 LYS 50 -6.718 -25.810 0.767 382 HB3 LYS 50 HB3 LYS 50 -5.646 -26.777 1.773 383 HG2 LYS 50 HG2 LYS 50 -5.261 -27.644 -0.330 384 HG3 LYS 50 HG3 LYS 50 -6.494 -28.776 0.239 385 HD2 LYS 50 HD2 LYS 50 -6.929 -26.302 -1.494 386 HD3 LYS 50 HD3 LYS 50 -6.837 -27.958 -2.112 387 HE2 LYS 50 HE2 LYS 50 -8.897 -26.994 -0.111 388 HE3 LYS 50 HE3 LYS 50 -9.157 -27.002 -1.860 389 HZ1 LYS 50 HZ1 LYS 50 -8.806 -29.375 -1.859 390 HZ2 LYS 50 HZ2 LYS 50 -8.554 -29.399 -0.237 391 HZ3 LYS 50 HZ3 LYS 50 -10.033 -28.988 -0.832 392 H LEU 51 H LEU 51 -8.112 -26.379 4.390 393 HA LEU 51 HA LEU 51 -6.567 -28.574 5.700 394 HB2 LEU 51 HB2 LEU 51 -6.857 -25.612 6.358 395 HB3 LEU 51 HB3 LEU 51 -6.150 -26.786 7.475 396 HG LEU 51 HG LEU 51 -5.075 -26.337 4.676 397 HD11 LEU 51 HD11 LEU 51 -4.138 -25.136 7.319 398 HD12 LEU 51 HD12 LEU 51 -3.358 -24.937 5.733 399 HD13 LEU 51 HD13 LEU 51 -4.961 -24.252 6.019 400 HD21 LEU 51 HD21 LEU 51 -4.447 -28.485 5.725 401 HD22 LEU 51 HD22 LEU 51 -3.042 -27.398 5.712 402 HD23 LEU 51 HD23 LEU 51 -3.967 -27.645 7.206 403 H GLY 52 H GLY 52 -9.638 -27.111 5.293 404 HA2 GLY 52 HA2 GLY 52 -11.577 -28.066 6.310 405 HA3 GLY 52 HA3 GLY 52 -10.636 -28.420 7.769 406 H GLU 53 H GLU 53 -9.639 -25.368 6.893 407 HA GLU 53 HA GLU 53 -11.258 -24.116 8.958 408 HB2 GLU 53 HB2 GLU 53 -9.055 -23.034 7.159 409 HB3 GLU 53 HB3 GLU 53 -9.834 -22.145 8.461 410 HG2 GLU 53 HG2 GLU 53 -9.161 -23.986 10.049 411 HG3 GLU 53 HG3 GLU 53 -8.203 -24.685 8.729 412 H TYR 54 H TYR 54 -12.970 -24.948 6.899 413 HA TYR 54 HA TYR 54 -13.510 -23.021 4.904 414 HB2 TYR 54 HB2 TYR 54 -15.311 -24.911 6.451 415 HB3 TYR 54 HB3 TYR 54 -15.898 -23.896 5.136 416 HD1 TYR 54 HD1 TYR 54 -13.642 -26.730 5.940 417 HD2 TYR 54 HD2 TYR 54 -15.495 -24.385 2.854 418 HE1 TYR 54 HE1 TYR 54 -12.929 -28.406 4.249 419 HE2 TYR 54 HE2 TYR 54 -14.828 -26.073 1.167 420 HH TYR 54 HH TYR 54 -12.945 -29.007 2.044 421 H THR 55 H THR 55 -14.224 -23.021 8.377 422 HA THR 55 HA THR 55 -16.184 -20.983 8.422 423 HB THR 55 HB THR 55 -13.987 -21.658 10.424 424 HG1 THR 55 HG1 THR 55 -15.610 -22.977 11.324 425 HG21 THR 55 HG21 THR 55 -16.700 -20.277 10.764 426 HG22 THR 55 HG22 THR 55 -15.629 -20.757 12.098 427 HG23 THR 55 HG23 THR 55 -15.109 -19.510 10.964 428 H GLN 56 H GLN 56 -12.615 -20.831 8.155 429 HA GLN 56 HA GLN 56 -12.613 -17.902 8.395 430 HB2 GLN 56 HB2 GLN 56 -10.496 -20.011 7.913 431 HB3 GLN 56 HB3 GLN 56 -10.186 -18.271 7.794 432 HG2 GLN 56 HG2 GLN 56 -9.577 -18.926 9.960 433 HG3 GLN 56 HG3 GLN 56 -11.037 -17.961 10.113 434 HE21 GLN 56 HE22 GLN 56 -9.611 -21.202 10.380 435 HE22 GLN 56 HE21 GLN 56 -10.950 -21.916 11.265 436 H ALA 57 H ALA 57 -12.882 -20.356 5.858 437 HA ALA 57 HA ALA 57 -11.699 -18.752 3.760 438 HB1 ALA 57 HB1 ALA 57 -13.574 -21.155 3.624 439 HB2 ALA 57 HB2 ALA 57 -12.583 -20.512 2.297 440 HB3 ALA 57 HB3 ALA 57 -11.795 -21.230 3.719 441 H ILE 58 H ILE 58 -15.045 -19.459 4.840 442 HA ILE 58 HA ILE 58 -16.442 -17.955 2.805 443 HB ILE 58 HB ILE 58 -17.003 -18.597 5.777 444 HG12 ILE 58 HG12 ILE 58 -17.954 -20.089 3.314 445 HG13 ILE 58 HG13 ILE 58 -16.571 -20.593 4.293 446 HG21 ILE 58 HG21 ILE 58 -19.288 -18.218 5.477 447 HG22 ILE 58 HG22 ILE 58 -18.535 -16.826 4.687 448 HG23 ILE 58 HG23 ILE 58 -19.155 -18.206 3.725 449 HD11 ILE 58 HD11 ILE 58 -18.532 -21.846 5.004 450 HD12 ILE 58 HD12 ILE 58 -18.073 -20.707 6.290 451 HD13 ILE 58 HD13 ILE 58 -19.461 -20.352 5.227 452 H GLN 59 H GLN 59 -14.932 -17.119 5.936 453 HA GLN 59 HA GLN 59 -15.903 -14.379 5.900 454 HB2 GLN 59 HB2 GLN 59 -13.824 -15.832 7.590 455 HB3 GLN 59 HB3 GLN 59 -14.361 -14.158 7.869 456 HG2 GLN 59 HG2 GLN 59 -16.679 -14.932 8.180 457 HG3 GLN 59 HG3 GLN 59 -16.187 -16.602 7.886 458 HE21 GLN 59 HE22 GLN 59 -17.413 -16.455 10.160 459 HE22 GLN 59 HE21 GLN 59 -16.335 -16.366 11.535 460 H MET 60 H MET 60 -13.852 -15.827 3.870 461 HA MET 60 HA MET 60 -12.118 -13.446 3.567 462 HB2 MET 60 HB2 MET 60 -11.014 -15.666 4.319 463 HB3 MET 60 HB3 MET 60 -11.502 -16.311 2.752 464 HG2 MET 60 HG2 MET 60 -9.397 -15.661 2.231 465 HG3 MET 60 HG3 MET 60 -10.239 -14.172 1.833 466 HE1 MET 60 HE1 MET 60 -9.422 -12.088 5.200 467 HE2 MET 60 HE2 MET 60 -10.374 -12.095 3.700 468 HE3 MET 60 HE3 MET 60 -10.811 -13.211 5.020 469 H CYS 61 H CYS 61 -14.229 -15.898 2.104 470 HA CYS 61 HA CYS 61 -13.813 -15.088 -0.604 471 HB2 CYS 61 HB2 CYS 61 -16.125 -16.458 0.864 472 HB3 CYS 61 HB3 CYS 61 -16.101 -16.236 -0.886 473 HG CYS 61 HG CYS 61 -13.806 -17.435 -1.291 474 H GLN 62 H GLN 62 -16.183 -14.081 1.936 475 HA GLN 62 HA GLN 62 -17.464 -12.164 0.164 476 HB2 GLN 62 HB2 GLN 62 -17.536 -12.449 3.202 477 HB3 GLN 62 HB3 GLN 62 -18.679 -11.521 2.200 478 HG2 GLN 62 HG2 GLN 62 -19.393 -13.617 1.061 479 HG3 GLN 62 HG3 GLN 62 -18.203 -14.526 1.988 480 HE21 GLN 62 HE22 GLN 62 -19.524 -15.847 3.032 481 HE22 GLN 62 HE21 GLN 62 -20.831 -15.343 4.054 482 H GLN 63 H GLN 63 -14.393 -12.115 1.336 483 HA GLN 63 HA GLN 63 -14.429 -9.180 1.840 484 HB2 GLN 63 HB2 GLN 63 -12.401 -11.334 2.527 485 HB3 GLN 63 HB3 GLN 63 -12.152 -9.613 2.833 486 HG2 GLN 63 HG2 GLN 63 -14.514 -11.146 4.004 487 HG3 GLN 63 HG3 GLN 63 -12.930 -11.057 4.775 488 HE21 GLN 63 HE22 GLN 63 -13.563 -9.919 6.588 489 HE22 GLN 63 HE21 GLN 63 -14.056 -8.247 6.517 490 H GLY 64 H GLY 64 -13.858 -11.477 -0.569 491 HA2 GLY 64 HA2 GLY 64 -11.830 -9.729 -1.906 492 HA3 GLY 64 HA3 GLY 64 -12.130 -11.440 -2.274 493 H LEU 65 H LEU 65 -15.066 -11.223 -2.141 494 HA LEU 65 HA LEU 65 -15.677 -10.314 -4.786 495 HB2 LEU 65 HB2 LEU 65 -17.320 -10.973 -2.315 496 HB3 LEU 65 HB3 LEU 65 -18.081 -10.474 -3.827 497 HG LEU 65 HG LEU 65 -16.157 -12.839 -3.653 498 HD11 LEU 65 HD11 LEU 65 -18.156 -13.221 -2.256 499 HD12 LEU 65 HD12 LEU 65 -19.198 -12.757 -3.617 500 HD13 LEU 65 HD13 LEU 65 -18.198 -14.225 -3.718 501 HD21 LEU 65 HD21 LEU 65 -17.219 -13.448 -5.799 502 HD22 LEU 65 HD22 LEU 65 -18.154 -11.937 -5.765 503 HD23 LEU 65 HD23 LEU 65 -16.382 -11.887 -5.902 504 H ARG 66 H ARG 66 -14.940 -8.540 -2.012 505 HA ARG 66 HA ARG 66 -16.560 -6.175 -2.590 506 HB2 ARG 66 HB2 ARG 66 -14.096 -6.555 -0.833 507 HB3 ARG 66 HB3 ARG 66 -15.222 -5.189 -0.784 508 HG2 ARG 66 HG2 ARG 66 -17.035 -6.739 -0.066 509 HG3 ARG 66 HG3 ARG 66 -15.891 -8.086 -0.119 510 HD2 ARG 66 HD2 ARG 66 -16.112 -7.302 2.172 511 HD3 ARG 66 HD3 ARG 66 -14.479 -6.945 1.570 512 HE ARG 66 HE ARG 66 -16.140 -4.688 1.083 513 HH11 ARG 66 HH11 ARG 66 -14.726 -6.454 3.797 514 HH12 ARG 66 HH12 ARG 66 -14.618 -5.034 4.814 515 HH21 ARG 66 HH21 ARG 66 -15.987 -2.853 2.425 516 HH22 ARG 66 HH22 ARG 66 -15.353 -3.005 4.046 517 H TYR 67 H TYR 67 -14.031 -7.588 -4.213 518 HA TYR 67 HA TYR 67 -12.762 -5.013 -5.004 519 HB2 TYR 67 HB2 TYR 67 -11.382 -7.534 -4.062 520 HB3 TYR 67 HB3 TYR 67 -10.547 -6.147 -4.750 521 HD1 TYR 67 HD2 TYR 67 -11.350 -3.790 -3.586 522 HD2 TYR 67 HD1 TYR 67 -11.352 -7.691 -1.760 523 HE1 TYR 67 HE2 TYR 67 -11.310 -2.736 -1.340 524 HE2 TYR 67 HE1 TYR 67 -11.302 -6.640 0.486 525 HH TYR 67 HH TYR 67 -11.263 -4.685 1.682 526 H THR 68 H THR 68 -14.405 -7.718 -6.022 527 HA THR 68 HA THR 68 -12.887 -8.029 -8.537 528 HB THR 68 HB THR 68 -14.656 -9.769 -8.980 529 HG1 THR 68 HG1 THR 68 -16.282 -8.942 -7.623 530 HG21 THR 68 HG21 THR 68 -13.765 -11.372 -7.365 531 HG22 THR 68 HG22 THR 68 -12.461 -10.320 -7.955 532 HG23 THR 68 HG23 THR 68 -13.172 -10.040 -6.352 533 H SER 69 H SER 69 -15.120 -5.835 -7.374 534 HA SER 69 HA SER 69 -17.118 -5.829 -9.413 535 HB2 SER 69 HB2 SER 69 -16.184 -3.618 -7.536 536 HB3 SER 69 HB3 SER 69 -17.698 -3.634 -8.463 537 HG SER 69 HG SER 69 -17.982 -4.389 -6.314 538 H THR 70 H THR 70 -13.816 -4.883 -9.614 539 HA THR 70 HA THR 70 -14.215 -2.599 -11.377 540 HB THR 70 HB THR 70 -11.798 -2.674 -11.629 541 HG1 THR 70 HG1 THR 70 -10.649 -4.383 -10.706 542 HG21 THR 70 HG21 THR 70 -12.710 -1.751 -9.503 543 HG22 THR 70 HG22 THR 70 -12.561 -3.355 -8.754 544 HG23 THR 70 HG23 THR 70 -11.103 -2.494 -9.286 545 H ALA 71 H ALA 71 -14.722 -5.846 -11.842 546 HA ALA 71 HA ALA 71 -15.005 -7.194 -13.605 547 HB1 ALA 71 HB1 ALA 71 -15.302 -6.318 -15.827 548 HB2 ALA 71 HB2 ALA 71 -16.068 -5.203 -14.671 549 HB3 ALA 71 HB3 ALA 71 -14.488 -4.802 -15.401 550 H GLU 72 H GLU 72 -12.069 -5.754 -12.882 551 HA GLU 72 HA GLU 72 -10.513 -6.966 -14.996 552 HB2 GLU 72 HB2 GLU 72 -9.727 -5.874 -12.290 553 HB3 GLU 72 HB3 GLU 72 -8.583 -6.358 -13.543 554 HG2 GLU 72 HG2 GLU 72 -10.656 -4.136 -13.787 555 HG3 GLU 72 HG3 GLU 72 -8.926 -3.913 -13.475 556 H HIS 73 H HIS 73 -12.341 -8.375 -12.738 557 HA HIS 73 HA HIS 73 -10.501 -10.636 -12.206 558 HB2 HIS 73 HB2 HIS 73 -12.304 -9.403 -10.102 559 HB3 HIS 73 HB3 HIS 73 -11.042 -10.606 -9.857 560 HD2 HIS 73 HD2 HIS 73 -11.682 -6.895 -9.909 561 HE1 HIS 73 HE1 HIS 73 -7.478 -7.295 -9.522 562 HE2 HIS 73 HE2 HIS 73 -9.430 -5.671 -9.387 563 H VAL 74 H VAL 74 -12.765 -10.246 -14.083 564 HA VAL 74 HA VAL 74 -15.250 -11.030 -13.157 565 HB VAL 74 HB VAL 74 -14.603 -10.171 -15.411 566 HG11 VAL 74 HG11 VAL 74 -13.890 -13.076 -15.988 567 HG12 VAL 74 HG12 VAL 74 -13.933 -11.742 -17.162 568 HG13 VAL 74 HG13 VAL 74 -12.723 -11.735 -15.862 569 HG21 VAL 74 HG21 VAL 74 -16.353 -11.358 -16.626 570 HG22 VAL 74 HG22 VAL 74 -16.299 -12.699 -15.461 571 HG23 VAL 74 HG23 VAL 74 -16.858 -11.092 -14.943 572 H ALA 75 H ALA 75 -12.429 -13.111 -13.582 573 HA ALA 75 HA ALA 75 -14.014 -15.570 -13.410 574 HB1 ALA 75 HB1 ALA 75 -11.790 -16.646 -13.268 575 HB2 ALA 75 HB2 ALA 75 -11.861 -15.493 -14.629 576 HB3 ALA 75 HB3 ALA 75 -11.020 -15.051 -13.118 577 H ILE 76 H ILE 76 -11.785 -13.756 -11.190 578 HA ILE 76 HA ILE 76 -12.156 -15.505 -8.970 579 HB ILE 76 HB ILE 76 -11.465 -12.538 -9.077 580 HG12 ILE 76 HG12 ILE 76 -9.693 -15.010 -8.951 581 HG13 ILE 76 HG13 ILE 76 -9.896 -13.956 -10.349 582 HG21 ILE 76 HG21 ILE 76 -12.206 -13.191 -6.829 583 HG22 ILE 76 HG22 ILE 76 -11.070 -14.572 -6.846 584 HG23 ILE 76 HG23 ILE 76 -10.473 -12.900 -6.833 585 HD11 ILE 76 HD11 ILE 76 -7.830 -13.355 -9.284 586 HD12 ILE 76 HD12 ILE 76 -8.988 -12.039 -9.009 587 HD13 ILE 76 HD13 ILE 76 -8.617 -13.193 -7.709 588 H ARG 77 H ARG 77 -14.037 -12.838 -10.293 589 HA ARG 77 HA ARG 77 -15.771 -12.227 -8.157 590 HB2 ARG 77 HB2 ARG 77 -15.490 -11.067 -10.380 591 HB3 ARG 77 HB3 ARG 77 -16.405 -12.380 -11.128 592 HG2 ARG 77 HG2 ARG 77 -18.360 -11.835 -9.699 593 HG3 ARG 77 HG3 ARG 77 -17.419 -10.516 -8.949 594 HD2 ARG 77 HD2 ARG 77 -17.109 -9.507 -11.194 595 HD3 ARG 77 HD3 ARG 77 -18.095 -10.812 -11.900 596 HE ARG 77 HE ARG 77 -19.901 -9.927 -10.239 597 HH11 ARG 77 HH11 ARG 77 -17.550 -7.877 -11.922 598 HH12 ARG 77 HH12 ARG 77 -18.607 -6.489 -11.931 599 HH21 ARG 77 HH21 ARG 77 -21.236 -8.090 -10.257 600 HH22 ARG 77 HH22 ARG 77 -20.673 -6.607 -10.983 601 H SER 78 H SER 78 -15.544 -15.080 -10.125 602 HA SER 78 HA SER 78 -18.183 -16.055 -9.109 603 HB2 SER 78 HB2 SER 78 -16.499 -16.928 -11.489 604 HB3 SER 78 HB3 SER 78 -18.028 -17.685 -10.971 605 HG SER 78 HG SER 78 -18.321 -16.095 -12.612 606 H LYS 79 H LYS 79 -14.736 -16.444 -8.663 607 HA LYS 79 HA LYS 79 -15.016 -19.250 -7.868 608 HB2 LYS 79 HB2 LYS 79 -12.721 -17.252 -7.648 609 HB3 LYS 79 HB3 LYS 79 -12.643 -18.934 -7.144 610 HG2 LYS 79 HG2 LYS 79 -12.982 -17.884 -9.962 611 HG3 LYS 79 HG3 LYS 79 -11.638 -18.819 -9.298 612 HD2 LYS 79 HD2 LYS 79 -14.451 -19.775 -9.945 613 HD3 LYS 79 HD3 LYS 79 -12.908 -20.309 -10.644 614 HE2 LYS 79 HE2 LYS 79 -12.255 -21.141 -8.326 615 HE3 LYS 79 HE3 LYS 79 -13.925 -20.793 -7.814 616 HZ1 LYS 79 HZ1 LYS 79 -14.697 -22.315 -9.505 617 HZ2 LYS 79 HZ2 LYS 79 -13.156 -22.639 -9.985 618 HZ3 LYS 79 HZ3 LYS 79 -13.662 -23.084 -8.487 619 H LEU 80 H LEU 80 -14.829 -16.030 -6.233 620 HA LEU 80 HA LEU 80 -14.794 -17.271 -3.603 621 HB2 LEU 80 HB2 LEU 80 -15.102 -14.472 -4.705 622 HB3 LEU 80 HB3 LEU 80 -15.365 -14.822 -2.990 623 HG LEU 80 HG LEU 80 -13.110 -15.598 -2.696 624 HD11 LEU 80 HD11 LEU 80 -12.811 -15.208 -5.690 625 HD12 LEU 80 HD12 LEU 80 -11.448 -15.412 -4.573 626 HD13 LEU 80 HD13 LEU 80 -12.613 -16.727 -4.774 627 HD21 LEU 80 HD21 LEU 80 -13.251 -13.037 -4.331 628 HD22 LEU 80 HD22 LEU 80 -13.491 -13.185 -2.574 629 HD23 LEU 80 HD23 LEU 80 -11.896 -13.502 -3.288 630 H GLN 81 H GLN 81 -17.120 -16.839 -6.059 631 HA GLN 81 HA GLN 81 -19.387 -16.929 -4.163 632 HB2 GLN 81 HB2 GLN 81 -18.945 -16.575 -7.117 633 HB3 GLN 81 HB3 GLN 81 -20.441 -17.354 -6.630 634 HG2 GLN 81 HG2 GLN 81 -19.462 -14.623 -5.711 635 HG3 GLN 81 HG3 GLN 81 -20.782 -14.951 -6.849 636 HE21 GLN 81 HE22 GLN 81 -22.072 -17.134 -5.516 637 HE22 GLN 81 HE21 GLN 81 -22.760 -16.524 -4.033 638 H TYR 82 H TYR 82 -17.635 -18.951 -6.578 639 HA TYR 82 HA TYR 82 -19.380 -21.192 -6.495 640 HB2 TYR 82 HB2 TYR 82 -17.685 -20.875 -8.252 641 HB3 TYR 82 HB3 TYR 82 -16.411 -20.820 -7.060 642 HD1 TYR 82 HD2 TYR 82 -18.919 -23.085 -8.635 643 HD2 TYR 82 HD1 TYR 82 -15.345 -22.766 -6.250 644 HE1 TYR 82 HE2 TYR 82 -18.569 -25.547 -8.830 645 HE2 TYR 82 HE1 TYR 82 -14.988 -25.213 -6.454 646 HH TYR 82 HH TYR 82 -15.764 -27.191 -7.314 647 H ARG 83 H ARG 83 -16.434 -20.446 -4.490 648 HA ARG 83 HA ARG 83 -16.821 -23.045 -3.184 649 HB2 ARG 83 HB2 ARG 83 -14.565 -21.927 -3.757 650 HB3 ARG 83 HB3 ARG 83 -14.858 -20.882 -2.352 651 HG2 ARG 83 HG2 ARG 83 -13.479 -22.782 -1.688 652 HG3 ARG 83 HG3 ARG 83 -15.072 -22.954 -0.932 653 HD2 ARG 83 HD2 ARG 83 -15.726 -24.533 -2.771 654 HD3 ARG 83 HD3 ARG 83 -14.108 -24.353 -3.467 655 HE ARG 83 HE ARG 83 -13.874 -25.174 -0.753 656 HH11 ARG 83 HH11 ARG 83 -14.931 -26.367 -3.898 657 HH12 ARG 83 HH12 ARG 83 -14.601 -28.043 -3.513 658 HH21 ARG 83 HH21 ARG 83 -13.474 -27.402 -0.257 659 HH22 ARG 83 HH22 ARG 83 -13.780 -28.613 -1.471 660 H LEU 84 H LEU 84 -17.684 -19.694 -2.630 661 HA LEU 84 HA LEU 84 -18.395 -19.988 0.150 662 HB2 LEU 84 HB2 LEU 84 -17.961 -17.842 -0.991 663 HB3 LEU 84 HB3 LEU 84 -19.347 -18.112 -2.054 664 HG LEU 84 HG LEU 84 -20.812 -18.097 0.017 665 HD11 LEU 84 HD11 LEU 84 -19.902 -17.204 2.052 666 HD12 LEU 84 HD12 LEU 84 -19.051 -18.702 1.625 667 HD13 LEU 84 HD13 LEU 84 -18.270 -17.122 1.342 668 HD21 LEU 84 HD21 LEU 84 -20.526 -16.094 -1.404 669 HD22 LEU 84 HD22 LEU 84 -20.704 -15.648 0.307 670 HD23 LEU 84 HD23 LEU 84 -19.092 -15.635 -0.467 671 H GLU 85 H GLU 85 -19.864 -20.671 -2.971 672 HA GLU 85 HA GLU 85 -22.544 -21.229 -2.044 673 HB2 GLU 85 HB2 GLU 85 -20.946 -21.455 -4.591 674 HB3 GLU 85 HB3 GLU 85 -22.417 -22.385 -4.486 675 HG2 GLU 85 HG2 GLU 85 -23.747 -20.404 -3.972 676 HG3 GLU 85 HG3 GLU 85 -22.293 -19.405 -3.875 677 H LEU 86 H LEU 86 -19.702 -22.866 -1.444 678 HA LEU 86 HA LEU 86 -21.162 -25.458 -1.208 679 HB2 LEU 86 HB2 LEU 86 -18.326 -25.003 -2.224 680 HB3 LEU 86 HB3 LEU 86 -19.000 -26.585 -1.825 681 HG LEU 86 HG LEU 86 -20.125 -24.734 -3.967 682 HD11 LEU 86 HD11 LEU 86 -17.881 -25.546 -4.548 683 HD12 LEU 86 HD12 LEU 86 -18.383 -27.217 -4.196 684 HD13 LEU 86 HD13 LEU 86 -19.121 -26.332 -5.550 685 HD21 LEU 86 HD21 LEU 86 -21.348 -26.783 -4.681 686 HD22 LEU 86 HD22 LEU 86 -20.687 -27.655 -3.272 687 HD23 LEU 86 HD23 LEU 86 -21.807 -26.297 -3.037 688 H ALA 87 H ALA 87 -19.020 -23.064 0.195 689 HA ALA 87 HA ALA 87 -17.876 -24.717 2.229 690 HB1 ALA 87 HB1 ALA 87 -18.508 -21.735 2.206 691 HB2 ALA 87 HB2 ALA 87 -17.384 -22.569 3.315 692 HB3 ALA 87 HB3 ALA 87 -17.017 -22.485 1.585 693 H GLN 88 H GLN 88 -20.989 -23.070 1.863 694 HA GLN 88 HA GLN 88 -21.794 -23.319 4.616 695 HB2 GLN 88 HB2 GLN 88 -23.280 -22.801 2.009 696 HB3 GLN 88 HB3 GLN 88 -24.042 -22.717 3.602 697 HG2 GLN 88 HG2 GLN 88 -21.639 -21.036 2.763 698 HG3 GLN 88 HG3 GLN 88 -23.315 -20.491 2.682 699 HE21 GLN 88 HE22 GLN 88 -21.725 -18.927 4.127 700 HE22 GLN 88 HE21 GLN 88 -21.971 -19.152 5.847 701 H GLY 89 H GLY 89 -21.031 -25.736 2.647 702 HA2 GLY 89 HA2 GLY 89 -23.077 -27.556 3.803 703 HA3 GLY 89 HA3 GLY 89 -22.697 -27.619 2.068 704 H ALA 90 H ALA 90 -19.986 -26.722 3.963 705 HA ALA 90 HA ALA 90 -19.094 -29.513 4.371 706 HB1 ALA 90 HB1 ALA 90 -17.541 -27.440 2.778 707 HB2 ALA 90 HB2 ALA 90 -16.973 -29.068 3.208 708 HB3 ALA 90 HB3 ALA 90 -18.355 -28.873 2.099 709 H VAL 91 H VAL 91 -19.288 -26.261 5.434 710 HA VAL 91 HA VAL 91 -16.933 -26.180 7.072 711 HB VAL 91 HB VAL 91 -18.299 -24.239 6.328 712 HG11 VAL 91 HG11 VAL 91 -20.560 -25.179 6.711 713 HG12 VAL 91 HG12 VAL 91 -20.269 -25.138 8.469 714 HG13 VAL 91 HG13 VAL 91 -20.334 -23.627 7.533 715 HG21 VAL 91 HG21 VAL 91 -16.710 -24.081 8.239 716 HG22 VAL 91 HG22 VAL 91 -18.080 -22.958 8.387 717 HG23 VAL 91 HG23 VAL 91 -18.050 -24.444 9.352 718 H GLY 92 H GLY 92 -19.945 -27.812 7.301 719 HA2 GLY 92 HA2 GLY 92 -19.152 -29.320 9.614 720 HA3 GLY 92 HA3 GLY 92 -20.388 -28.106 10.047 721 H SER 93 H SER 93 -20.957 -28.852 6.858 722 HA SER 93 HA SER 93 -22.714 -29.845 5.833 723 HB2 SER 93 HB2 SER 93 -20.984 -31.671 6.120 724 HB3 SER 93 HB3 SER 93 -22.005 -32.301 7.449 725 HG SER 93 HG SER 93 -22.461 -33.237 5.380 726 H VAL 94 H VAL 94 -24.379 -31.961 6.625 727 HA VAL 94 HA VAL 94 -26.045 -30.826 8.768 728 HB VAL 94 HB VAL 94 -26.555 -29.615 6.677 729 HG11 VAL 94 HG11 VAL 94 -27.331 -32.317 5.525 730 HG12 VAL 94 HG12 VAL 94 -27.512 -30.734 4.735 731 HG13 VAL 94 HG13 VAL 94 -25.889 -31.373 5.087 732 HG21 VAL 94 HG21 VAL 94 -28.365 -30.023 8.316 733 HG22 VAL 94 HG22 VAL 94 -28.947 -29.844 6.642 734 HG23 VAL 94 HG23 VAL 94 -28.868 -31.452 7.392 735 H GLN 95 H GLN 95 -24.523 -33.106 8.785 736 HA GLN 95 HA GLN 95 -25.693 -35.516 8.030 737 HB2 GLN 95 HB2 GLN 95 -24.355 -36.503 9.841 738 HB3 GLN 95 HB3 GLN 95 -23.418 -35.311 8.919 739 HG2 GLN 95 HG2 GLN 95 -24.847 -34.652 11.528 740 HG3 GLN 95 HG3 GLN 95 -23.178 -35.243 11.461 741 HE21 GLN 95 HE22 GLN 95 -21.653 -33.937 10.004 742 HE22 GLN 95 HE21 GLN 95 -21.868 -32.192 10.025 743 H ILE 96 H ILE 96 -26.971 -33.276 10.329 744 HA ILE 96 HA ILE 96 -29.083 -35.222 10.993 745 HB ILE 96 HB ILE 96 -29.063 -34.437 13.367 746 HG12 ILE 96 HG12 ILE 96 -26.333 -33.275 12.643 747 HG13 ILE 96 HG13 ILE 96 -27.793 -32.338 13.007 748 HG21 ILE 96 HG21 ILE 96 -26.469 -35.793 12.550 749 HG22 ILE 96 HG22 ILE 96 -27.319 -35.945 14.101 750 HG23 ILE 96 HG23 ILE 96 -28.062 -36.597 12.632 751 HD11 ILE 96 HD11 ILE 96 -26.337 -34.206 14.923 752 HD12 ILE 96 HD12 ILE 96 -26.372 -32.441 14.978 753 HD13 ILE 96 HD13 ILE 96 -27.861 -33.363 15.282 754 HA PRO 97 HA PRO 97 -31.867 -31.889 10.242 755 HB2 PRO 97 HB2 PRO 97 -33.050 -32.523 12.936 756 HB3 PRO 97 HB3 PRO 97 -33.882 -32.291 11.360 757 HG2 PRO 97 HG2 PRO 97 -33.477 -34.793 12.329 758 HG3 PRO 97 HG3 PRO 97 -33.164 -34.444 10.592 759 HD2 PRO 97 HD2 PRO 97 -31.174 -34.632 12.858 760 HD3 PRO 97 HD3 PRO 97 -31.079 -35.318 11.205 761 H VAL 98 H VAL 98 -32.517 -29.762 10.930 762 HA VAL 98 HA VAL 98 -31.143 -28.673 13.311 763 HB VAL 98 HB VAL 98 -30.346 -26.727 11.962 764 HG11 VAL 98 HG11 VAL 98 -29.227 -29.407 11.055 765 HG12 VAL 98 HG12 VAL 98 -28.386 -27.844 11.025 766 HG13 VAL 98 HG13 VAL 98 -28.826 -28.586 12.583 767 HG21 VAL 98 HG21 VAL 98 -31.003 -28.508 9.575 768 HG22 VAL 98 HG22 VAL 98 -31.851 -27.006 10.006 769 HG23 VAL 98 HG23 VAL 98 -30.144 -26.953 9.530 770 H VAL 99 H VAL 99 -33.980 -29.167 11.875 771 HA VAL 99 HA VAL 99 -35.187 -26.746 13.058 772 HB VAL 99 HB VAL 99 -36.701 -26.518 11.074 773 HG11 VAL 99 HG11 VAL 99 -33.761 -26.159 10.409 774 HG12 VAL 99 HG12 VAL 99 -35.131 -25.319 9.660 775 HG13 VAL 99 HG13 VAL 99 -34.742 -25.034 11.370 776 HG21 VAL 99 HG21 VAL 99 -34.696 -28.365 9.713 777 HG22 VAL 99 HG22 VAL 99 -36.373 -28.792 10.128 778 HG23 VAL 99 HG23 VAL 99 -36.044 -27.516 8.938 779 H GLU 100 H GLU 100 -34.948 -29.874 13.420 780 HA GLU 100 HA GLU 100 -37.260 -31.212 12.972 781 HB2 GLU 100 HB2 GLU 100 -34.942 -31.741 14.167 782 HB3 GLU 100 HB3 GLU 100 -35.891 -31.450 15.642 783 HG2 GLU 100 HG2 GLU 100 -37.592 -33.071 14.780 784 HG3 GLU 100 HG3 GLU 100 -36.561 -33.317 13.355 785 H VAL 101 H VAL 101 -39.253 -31.434 13.857 786 HA VAL 101 HA VAL 101 -40.367 -29.289 15.419 787 HB VAL 101 HB VAL 101 -41.594 -30.573 13.702 788 HG11 VAL 101 HG11 VAL 101 -41.476 -32.877 15.685 789 HG12 VAL 101 HG12 VAL 101 -42.389 -32.846 14.165 790 HG13 VAL 101 HG13 VAL 101 -40.613 -32.807 14.127 791 HG21 VAL 101 HG21 VAL 101 -42.832 -29.422 15.534 792 HG22 VAL 101 HG22 VAL 101 -43.686 -30.834 14.880 793 HG23 VAL 101 HG23 VAL 101 -42.863 -30.955 16.442 794 H ASP 102 H ASP 102 -41.415 -29.513 17.522 795 HA ASP 102 HA ASP 102 -40.565 -31.751 19.232 796 HB2 ASP 102 HB2 ASP 102 -38.745 -30.028 19.261 797 HB3 ASP 102 HB3 ASP 102 -39.923 -28.874 19.888 798 H GLU 103 H GLU 103 -41.613 -31.568 21.418 799 HA GLU 103 HA GLU 103 -44.419 -30.874 21.134 800 HB2 GLU 103 HB2 GLU 103 -42.882 -31.696 23.618 801 HB3 GLU 103 HB3 GLU 103 -44.632 -31.734 23.393 802 HG2 GLU 103 HG2 GLU 103 -44.360 -33.372 21.540 803 HG3 GLU 103 HG3 GLU 103 -42.612 -33.396 21.834 804 H LEU 104 H LEU 104 -45.267 -29.877 23.426 805 HA LEU 104 HA LEU 104 -44.725 -27.065 23.194 806 HB2 LEU 104 HB2 LEU 104 -46.106 -28.428 25.512 807 HB3 LEU 104 HB3 LEU 104 -46.407 -26.820 24.896 808 HG LEU 104 HG LEU 104 -47.083 -29.400 23.464 809 HD11 LEU 104 HD11 LEU 104 -48.829 -27.240 24.703 810 HD12 LEU 104 HD12 LEU 104 -49.404 -28.676 23.826 811 HD13 LEU 104 HD13 LEU 104 -48.546 -28.863 25.369 812 HD21 LEU 104 HD21 LEU 104 -46.457 -27.646 21.847 813 HD22 LEU 104 HD22 LEU 104 -48.209 -27.922 21.816 814 HD23 LEU 104 HD23 LEU 104 -47.552 -26.499 22.661 815 HA PRO 105 HA PRO 105 -41.481 -26.633 26.132 816 HB2 PRO 105 HB2 PRO 105 -41.817 -24.143 27.150 817 HB3 PRO 105 HB3 PRO 105 -41.570 -24.403 25.396 818 HG2 PRO 105 HG2 PRO 105 -44.185 -23.986 26.877 819 HG3 PRO 105 HG3 PRO 105 -43.627 -23.190 25.369 820 HD2 PRO 105 HD2 PRO 105 -45.284 -25.385 25.458 821 HD3 PRO 105 HD3 PRO 105 -44.203 -25.070 24.078 822 H GLU 106 H GLU 106 -44.243 -27.737 27.195 823 HA GLU 106 HA GLU 106 -45.139 -28.402 29.168 824 HB2 GLU 106 HB2 GLU 106 -42.210 -28.242 29.973 825 HB3 GLU 106 HB3 GLU 106 -43.478 -29.052 30.931 826 HG2 GLU 106 HG2 GLU 106 -43.971 -30.531 28.999 827 HG3 GLU 106 HG3 GLU 106 -42.685 -29.746 28.065 828 H GLY 107 H GLY 107 -44.903 -25.444 28.646 829 HA2 GLY 107 HA2 GLY 107 -45.805 -24.590 31.297 830 HA3 GLY 107 HA3 GLY 107 -44.349 -23.768 30.684 831 H TYR 108 H TYR 108 -46.670 -24.909 28.355 832 HA TYR 108 HA TYR 108 -47.102 -22.339 27.239 833 HB2 TYR 108 HB2 TYR 108 -48.555 -23.428 25.709 834 HB3 TYR 108 HB3 TYR 108 -47.177 -24.481 26.007 835 HD1 TYR 108 HD1 TYR 108 -47.517 -26.327 27.872 836 HD2 TYR 108 HD2 TYR 108 -50.699 -24.308 25.813 837 HE1 TYR 108 HE1 TYR 108 -49.050 -28.200 28.419 838 HE2 TYR 108 HE2 TYR 108 -52.241 -26.189 26.328 839 HH TYR 108 HH TYR 108 -51.184 -29.049 28.213 840 H ASP 109 H ASP 109 -49.556 -21.759 26.679 841 HA ASP 109 HA ASP 109 -50.577 -20.683 29.124 842 HB2 ASP 109 HB2 ASP 109 -50.544 -19.593 26.851 843 HB3 ASP 109 HB3 ASP 109 -51.837 -20.702 26.346 844 H ARG 110 H ARG 110 -50.702 -23.675 28.738 845 HA ARG 110 HA ARG 110 -52.099 -25.455 28.976 846 HB2 ARG 110 HB2 ARG 110 -53.365 -25.447 30.994 847 HB3 ARG 110 HB3 ARG 110 -51.778 -24.701 31.204 848 HG2 ARG 110 HG2 ARG 110 -52.776 -22.464 31.161 849 HG3 ARG 110 HG3 ARG 110 -54.386 -23.164 30.839 850 HD2 ARG 110 HD2 ARG 110 -54.241 -24.446 32.922 851 HD3 ARG 110 HD3 ARG 110 -52.642 -23.781 33.242 852 HE ARG 110 HE ARG 110 -55.242 -22.448 33.580 853 HH11 ARG 110 HH11 ARG 110 -51.735 -21.984 33.314 854 HH12 ARG 110 HH12 ARG 110 -51.771 -20.422 34.102 855 HH21 ARG 110 HH21 ARG 110 -55.241 -20.418 34.606 856 HH22 ARG 110 HH22 ARG 110 -53.749 -19.537 34.820 857 H SER 111 H SER 111 -53.053 -23.598 26.877 858 HA SER 111 HA SER 111 -55.820 -24.630 26.679 859 HB2 SER 111 HB2 SER 111 -55.060 -21.709 26.286 860 HB3 SER 111 HB3 SER 111 -56.647 -22.429 25.963 861 HG SER 111 HG SER 111 -55.310 -22.223 28.461 Start of MODEL 10 1 H1 SER 2 H1 SER 2 7.805 -3.360 -3.720 2 H2 SER 2 H2 SER 2 7.010 -2.271 -4.655 3 H3 SER 2 H3 SER 2 7.958 -3.412 -5.362 4 HA SER 2 HA SER 2 5.495 -3.921 -3.836 5 HB2 SER 2 HB2 SER 2 6.032 -4.119 -6.822 6 HB3 SER 2 HB3 SER 2 4.515 -4.563 -5.995 7 HG SER 2 HG SER 2 4.461 -2.421 -6.849 8 H GLN 3 H GLN 3 4.996 -6.052 -3.431 9 HA GLN 3 HA GLN 3 6.732 -8.167 -4.525 10 HB2 GLN 3 HB2 GLN 3 7.736 -7.159 -2.398 11 HB3 GLN 3 HB3 GLN 3 6.357 -7.843 -1.531 12 HG2 GLN 3 HG2 GLN 3 7.029 -10.123 -2.304 13 HG3 GLN 3 HG3 GLN 3 8.355 -9.411 -3.216 14 HE21 GLN 3 HE22 GLN 3 9.583 -11.024 -1.833 15 HE22 GLN 3 HE21 GLN 3 10.123 -10.469 -0.268 16 H PHE 4 H PHE 4 3.721 -7.065 -4.113 17 HA PHE 4 HA PHE 4 2.219 -8.993 -2.740 18 HB2 PHE 4 HB2 PHE 4 1.491 -6.776 -3.594 19 HB3 PHE 4 HB3 PHE 4 1.531 -7.390 -5.233 20 HD1 PHE 4 HD1 PHE 4 0.010 -9.698 -5.522 21 HD2 PHE 4 HD2 PHE 4 -0.527 -6.624 -2.584 22 HE1 PHE 4 HE1 PHE 4 -2.340 -10.400 -5.225 23 HE2 PHE 4 HE2 PHE 4 -2.918 -7.239 -2.346 24 HZ PHE 4 HZ PHE 4 -3.827 -9.141 -3.677 25 H GLU 5 H GLU 5 3.330 -8.972 -6.154 26 HA GLU 5 HA GLU 5 1.979 -11.568 -6.591 27 HB2 GLU 5 HB2 GLU 5 3.322 -9.606 -8.479 28 HB3 GLU 5 HB3 GLU 5 2.596 -11.149 -8.978 29 HG2 GLU 5 HG2 GLU 5 0.419 -10.435 -8.001 30 HG3 GLU 5 HG3 GLU 5 1.132 -8.863 -7.595 31 H LYS 6 H LYS 6 4.717 -10.883 -5.095 32 HA LYS 6 HA LYS 6 6.322 -12.989 -6.499 33 HB2 LYS 6 HB2 LYS 6 7.018 -10.553 -4.834 34 HB3 LYS 6 HB3 LYS 6 8.102 -11.940 -4.900 35 HG2 LYS 6 HG2 LYS 6 8.793 -10.288 -6.507 36 HG3 LYS 6 HG3 LYS 6 8.254 -11.752 -7.347 37 HD2 LYS 6 HD2 LYS 6 6.136 -10.677 -7.930 38 HD3 LYS 6 HD3 LYS 6 6.573 -9.233 -6.959 39 HE2 LYS 6 HE2 LYS 6 8.515 -8.852 -8.436 40 HE3 LYS 6 HE3 LYS 6 8.095 -10.294 -9.380 41 HZ1 LYS 6 HZ1 LYS 6 7.297 -8.282 -10.408 42 HZ2 LYS 6 HZ2 LYS 6 6.027 -9.220 -9.956 43 HZ3 LYS 6 HZ3 LYS 6 6.422 -7.889 -9.077 44 H GLN 7 H GLN 7 5.559 -11.690 -3.184 45 HA GLN 7 HA GLN 7 6.506 -14.019 -1.857 46 HB2 GLN 7 HB2 GLN 7 5.570 -11.503 -1.141 47 HB3 GLN 7 HB3 GLN 7 4.273 -12.548 -0.560 48 HG2 GLN 7 HG2 GLN 7 7.243 -12.791 0.074 49 HG3 GLN 7 HG3 GLN 7 5.978 -12.199 1.170 50 HE21 GLN 7 HE22 GLN 7 4.060 -13.848 1.469 51 HE22 GLN 7 HE21 GLN 7 4.545 -15.518 1.682 52 H LYS 8 H LYS 8 3.393 -13.161 -3.296 53 HA LYS 8 HA LYS 8 1.839 -15.239 -2.027 54 HB2 LYS 8 HB2 LYS 8 1.045 -13.001 -2.862 55 HB3 LYS 8 HB3 LYS 8 1.379 -13.544 -4.485 56 HG2 LYS 8 HG2 LYS 8 -0.298 -15.494 -3.943 57 HG3 LYS 8 HG3 LYS 8 -0.790 -14.476 -2.588 58 HD2 LYS 8 HD2 LYS 8 -2.222 -13.787 -4.367 59 HD3 LYS 8 HD3 LYS 8 -0.935 -12.566 -4.369 60 HE2 LYS 8 HE2 LYS 8 -1.156 -13.260 -6.662 61 HE3 LYS 8 HE3 LYS 8 0.301 -14.037 -6.061 62 HZ1 LYS 8 HZ1 LYS 8 -1.037 -15.593 -7.253 63 HZ2 LYS 8 HZ2 LYS 8 -1.035 -16.029 -5.676 64 HZ3 LYS 8 HZ3 LYS 8 -2.363 -15.292 -6.306 65 H GLU 9 H GLU 9 2.998 -14.723 -5.379 66 HA GLU 9 HA GLU 9 2.169 -17.222 -6.419 67 HB2 GLU 9 HB2 GLU 9 4.313 -15.215 -7.076 68 HB3 GLU 9 HB3 GLU 9 4.060 -16.661 -8.083 69 HG2 GLU 9 HG2 GLU 9 1.935 -14.566 -7.444 70 HG3 GLU 9 HG3 GLU 9 2.880 -14.625 -8.952 71 H GLN 10 H GLN 10 5.113 -16.327 -4.586 72 HA GLN 10 HA GLN 10 6.557 -18.729 -5.223 73 HB2 GLN 10 HB2 GLN 10 6.823 -16.581 -3.115 74 HB3 GLN 10 HB3 GLN 10 7.888 -18.001 -3.134 75 HG2 GLN 10 HG2 GLN 10 8.642 -17.514 -5.380 76 HG3 GLN 10 HG3 GLN 10 7.495 -16.188 -5.539 77 HE21 GLN 10 HE22 GLN 10 9.815 -15.279 -6.132 78 HE22 GLN 10 HE21 GLN 10 10.632 -14.471 -4.810 79 H GLY 11 H GLY 11 3.692 -18.502 -3.567 80 HA2 GLY 11 HA2 GLY 11 4.395 -20.885 -1.896 81 HA3 GLY 11 HA3 GLY 11 3.205 -19.682 -1.403 82 H ASN 12 H ASN 12 2.830 -19.892 -4.722 83 HA ASN 12 HA ASN 12 0.367 -21.307 -4.511 84 HB2 ASN 12 HB2 ASN 12 0.100 -20.754 -6.707 85 HB3 ASN 12 HB3 ASN 12 1.431 -19.654 -6.365 86 HD21 ASN 12 HD22 ASN 12 3.546 -20.218 -7.166 87 HD22 ASN 12 HD21 ASN 12 3.715 -21.397 -8.449 88 H SER 13 H SER 13 3.674 -22.313 -5.074 89 HA SER 13 HA SER 13 2.926 -24.999 -5.955 90 HB2 SER 13 HB2 SER 13 5.611 -23.854 -5.064 91 HB3 SER 13 HB3 SER 13 5.362 -25.417 -5.868 92 HG SER 13 HG SER 13 4.560 -24.291 -7.670 93 H LEU 14 H LEU 14 4.024 -23.397 -2.927 94 HA LEU 14 HA LEU 14 4.392 -25.754 -1.390 95 HB2 LEU 14 HB2 LEU 14 3.779 -22.843 -0.844 96 HB3 LEU 14 HB3 LEU 14 3.728 -24.004 0.467 97 HG LEU 14 HG LEU 14 6.048 -24.661 0.091 98 HD11 LEU 14 HD11 LEU 14 6.272 -24.308 -2.318 99 HD12 LEU 14 HD12 LEU 14 6.011 -22.556 -2.121 100 HD13 LEU 14 HD13 LEU 14 7.476 -23.334 -1.460 101 HD21 LEU 14 HD21 LEU 14 5.650 -21.642 0.229 102 HD22 LEU 14 HD22 LEU 14 5.531 -22.773 1.591 103 HD23 LEU 14 HD23 LEU 14 7.094 -22.531 0.772 104 H PHE 15 H PHE 15 1.560 -23.825 -2.264 105 HA PHE 15 HA PHE 15 -0.370 -25.030 -0.556 106 HB2 PHE 15 HB2 PHE 15 -0.781 -22.939 -1.649 107 HB3 PHE 15 HB3 PHE 15 -0.380 -23.596 -3.224 108 HD1 PHE 15 HD1 PHE 15 -2.830 -24.248 -0.447 109 HD2 PHE 15 HD2 PHE 15 -2.069 -24.055 -4.664 110 HE1 PHE 15 HE1 PHE 15 -5.218 -24.767 -0.893 111 HE2 PHE 15 HE2 PHE 15 -4.489 -24.460 -5.122 112 HZ PHE 15 HZ PHE 15 -6.048 -24.810 -3.250 113 H LYS 16 H LYS 16 1.361 -26.289 -3.245 114 HA LYS 16 HA LYS 16 -0.705 -28.373 -3.721 115 HB2 LYS 16 HB2 LYS 16 1.523 -27.337 -5.488 116 HB3 LYS 16 HB3 LYS 16 0.454 -28.694 -5.904 117 HG2 LYS 16 HG2 LYS 16 -1.500 -27.293 -5.881 118 HG3 LYS 16 HG3 LYS 16 -0.623 -25.968 -5.096 119 HD2 LYS 16 HD2 LYS 16 0.839 -25.763 -7.104 120 HD3 LYS 16 HD3 LYS 16 -0.203 -26.933 -7.947 121 HE2 LYS 16 HE2 LYS 16 -1.310 -24.495 -6.509 122 HE3 LYS 16 HE3 LYS 16 -0.718 -24.376 -8.189 123 HZ1 LYS 16 HZ1 LYS 16 -3.080 -24.802 -8.106 124 HZ2 LYS 16 HZ2 LYS 16 -2.309 -26.075 -8.803 125 HZ3 LYS 16 HZ3 LYS 16 -2.860 -26.186 -7.253 126 H GLN 17 H GLN 17 2.316 -27.832 -2.191 127 HA GLN 17 HA GLN 17 3.478 -30.457 -2.676 128 HB2 GLN 17 HB2 GLN 17 4.102 -28.287 -0.670 129 HB3 GLN 17 HB3 GLN 17 4.982 -29.826 -0.815 130 HG2 GLN 17 HG2 GLN 17 5.296 -29.259 -3.308 131 HG3 GLN 17 HG3 GLN 17 4.774 -27.628 -2.872 132 HE21 GLN 17 HE22 GLN 17 5.886 -27.122 -0.452 133 HE22 GLN 17 HE21 GLN 17 7.623 -27.235 -0.542 134 H GLY 18 H GLY 18 0.937 -29.303 -0.588 135 HA2 GLY 18 HA2 GLY 18 -0.424 -30.779 0.644 136 HA3 GLY 18 HA3 GLY 18 0.899 -31.954 0.744 137 H LEU 19 H LEU 19 1.524 -28.558 1.442 138 HA LEU 19 HA LEU 19 1.427 -29.058 4.354 139 HB2 LEU 19 HB2 LEU 19 3.676 -27.897 4.535 140 HB3 LEU 19 HB3 LEU 19 3.638 -29.571 3.972 141 HG LEU 19 HG LEU 19 3.910 -28.840 1.628 142 HD11 LEU 19 HD11 LEU 19 4.268 -26.076 2.862 143 HD12 LEU 19 HD12 LEU 19 4.609 -26.505 1.176 144 HD13 LEU 19 HD13 LEU 19 2.946 -26.570 1.781 145 HD21 LEU 19 HD21 LEU 19 5.835 -29.430 3.044 146 HD22 LEU 19 HD22 LEU 19 6.259 -28.152 1.880 147 HD23 LEU 19 HD23 LEU 19 5.964 -27.736 3.585 148 H TYR 20 H TYR 20 -0.551 -27.875 3.214 149 HA TYR 20 HA TYR 20 -0.556 -25.285 2.335 150 HB2 TYR 20 HB2 TYR 20 -2.634 -26.370 4.216 151 HB3 TYR 20 HB3 TYR 20 -2.880 -25.266 2.872 152 HD1 TYR 20 HD2 TYR 20 -2.771 -26.169 0.517 153 HD2 TYR 20 HD1 TYR 20 -2.602 -28.742 3.955 154 HE1 TYR 20 HE2 TYR 20 -3.381 -28.108 -0.904 155 HE2 TYR 20 HE1 TYR 20 -3.221 -30.679 2.548 156 HH TYR 20 HH TYR 20 -3.740 -31.412 0.439 157 H ARG 21 H ARG 21 0.021 -26.292 5.658 158 HA ARG 21 HA ARG 21 -0.831 -24.040 7.092 159 HB2 ARG 21 HB2 ARG 21 -0.121 -26.132 8.099 160 HB3 ARG 21 HB3 ARG 21 1.517 -25.937 7.472 161 HG2 ARG 21 HG2 ARG 21 1.347 -25.395 9.888 162 HG3 ARG 21 HG3 ARG 21 1.933 -24.033 8.912 163 HD2 ARG 21 HD2 ARG 21 -0.320 -23.030 8.940 164 HD3 ARG 21 HD3 ARG 21 -0.934 -24.411 9.863 165 HE ARG 21 HE ARG 21 -0.001 -23.529 11.789 166 HH11 ARG 21 HH11 ARG 21 1.349 -21.859 8.969 167 HH12 ARG 21 HH12 ARG 21 2.178 -20.666 9.936 168 HH21 ARG 21 HH21 ARG 21 1.098 -21.946 13.018 169 HH22 ARG 21 HH22 ARG 21 2.033 -20.708 12.212 170 H GLU 22 H GLU 22 1.853 -24.369 4.874 171 HA GLU 22 HA GLU 22 3.167 -21.876 5.797 172 HB2 GLU 22 HB2 GLU 22 3.612 -23.628 3.351 173 HB3 GLU 22 HB3 GLU 22 4.727 -22.402 3.974 174 HG2 GLU 22 HG2 GLU 22 3.864 -24.871 5.559 175 HG3 GLU 22 HG3 GLU 22 5.260 -24.813 4.489 176 H ALA 23 H ALA 23 1.221 -23.183 3.151 177 HA ALA 23 HA ALA 23 1.408 -20.963 1.378 178 HB1 ALA 23 HB1 ALA 23 -0.681 -23.160 1.607 179 HB2 ALA 23 HB2 ALA 23 -0.404 -22.109 0.199 180 HB3 ALA 23 HB3 ALA 23 0.854 -23.261 0.712 181 H VAL 24 H VAL 24 -0.653 -21.450 4.217 182 HA VAL 24 HA VAL 24 -2.738 -19.556 3.381 183 HB VAL 24 HB VAL 24 -1.760 -20.543 6.112 184 HG11 VAL 24 HG11 VAL 24 -4.338 -19.074 5.357 185 HG12 VAL 24 HG12 VAL 24 -3.984 -19.776 6.949 186 HG13 VAL 24 HG13 VAL 24 -3.006 -18.432 6.345 187 HG21 VAL 24 HG21 VAL 24 -4.222 -21.355 4.455 188 HG22 VAL 24 HG22 VAL 24 -2.749 -22.333 4.617 189 HG23 VAL 24 HG23 VAL 24 -3.759 -22.020 6.041 190 H HIS 25 H HIS 25 0.120 -19.757 5.263 191 HA HIS 25 HA HIS 25 0.380 -17.094 6.268 192 HB2 HIS 25 HB2 HIS 25 1.471 -19.794 6.430 193 HB3 HIS 25 HB3 HIS 25 2.746 -18.663 6.296 194 HD2 HIS 25 HD2 HIS 25 3.376 -17.454 8.638 195 HE1 HIS 25 HE1 HIS 25 -0.138 -18.513 10.815 196 HE2 HIS 25 HE2 HIS 25 2.171 -17.410 10.974 197 H CYS 26 H CYS 26 0.470 -17.984 3.180 198 HA CYS 26 HA CYS 26 2.697 -16.132 2.451 199 HB2 CYS 26 HB2 CYS 26 1.816 -18.763 1.205 200 HB3 CYS 26 HB3 CYS 26 2.734 -17.538 0.328 201 HG CYS 26 HG CYS 26 3.461 -19.017 3.195 202 H TYR 27 H TYR 27 -0.582 -16.502 2.534 203 HA TYR 27 HA TYR 27 -0.933 -14.702 0.173 204 HB2 TYR 27 HB2 TYR 27 -2.998 -16.515 1.417 205 HB3 TYR 27 HB3 TYR 27 -3.198 -15.521 -0.028 206 HD1 TYR 27 HD1 TYR 27 -0.489 -16.278 -1.350 207 HD2 TYR 27 HD2 TYR 27 -3.591 -18.558 0.543 208 HE1 TYR 27 HE1 TYR 27 0.118 -18.245 -2.742 209 HE2 TYR 27 HE2 TYR 27 -2.993 -20.537 -0.852 210 HH TYR 27 HH TYR 27 -1.654 -21.348 -2.493 211 H ASP 28 H ASP 28 -0.869 -14.821 3.535 212 HA ASP 28 HA ASP 28 -3.209 -13.166 4.091 213 HB2 ASP 28 HB2 ASP 28 -2.100 -14.867 5.613 214 HB3 ASP 28 HB3 ASP 28 -0.731 -13.774 5.777 215 H GLN 29 H GLN 29 0.179 -12.605 3.219 216 HA GLN 29 HA GLN 29 0.275 -10.003 4.455 217 HB2 GLN 29 HB2 GLN 29 2.424 -9.807 3.618 218 HB3 GLN 29 HB3 GLN 29 2.243 -11.513 4.043 219 HG2 GLN 29 HG2 GLN 29 1.903 -10.338 1.286 220 HG3 GLN 29 HG3 GLN 29 3.403 -11.073 1.852 221 HE21 GLN 29 HE22 GLN 29 1.905 -11.841 -0.459 222 HE22 GLN 29 HE21 GLN 29 1.337 -13.482 -0.247 223 H LEU 30 H LEU 30 -1.213 -11.129 1.536 224 HA LEU 30 HA LEU 30 -1.008 -8.596 0.105 225 HB2 LEU 30 HB2 LEU 30 -2.957 -10.939 -0.119 226 HB3 LEU 30 HB3 LEU 30 -2.836 -9.592 -1.254 227 HG LEU 30 HG LEU 30 -1.589 -11.091 -2.390 228 HD11 LEU 30 HD11 LEU 30 0.566 -10.287 -0.397 229 HD12 LEU 30 HD12 LEU 30 0.812 -10.886 -2.040 230 HD13 LEU 30 HD13 LEU 30 0.050 -9.308 -1.773 231 HD21 LEU 30 HD21 LEU 30 -2.065 -12.909 -0.903 232 HD22 LEU 30 HD22 LEU 30 -0.350 -12.940 -1.326 233 HD23 LEU 30 HD23 LEU 30 -0.848 -12.337 0.265 234 H ILE 31 H ILE 31 -3.258 -10.140 2.363 235 HA ILE 31 HA ILE 31 -5.281 -8.106 2.138 236 HB ILE 31 HB ILE 31 -4.670 -10.217 4.238 237 HG12 ILE 31 HG12 ILE 31 -6.934 -10.468 2.290 238 HG13 ILE 31 HG13 ILE 31 -5.315 -10.779 1.692 239 HG21 ILE 31 HG21 ILE 31 -7.199 -8.591 3.809 240 HG22 ILE 31 HG22 ILE 31 -7.088 -10.016 4.867 241 HG23 ILE 31 HG23 ILE 31 -6.141 -8.574 5.245 242 HD11 ILE 31 HD11 ILE 31 -6.325 -12.847 2.451 243 HD12 ILE 31 HD12 ILE 31 -4.936 -12.395 3.474 244 HD13 ILE 31 HD13 ILE 31 -6.589 -12.136 4.068 245 H THR 32 H THR 32 -2.217 -8.267 3.558 246 HA THR 32 HA THR 32 -2.827 -6.110 5.535 247 HB THR 32 HB THR 32 -0.408 -7.941 5.326 248 HG1 THR 32 HG1 THR 32 -2.269 -9.059 5.897 249 HG21 THR 32 HG21 THR 32 0.185 -5.889 6.490 250 HG22 THR 32 HG22 THR 32 -1.309 -5.967 7.463 251 HG23 THR 32 HG23 THR 32 -0.021 -7.178 7.679 252 H ALA 33 H ALA 33 -1.216 -6.683 2.460 253 HA ALA 33 HA ALA 33 0.462 -4.262 2.851 254 HB1 ALA 33 HB1 ALA 33 0.394 -6.317 0.605 255 HB2 ALA 33 HB2 ALA 33 1.559 -4.980 0.778 256 HB3 ALA 33 HB3 ALA 33 1.535 -6.291 1.971 257 H GLN 34 H GLN 34 -2.138 -5.556 0.743 258 HA GLN 34 HA GLN 34 -3.311 -2.955 0.481 259 HB2 GLN 34 HB2 GLN 34 -3.274 -2.921 -2.037 260 HB3 GLN 34 HB3 GLN 34 -1.830 -2.364 -1.197 261 HG2 GLN 34 HG2 GLN 34 -1.865 -5.237 -1.953 262 HG3 GLN 34 HG3 GLN 34 -1.830 -4.088 -3.290 263 HE21 GLN 34 HE22 GLN 34 -0.202 -2.154 -2.914 264 HE22 GLN 34 HE21 GLN 34 1.376 -2.647 -2.340 265 HA PRO 35 HA PRO 35 -6.069 -6.620 0.403 266 HB2 PRO 35 HB2 PRO 35 -8.010 -5.480 2.007 267 HB3 PRO 35 HB3 PRO 35 -6.570 -6.335 2.623 268 HG2 PRO 35 HG2 PRO 35 -6.978 -3.362 2.264 269 HG3 PRO 35 HG3 PRO 35 -6.296 -4.221 3.683 270 HD2 PRO 35 HD2 PRO 35 -4.711 -3.050 1.824 271 HD3 PRO 35 HD3 PRO 35 -4.254 -4.617 2.558 272 H GLN 36 H GLN 36 -6.109 -3.548 -0.966 273 HA GLN 36 HA GLN 36 -8.844 -3.308 -1.732 274 HB2 GLN 36 HB2 GLN 36 -8.082 -1.547 -3.181 275 HB3 GLN 36 HB3 GLN 36 -7.239 -1.439 -1.631 276 HG2 GLN 36 HG2 GLN 36 -5.299 -2.642 -2.641 277 HG3 GLN 36 HG3 GLN 36 -6.130 -2.653 -4.194 278 HE21 GLN 36 HE22 GLN 36 -3.623 -1.491 -4.044 279 HE22 GLN 36 HE21 GLN 36 -3.770 0.246 -4.193 280 H ASN 37 H ASN 37 -7.074 -5.875 -2.476 281 HA ASN 37 HA ASN 37 -8.217 -6.095 -5.210 282 HB2 ASN 37 HB2 ASN 37 -5.423 -6.877 -4.278 283 HB3 ASN 37 HB3 ASN 37 -6.127 -7.373 -5.826 284 HD21 ASN 37 HD22 ASN 37 -4.153 -5.133 -4.386 285 HD22 ASN 37 HD21 ASN 37 -4.269 -3.843 -5.566 286 HA PRO 38 HA PRO 38 -9.947 -9.733 -3.389 287 HB2 PRO 38 HB2 PRO 38 -10.930 -10.938 -5.582 288 HB3 PRO 38 HB3 PRO 38 -11.517 -9.332 -5.062 289 HG2 PRO 38 HG2 PRO 38 -9.375 -9.870 -7.129 290 HG3 PRO 38 HG3 PRO 38 -10.885 -8.917 -7.337 291 HD2 PRO 38 HD2 PRO 38 -8.609 -7.632 -6.651 292 HD3 PRO 38 HD3 PRO 38 -10.128 -7.245 -5.869 293 H VAL 39 H VAL 39 -7.136 -9.781 -5.398 294 HA VAL 39 HA VAL 39 -6.856 -12.582 -5.861 295 HB VAL 39 HB VAL 39 -4.716 -10.447 -5.444 296 HG11 VAL 39 HG11 VAL 39 -3.315 -11.937 -6.837 297 HG12 VAL 39 HG12 VAL 39 -3.808 -12.726 -5.326 298 HG13 VAL 39 HG13 VAL 39 -4.623 -13.146 -6.862 299 HG21 VAL 39 HG21 VAL 39 -4.733 -10.268 -7.911 300 HG22 VAL 39 HG22 VAL 39 -6.107 -11.399 -7.984 301 HG23 VAL 39 HG23 VAL 39 -6.294 -9.801 -7.219 302 H GLY 40 H GLY 40 -5.939 -10.490 -3.093 303 HA2 GLY 40 HA2 GLY 40 -4.505 -12.425 -1.572 304 HA3 GLY 40 HA3 GLY 40 -5.330 -10.986 -0.948 305 H TYR 41 H TYR 41 -7.861 -12.163 -2.351 306 HA TYR 41 HA TYR 41 -8.565 -14.101 -0.219 307 HB2 TYR 41 HB2 TYR 41 -10.638 -12.527 -1.715 308 HB3 TYR 41 HB3 TYR 41 -10.740 -13.265 -0.188 309 HD1 TYR 41 HD1 TYR 41 -8.883 -10.423 -1.785 310 HD2 TYR 41 HD2 TYR 41 -10.636 -12.055 1.769 311 HE1 TYR 41 HE1 TYR 41 -8.482 -8.277 -0.612 312 HE2 TYR 41 HE2 TYR 41 -10.210 -9.925 2.970 313 HH TYR 41 HH TYR 41 -8.725 -7.108 1.330 314 H SER 42 H SER 42 -7.348 -14.474 -2.997 315 HA SER 42 HA SER 42 -9.476 -16.262 -4.074 316 HB2 SER 42 HB2 SER 42 -9.086 -14.241 -5.480 317 HB3 SER 42 HB3 SER 42 -7.387 -14.741 -5.667 318 HG SER 42 HG SER 42 -8.640 -15.490 -7.399 319 H ASN 43 H ASN 43 -6.556 -16.135 -2.507 320 HA ASN 43 HA ASN 43 -5.900 -18.878 -3.481 321 HB2 ASN 43 HB2 ASN 43 -3.991 -16.636 -2.675 322 HB3 ASN 43 HB3 ASN 43 -3.530 -18.310 -2.974 323 HD21 ASN 43 HD22 ASN 43 -4.334 -19.226 -5.176 324 HD22 ASN 43 HD21 ASN 43 -4.126 -18.157 -6.543 325 H LYS 44 H LYS 44 -5.945 -16.559 -0.700 326 HA LYS 44 HA LYS 44 -5.461 -18.697 1.222 327 HB2 LYS 44 HB2 LYS 44 -5.103 -16.151 1.470 328 HB3 LYS 44 HB3 LYS 44 -6.831 -16.038 1.682 329 HG2 LYS 44 HG2 LYS 44 -6.687 -17.663 3.593 330 HG3 LYS 44 HG3 LYS 44 -4.930 -17.721 3.386 331 HD2 LYS 44 HD2 LYS 44 -4.799 -15.284 3.859 332 HD3 LYS 44 HD3 LYS 44 -6.563 -15.227 4.034 333 HE2 LYS 44 HE2 LYS 44 -6.368 -16.966 5.852 334 HE3 LYS 44 HE3 LYS 44 -4.608 -16.784 5.770 335 HZ1 LYS 44 HZ1 LYS 44 -4.910 -14.449 6.332 336 HZ2 LYS 44 HZ2 LYS 44 -6.543 -14.645 6.398 337 HZ3 LYS 44 HZ3 LYS 44 -5.580 -15.414 7.483 338 H ALA 45 H ALA 45 -8.246 -17.049 -0.197 339 HA ALA 45 HA ALA 45 -10.290 -18.440 1.272 340 HB1 ALA 45 HB1 ALA 45 -11.786 -17.476 -0.392 341 HB2 ALA 45 HB2 ALA 45 -10.559 -16.250 -0.006 342 HB3 ALA 45 HB3 ALA 45 -10.437 -17.203 -1.506 343 H MET 46 H MET 46 -8.027 -19.744 -0.745 344 HA MET 46 HA MET 46 -9.823 -21.968 -1.562 345 HB2 MET 46 HB2 MET 46 -9.024 -20.262 -3.402 346 HB3 MET 46 HB3 MET 46 -7.460 -21.089 -3.232 347 HG2 MET 46 HG2 MET 46 -8.652 -23.261 -3.662 348 HG3 MET 46 HG3 MET 46 -10.142 -22.353 -3.948 349 HE1 MET 46 HE1 MET 46 -9.371 -20.358 -7.197 350 HE2 MET 46 HE2 MET 46 -10.576 -20.768 -5.946 351 HE3 MET 46 HE3 MET 46 -9.152 -19.784 -5.534 352 H ALA 47 H ALA 47 -7.413 -21.021 0.454 353 HA ALA 47 HA ALA 47 -6.176 -23.718 0.384 354 HB1 ALA 47 HB1 ALA 47 -4.931 -21.096 1.263 355 HB2 ALA 47 HB2 ALA 47 -4.144 -22.692 1.330 356 HB3 ALA 47 HB3 ALA 47 -4.564 -21.981 -0.243 357 H LEU 48 H LEU 48 -7.879 -21.308 2.301 358 HA LEU 48 HA LEU 48 -7.458 -22.658 4.840 359 HB2 LEU 48 HB2 LEU 48 -9.577 -20.766 3.745 360 HB3 LEU 48 HB3 LEU 48 -9.625 -21.400 5.399 361 HG LEU 48 HG LEU 48 -7.244 -19.874 4.267 362 HD11 LEU 48 HD11 LEU 48 -8.126 -17.963 5.566 363 HD12 LEU 48 HD12 LEU 48 -9.241 -18.442 4.271 364 HD13 LEU 48 HD13 LEU 48 -9.584 -18.901 5.952 365 HD21 LEU 48 HD21 LEU 48 -6.719 -21.301 6.210 366 HD22 LEU 48 HD22 LEU 48 -6.725 -19.599 6.693 367 HD23 LEU 48 HD23 LEU 48 -8.106 -20.643 7.092 368 H ILE 49 H ILE 49 -9.678 -23.037 2.073 369 HA ILE 49 HA ILE 49 -11.391 -24.956 3.333 370 HB ILE 49 HB ILE 49 -11.977 -25.608 1.035 371 HG12 ILE 49 HG12 ILE 49 -10.180 -23.375 0.134 372 HG13 ILE 49 HG13 ILE 49 -9.540 -24.990 0.216 373 HG21 ILE 49 HG21 ILE 49 -11.879 -22.587 1.471 374 HG22 ILE 49 HG22 ILE 49 -13.017 -23.459 0.427 375 HG23 ILE 49 HG23 ILE 49 -13.085 -23.676 2.189 376 HD11 ILE 49 HD11 ILE 49 -11.944 -24.298 -1.447 377 HD12 ILE 49 HD12 ILE 49 -10.292 -24.612 -2.040 378 HD13 ILE 49 HD13 ILE 49 -11.182 -25.912 -1.232 379 H LYS 50 H LYS 50 -8.223 -25.051 1.908 380 HA LYS 50 HA LYS 50 -8.340 -27.821 1.100 381 HB2 LYS 50 HB2 LYS 50 -6.905 -25.572 0.384 382 HB3 LYS 50 HB3 LYS 50 -5.707 -26.458 1.328 383 HG2 LYS 50 HG2 LYS 50 -5.310 -27.308 -0.753 384 HG3 LYS 50 HG3 LYS 50 -6.513 -28.496 -0.221 385 HD2 LYS 50 HD2 LYS 50 -7.034 -25.956 -1.818 386 HD3 LYS 50 HD3 LYS 50 -6.875 -27.561 -2.557 387 HE2 LYS 50 HE2 LYS 50 -8.942 -26.806 -0.471 388 HE3 LYS 50 HE3 LYS 50 -9.235 -26.728 -2.217 389 HZ1 LYS 50 HZ1 LYS 50 -8.810 -29.077 -2.365 390 HZ2 LYS 50 HZ2 LYS 50 -8.502 -29.183 -0.750 391 HZ3 LYS 50 HZ3 LYS 50 -10.015 -28.806 -1.280 392 H LEU 51 H LEU 51 -8.255 -26.481 4.064 393 HA LEU 51 HA LEU 51 -6.209 -28.279 5.222 394 HB2 LEU 51 HB2 LEU 51 -5.368 -25.970 4.648 395 HB3 LEU 51 HB3 LEU 51 -6.540 -25.301 5.778 396 HG LEU 51 HG LEU 51 -5.394 -26.356 7.657 397 HD11 LEU 51 HD11 LEU 51 -3.219 -27.591 7.184 398 HD12 LEU 51 HD12 LEU 51 -4.675 -28.468 6.684 399 HD13 LEU 51 HD13 LEU 51 -3.690 -27.619 5.471 400 HD21 LEU 51 HD21 LEU 51 -4.569 -24.205 6.828 401 HD22 LEU 51 HD22 LEU 51 -3.194 -25.185 7.389 402 HD23 LEU 51 HD23 LEU 51 -3.530 -25.019 5.644 403 H GLY 52 H GLY 52 -9.413 -27.083 5.313 404 HA2 GLY 52 HA2 GLY 52 -10.963 -28.226 6.708 405 HA3 GLY 52 HA3 GLY 52 -9.721 -28.426 7.947 406 H GLU 53 H GLU 53 -10.106 -25.240 6.439 407 HA GLU 53 HA GLU 53 -11.569 -24.352 8.877 408 HB2 GLU 53 HB2 GLU 53 -9.451 -22.613 7.593 409 HB3 GLU 53 HB3 GLU 53 -10.230 -22.477 9.150 410 HG2 GLU 53 HG2 GLU 53 -9.148 -24.601 9.890 411 HG3 GLU 53 HG3 GLU 53 -8.273 -24.663 8.345 412 H TYR 54 H TYR 54 -12.998 -25.056 6.691 413 HA TYR 54 HA TYR 54 -13.512 -23.098 4.744 414 HB2 TYR 54 HB2 TYR 54 -15.327 -25.053 6.184 415 HB3 TYR 54 HB3 TYR 54 -15.882 -24.042 4.859 416 HD1 TYR 54 HD1 TYR 54 -13.335 -26.662 5.716 417 HD2 TYR 54 HD2 TYR 54 -15.625 -24.696 2.649 418 HE1 TYR 54 HE1 TYR 54 -12.537 -28.329 4.053 419 HE2 TYR 54 HE2 TYR 54 -14.868 -26.383 0.994 420 HH TYR 54 HH TYR 54 -12.570 -28.996 1.870 421 H THR 55 H THR 55 -14.347 -23.164 8.181 422 HA THR 55 HA THR 55 -16.351 -21.174 8.233 423 HB THR 55 HB THR 55 -14.140 -21.846 10.230 424 HG1 THR 55 HG1 THR 55 -15.779 -23.155 11.119 425 HG21 THR 55 HG21 THR 55 -15.192 -19.712 10.833 426 HG22 THR 55 HG22 THR 55 -16.810 -20.398 10.581 427 HG23 THR 55 HG23 THR 55 -15.784 -20.971 11.924 428 H GLN 56 H GLN 56 -12.898 -20.964 7.696 429 HA GLN 56 HA GLN 56 -12.881 -18.035 8.173 430 HB2 GLN 56 HB2 GLN 56 -10.642 -20.043 7.656 431 HB3 GLN 56 HB3 GLN 56 -10.436 -18.333 8.093 432 HG2 GLN 56 HG2 GLN 56 -11.462 -18.704 10.255 433 HG3 GLN 56 HG3 GLN 56 -11.948 -20.337 9.823 434 HE21 GLN 56 HE22 GLN 56 -10.901 -21.293 11.551 435 HE22 GLN 56 HE21 GLN 56 -9.161 -21.488 11.553 436 H ALA 57 H ALA 57 -13.152 -20.391 5.647 437 HA ALA 57 HA ALA 57 -11.835 -18.796 3.586 438 HB1 ALA 57 HB1 ALA 57 -11.934 -21.280 3.520 439 HB2 ALA 57 HB2 ALA 57 -13.705 -21.202 3.403 440 HB3 ALA 57 HB3 ALA 57 -12.702 -20.546 2.090 441 H ILE 58 H ILE 58 -15.202 -19.451 4.679 442 HA ILE 58 HA ILE 58 -16.460 -17.912 2.542 443 HB ILE 58 HB ILE 58 -17.417 -18.531 5.401 444 HG12 ILE 58 HG12 ILE 58 -17.859 -20.223 2.918 445 HG13 ILE 58 HG13 ILE 58 -16.645 -20.597 4.144 446 HG21 ILE 58 HG21 ILE 58 -18.778 -16.912 3.992 447 HG22 ILE 58 HG22 ILE 58 -19.054 -18.268 2.856 448 HG23 ILE 58 HG23 ILE 58 -19.662 -18.364 4.511 449 HD11 ILE 58 HD11 ILE 58 -19.650 -20.465 4.586 450 HD12 ILE 58 HD12 ILE 58 -18.612 -21.905 4.641 451 HD13 ILE 58 HD13 ILE 58 -18.434 -20.650 5.883 452 H GLN 59 H GLN 59 -15.152 -17.185 5.794 453 HA GLN 59 HA GLN 59 -16.148 -14.462 5.791 454 HB2 GLN 59 HB2 GLN 59 -14.018 -15.878 7.455 455 HB3 GLN 59 HB3 GLN 59 -14.625 -14.242 7.778 456 HG2 GLN 59 HG2 GLN 59 -16.312 -16.780 7.745 457 HG3 GLN 59 HG3 GLN 59 -15.736 -15.955 9.196 458 HE21 GLN 59 HE22 GLN 59 -18.521 -16.524 8.129 459 HE22 GLN 59 HE21 GLN 59 -19.311 -14.959 8.108 460 H MET 60 H MET 60 -13.899 -15.922 3.863 461 HA MET 60 HA MET 60 -12.264 -13.454 3.608 462 HB2 MET 60 HB2 MET 60 -11.109 -15.671 4.210 463 HB3 MET 60 HB3 MET 60 -11.676 -16.289 2.651 464 HG2 MET 60 HG2 MET 60 -9.623 -15.632 2.004 465 HG3 MET 60 HG3 MET 60 -10.465 -14.113 1.735 466 HE1 MET 60 HE1 MET 60 -9.429 -12.280 5.191 467 HE2 MET 60 HE2 MET 60 -10.518 -12.195 3.794 468 HE3 MET 60 HE3 MET 60 -10.795 -13.433 5.039 469 H CYS 61 H CYS 61 -14.339 -15.865 2.001 470 HA CYS 61 HA CYS 61 -13.903 -14.926 -0.664 471 HB2 CYS 61 HB2 CYS 61 -16.222 -16.415 0.702 472 HB3 CYS 61 HB3 CYS 61 -16.180 -16.071 -1.017 473 HG CYS 61 HG CYS 61 -13.910 -17.652 0.753 474 H GLN 62 H GLN 62 -16.343 -14.030 1.876 475 HA GLN 62 HA GLN 62 -17.773 -12.225 0.166 476 HB2 GLN 62 HB2 GLN 62 -17.441 -12.289 3.197 477 HB3 GLN 62 HB3 GLN 62 -18.682 -11.377 2.309 478 HG2 GLN 62 HG2 GLN 62 -19.684 -13.426 1.471 479 HG3 GLN 62 HG3 GLN 62 -18.354 -14.397 2.113 480 HE21 GLN 62 HE22 GLN 62 -20.037 -15.622 3.136 481 HE22 GLN 62 HE21 GLN 62 -20.745 -15.036 4.608 482 H GLN 63 H GLN 63 -14.751 -11.911 2.004 483 HA GLN 63 HA GLN 63 -14.843 -8.981 1.957 484 HB2 GLN 63 HB2 GLN 63 -12.598 -10.945 2.621 485 HB3 GLN 63 HB3 GLN 63 -12.512 -9.184 2.781 486 HG2 GLN 63 HG2 GLN 63 -14.637 -9.390 4.233 487 HG3 GLN 63 HG3 GLN 63 -14.263 -11.120 4.321 488 HE21 GLN 63 HE22 GLN 63 -12.970 -11.729 6.011 489 HE22 GLN 63 HE21 GLN 63 -11.857 -10.670 6.858 490 H GLY 64 H GLY 64 -13.682 -11.565 -0.139 491 HA2 GLY 64 HA2 GLY 64 -11.885 -9.837 -1.658 492 HA3 GLY 64 HA3 GLY 64 -12.399 -11.487 -2.064 493 H LEU 65 H LEU 65 -15.258 -10.985 -1.898 494 HA LEU 65 HA LEU 65 -15.757 -10.046 -4.548 495 HB2 LEU 65 HB2 LEU 65 -17.459 -10.705 -2.131 496 HB3 LEU 65 HB3 LEU 65 -18.191 -10.109 -3.630 497 HG LEU 65 HG LEU 65 -16.348 -12.549 -3.585 498 HD11 LEU 65 HD11 LEU 65 -18.311 -12.923 -2.130 499 HD12 LEU 65 HD12 LEU 65 -19.385 -12.388 -3.438 500 HD13 LEU 65 HD13 LEU 65 -18.421 -13.866 -3.625 501 HD21 LEU 65 HD21 LEU 65 -18.406 -11.515 -5.581 502 HD22 LEU 65 HD22 LEU 65 -16.640 -11.469 -5.782 503 HD23 LEU 65 HD23 LEU 65 -17.484 -13.029 -5.721 504 H ARG 66 H ARG 66 -14.990 -8.245 -1.780 505 HA ARG 66 HA ARG 66 -16.579 -5.872 -2.457 506 HB2 ARG 66 HB2 ARG 66 -14.216 -6.242 -0.577 507 HB3 ARG 66 HB3 ARG 66 -15.298 -4.849 -0.644 508 HG2 ARG 66 HG2 ARG 66 -17.202 -6.318 0.035 509 HG3 ARG 66 HG3 ARG 66 -16.080 -7.692 0.102 510 HD2 ARG 66 HD2 ARG 66 -16.394 -6.826 2.343 511 HD3 ARG 66 HD3 ARG 66 -14.728 -6.502 1.810 512 HE ARG 66 HE ARG 66 -16.519 -4.289 1.238 513 HH11 ARG 66 HH11 ARG 66 -14.614 -5.803 3.796 514 HH12 ARG 66 HH12 ARG 66 -14.444 -4.326 4.713 515 HH21 ARG 66 HH21 ARG 66 -16.299 -2.377 2.448 516 HH22 ARG 66 HH22 ARG 66 -15.398 -2.386 3.945 517 H TYR 67 H TYR 67 -14.024 -7.355 -3.954 518 HA TYR 67 HA TYR 67 -12.718 -4.801 -4.760 519 HB2 TYR 67 HB2 TYR 67 -11.364 -7.361 -3.867 520 HB3 TYR 67 HB3 TYR 67 -10.527 -5.948 -4.506 521 HD1 TYR 67 HD1 TYR 67 -11.159 -3.647 -3.254 522 HD2 TYR 67 HD2 TYR 67 -11.525 -7.590 -1.568 523 HE1 TYR 67 HE1 TYR 67 -11.141 -2.675 -0.968 524 HE2 TYR 67 HE2 TYR 67 -11.514 -6.624 0.716 525 HH TYR 67 HH TYR 67 -11.243 -3.085 1.290 526 H THR 68 H THR 68 -14.377 -7.547 -5.737 527 HA THR 68 HA THR 68 -12.993 -7.823 -8.320 528 HB THR 68 HB THR 68 -14.860 -9.459 -8.746 529 HG1 THR 68 HG1 THR 68 -16.397 -8.574 -7.311 530 HG21 THR 68 HG21 THR 68 -13.984 -11.133 -7.186 531 HG22 THR 68 HG22 THR 68 -12.662 -10.108 -7.808 532 HG23 THR 68 HG23 THR 68 -13.308 -9.852 -6.164 533 H SER 69 H SER 69 -14.305 -5.252 -7.400 534 HA SER 69 HA SER 69 -16.730 -4.850 -8.838 535 HB2 SER 69 HB2 SER 69 -16.298 -2.465 -8.310 536 HB3 SER 69 HB3 SER 69 -16.090 -3.525 -6.900 537 HG SER 69 HG SER 69 -14.367 -2.029 -7.121 538 H THR 70 H THR 70 -13.922 -5.617 -10.322 539 HA THR 70 HA THR 70 -14.564 -3.893 -12.660 540 HB THR 70 HB THR 70 -12.258 -3.399 -13.077 541 HG1 THR 70 HG1 THR 70 -10.648 -4.151 -11.672 542 HG21 THR 70 HG21 THR 70 -11.600 -2.038 -11.157 543 HG22 THR 70 HG22 THR 70 -13.361 -1.905 -11.398 544 HG23 THR 70 HG23 THR 70 -12.705 -2.932 -10.101 545 H ALA 71 H ALA 71 -13.527 -4.732 -14.676 546 HA ALA 71 HA ALA 71 -14.086 -7.534 -14.953 547 HB1 ALA 71 HB1 ALA 71 -12.710 -5.566 -16.834 548 HB2 ALA 71 HB2 ALA 71 -13.377 -7.159 -17.291 549 HB3 ALA 71 HB3 ALA 71 -14.468 -5.865 -16.743 550 H GLU 72 H GLU 72 -11.317 -5.951 -13.752 551 HA GLU 72 HA GLU 72 -9.283 -7.647 -14.875 552 HB2 GLU 72 HB2 GLU 72 -9.297 -5.986 -12.351 553 HB3 GLU 72 HB3 GLU 72 -7.863 -6.671 -13.127 554 HG2 GLU 72 HG2 GLU 72 -9.741 -4.605 -14.354 555 HG3 GLU 72 HG3 GLU 72 -8.142 -4.289 -13.682 556 H HIS 73 H HIS 73 -11.799 -8.407 -12.827 557 HA HIS 73 HA HIS 73 -10.328 -10.720 -11.702 558 HB2 HIS 73 HB2 HIS 73 -12.362 -9.294 -10.013 559 HB3 HIS 73 HB3 HIS 73 -11.048 -10.351 -9.516 560 HD2 HIS 73 HD2 HIS 73 -12.011 -6.753 -9.987 561 HE1 HIS 73 HE1 HIS 73 -7.866 -6.648 -9.079 562 HE2 HIS 73 HE2 HIS 73 -9.971 -5.246 -9.340 563 H VAL 74 H VAL 74 -12.294 -10.244 -13.959 564 HA VAL 74 HA VAL 74 -14.936 -10.748 -13.322 565 HB VAL 74 HB VAL 74 -13.968 -10.115 -15.522 566 HG11 VAL 74 HG11 VAL 74 -13.418 -13.093 -15.832 567 HG12 VAL 74 HG12 VAL 74 -13.210 -11.838 -17.078 568 HG13 VAL 74 HG13 VAL 74 -12.175 -11.833 -15.631 569 HG21 VAL 74 HG21 VAL 74 -15.840 -12.509 -15.618 570 HG22 VAL 74 HG22 VAL 74 -16.323 -10.822 -15.279 571 HG23 VAL 74 HG23 VAL 74 -15.655 -11.263 -16.865 572 H ALA 75 H ALA 75 -12.299 -13.114 -13.314 573 HA ALA 75 HA ALA 75 -14.198 -15.367 -13.102 574 HB1 ALA 75 HB1 ALA 75 -11.164 -15.211 -12.779 575 HB2 ALA 75 HB2 ALA 75 -12.128 -16.701 -12.864 576 HB3 ALA 75 HB3 ALA 75 -12.029 -15.623 -14.278 577 H ILE 76 H ILE 76 -11.916 -13.584 -10.912 578 HA ILE 76 HA ILE 76 -12.458 -15.217 -8.632 579 HB ILE 76 HB ILE 76 -11.644 -12.285 -8.788 580 HG12 ILE 76 HG12 ILE 76 -9.942 -14.804 -8.546 581 HG13 ILE 76 HG13 ILE 76 -10.083 -13.795 -9.979 582 HG21 ILE 76 HG21 ILE 76 -12.470 -12.885 -6.555 583 HG22 ILE 76 HG22 ILE 76 -11.429 -14.338 -6.542 584 HG23 ILE 76 HG23 ILE 76 -10.722 -12.717 -6.503 585 HD11 ILE 76 HD11 ILE 76 -8.037 -13.213 -8.875 586 HD12 ILE 76 HD12 ILE 76 -9.178 -11.854 -8.726 587 HD13 ILE 76 HD13 ILE 76 -8.876 -12.937 -7.342 588 H ARG 77 H ARG 77 -14.187 -12.558 -10.164 589 HA ARG 77 HA ARG 77 -15.961 -11.776 -8.130 590 HB2 ARG 77 HB2 ARG 77 -15.545 -10.709 -10.374 591 HB3 ARG 77 HB3 ARG 77 -16.450 -12.040 -11.121 592 HG2 ARG 77 HG2 ARG 77 -18.465 -11.375 -9.796 593 HG3 ARG 77 HG3 ARG 77 -17.533 -10.012 -9.121 594 HD2 ARG 77 HD2 ARG 77 -17.156 -9.162 -11.411 595 HD3 ARG 77 HD3 ARG 77 -18.010 -10.564 -12.070 596 HE ARG 77 HE ARG 77 -20.065 -9.651 -11.416 597 HH11 ARG 77 HH11 ARG 77 -17.405 -7.634 -10.211 598 HH12 ARG 77 HH12 ARG 77 -18.462 -6.311 -9.796 599 HH21 ARG 77 HH21 ARG 77 -21.400 -7.909 -10.844 600 HH22 ARG 77 HH22 ARG 77 -20.706 -6.451 -10.178 601 H SER 78 H SER 78 -15.762 -14.750 -9.877 602 HA SER 78 HA SER 78 -18.451 -15.590 -8.834 603 HB2 SER 78 HB2 SER 78 -16.938 -16.453 -11.345 604 HB3 SER 78 HB3 SER 78 -18.460 -17.172 -10.761 605 HG SER 78 HG SER 78 -19.438 -15.126 -10.987 606 H LYS 79 H LYS 79 -14.967 -16.259 -8.849 607 HA LYS 79 HA LYS 79 -15.337 -18.984 -7.931 608 HB2 LYS 79 HB2 LYS 79 -12.979 -17.063 -7.901 609 HB3 LYS 79 HB3 LYS 79 -12.901 -18.699 -7.254 610 HG2 LYS 79 HG2 LYS 79 -13.425 -17.924 -10.147 611 HG3 LYS 79 HG3 LYS 79 -12.001 -18.724 -9.480 612 HD2 LYS 79 HD2 LYS 79 -14.782 -19.850 -9.877 613 HD3 LYS 79 HD3 LYS 79 -13.240 -20.436 -10.521 614 HE2 LYS 79 HE2 LYS 79 -12.565 -20.862 -8.061 615 HE3 LYS 79 HE3 LYS 79 -14.279 -20.594 -7.669 616 HZ1 LYS 79 HZ1 LYS 79 -14.846 -22.389 -9.159 617 HZ2 LYS 79 HZ2 LYS 79 -13.267 -22.635 -9.547 618 HZ3 LYS 79 HZ3 LYS 79 -13.791 -22.921 -8.016 619 H LEU 80 H LEU 80 -15.164 -15.761 -6.352 620 HA LEU 80 HA LEU 80 -14.954 -17.039 -3.721 621 HB2 LEU 80 HB2 LEU 80 -15.431 -14.150 -4.526 622 HB3 LEU 80 HB3 LEU 80 -14.980 -14.737 -2.908 623 HG LEU 80 HG LEU 80 -13.316 -14.795 -5.453 624 HD11 LEU 80 HD11 LEU 80 -12.898 -13.515 -2.729 625 HD12 LEU 80 HD12 LEU 80 -11.774 -13.415 -4.111 626 HD13 LEU 80 HD13 LEU 80 -13.379 -12.663 -4.216 627 HD21 LEU 80 HD21 LEU 80 -12.659 -16.037 -2.766 628 HD22 LEU 80 HD22 LEU 80 -12.956 -16.920 -4.284 629 HD23 LEU 80 HD23 LEU 80 -11.552 -15.868 -4.155 630 H GLN 81 H GLN 81 -17.297 -17.007 -5.934 631 HA GLN 81 HA GLN 81 -19.458 -16.839 -3.899 632 HB2 GLN 81 HB2 GLN 81 -19.216 -16.238 -6.831 633 HB3 GLN 81 HB3 GLN 81 -20.678 -17.055 -6.349 634 HG2 GLN 81 HG2 GLN 81 -19.694 -14.367 -5.365 635 HG3 GLN 81 HG3 GLN 81 -21.184 -14.736 -6.255 636 HE21 GLN 81 HE22 GLN 81 -22.047 -17.057 -4.741 637 HE22 GLN 81 HE21 GLN 81 -22.433 -16.505 -3.118 638 H TYR 82 H TYR 82 -17.904 -18.757 -6.483 639 HA TYR 82 HA TYR 82 -19.699 -20.966 -6.455 640 HB2 TYR 82 HB2 TYR 82 -18.041 -20.584 -8.242 641 HB3 TYR 82 HB3 TYR 82 -16.741 -20.579 -7.077 642 HD1 TYR 82 HD2 TYR 82 -19.173 -22.725 -8.871 643 HD2 TYR 82 HD1 TYR 82 -15.773 -22.632 -6.227 644 HE1 TYR 82 HE2 TYR 82 -18.849 -25.166 -9.201 645 HE2 TYR 82 HE1 TYR 82 -15.448 -25.068 -6.550 646 HH TYR 82 HH TYR 82 -16.199 -26.971 -7.591 647 H ARG 83 H ARG 83 -16.658 -20.365 -4.541 648 HA ARG 83 HA ARG 83 -17.039 -22.974 -3.283 649 HB2 ARG 83 HB2 ARG 83 -14.782 -21.892 -3.852 650 HB3 ARG 83 HB3 ARG 83 -15.050 -20.835 -2.459 651 HG2 ARG 83 HG2 ARG 83 -13.660 -22.760 -1.838 652 HG3 ARG 83 HG3 ARG 83 -15.217 -22.843 -0.986 653 HD2 ARG 83 HD2 ARG 83 -16.046 -24.479 -2.651 654 HD3 ARG 83 HD3 ARG 83 -14.527 -24.334 -3.555 655 HE ARG 83 HE ARG 83 -14.009 -25.115 -0.842 656 HH11 ARG 83 HH11 ARG 83 -15.267 -26.340 -3.899 657 HH12 ARG 83 HH12 ARG 83 -14.824 -27.999 -3.569 658 HH21 ARG 83 HH21 ARG 83 -13.449 -27.319 -0.417 659 HH22 ARG 83 HH22 ARG 83 -13.804 -28.538 -1.613 660 H LEU 84 H LEU 84 -17.859 -19.640 -2.629 661 HA LEU 84 HA LEU 84 -18.496 -19.930 0.154 662 HB2 LEU 84 HB2 LEU 84 -18.156 -17.858 -1.339 663 HB3 LEU 84 HB3 LEU 84 -19.804 -18.101 -1.903 664 HG LEU 84 HG LEU 84 -18.915 -17.553 0.928 665 HD11 LEU 84 HD11 LEU 84 -20.035 -15.386 0.586 666 HD12 LEU 84 HD12 LEU 84 -18.677 -15.632 -0.530 667 HD13 LEU 84 HD13 LEU 84 -20.357 -15.836 -1.104 668 HD21 LEU 84 HD21 LEU 84 -21.369 -17.129 1.340 669 HD22 LEU 84 HD22 LEU 84 -21.701 -17.944 -0.202 670 HD23 LEU 84 HD23 LEU 84 -20.927 -18.823 1.144 671 H GLU 85 H GLU 85 -20.177 -20.410 -2.905 672 HA GLU 85 HA GLU 85 -22.745 -21.217 -1.910 673 HB2 GLU 85 HB2 GLU 85 -21.237 -21.259 -4.516 674 HB3 GLU 85 HB3 GLU 85 -22.728 -22.156 -4.421 675 HG2 GLU 85 HG2 GLU 85 -23.986 -20.191 -3.729 676 HG3 GLU 85 HG3 GLU 85 -22.492 -19.246 -3.581 677 H LEU 86 H LEU 86 -19.848 -22.829 -1.493 678 HA LEU 86 HA LEU 86 -21.270 -25.455 -1.415 679 HB2 LEU 86 HB2 LEU 86 -18.501 -24.884 -2.535 680 HB3 LEU 86 HB3 LEU 86 -19.117 -26.503 -2.189 681 HG LEU 86 HG LEU 86 -20.407 -24.567 -4.153 682 HD11 LEU 86 HD11 LEU 86 -18.626 -26.997 -4.608 683 HD12 LEU 86 HD12 LEU 86 -19.443 -26.047 -5.874 684 HD13 LEU 86 HD13 LEU 86 -18.169 -25.305 -4.890 685 HD21 LEU 86 HD21 LEU 86 -21.994 -26.218 -3.226 686 HD22 LEU 86 HD22 LEU 86 -21.610 -26.590 -4.913 687 HD23 LEU 86 HD23 LEU 86 -20.862 -27.535 -3.602 688 H ALA 87 H ALA 87 -19.117 -23.169 0.119 689 HA ALA 87 HA ALA 87 -17.851 -24.993 1.935 690 HB1 ALA 87 HB1 ALA 87 -17.322 -22.921 3.168 691 HB2 ALA 87 HB2 ALA 87 -16.999 -22.727 1.437 692 HB3 ALA 87 HB3 ALA 87 -18.472 -22.021 2.144 693 H GLN 88 H GLN 88 -21.013 -23.489 1.790 694 HA GLN 88 HA GLN 88 -21.701 -23.745 4.567 695 HB2 GLN 88 HB2 GLN 88 -23.408 -23.488 2.056 696 HB3 GLN 88 HB3 GLN 88 -23.969 -23.251 3.714 697 HG2 GLN 88 HG2 GLN 88 -22.395 -21.355 3.996 698 HG3 GLN 88 HG3 GLN 88 -21.780 -21.617 2.358 699 HE21 GLN 88 HE22 GLN 88 -22.569 -20.227 0.901 700 HE22 GLN 88 HE21 GLN 88 -24.171 -19.517 0.933 701 H GLY 89 H GLY 89 -20.925 -26.126 2.463 702 HA2 GLY 89 HA2 GLY 89 -22.661 -28.114 3.807 703 HA3 GLY 89 HA3 GLY 89 -22.616 -28.072 2.032 704 H ALA 90 H ALA 90 -19.723 -27.158 3.742 705 HA ALA 90 HA ALA 90 -18.553 -29.870 3.452 706 HB1 ALA 90 HB1 ALA 90 -17.398 -27.301 2.291 707 HB2 ALA 90 HB2 ALA 90 -16.593 -28.884 2.294 708 HB3 ALA 90 HB3 ALA 90 -18.085 -28.645 1.357 709 H VAL 91 H VAL 91 -18.874 -26.888 5.163 710 HA VAL 91 HA VAL 91 -16.444 -26.957 6.684 711 HB VAL 91 HB VAL 91 -17.971 -25.026 6.339 712 HG11 VAL 91 HG11 VAL 91 -19.760 -26.401 8.375 713 HG12 VAL 91 HG12 VAL 91 -19.979 -24.766 7.712 714 HG13 VAL 91 HG13 VAL 91 -20.139 -26.175 6.651 715 HG21 VAL 91 HG21 VAL 91 -17.727 -24.062 8.553 716 HG22 VAL 91 HG22 VAL 91 -17.564 -25.673 9.280 717 HG23 VAL 91 HG23 VAL 91 -16.298 -25.058 8.196 718 H GLY 92 H GLY 92 -19.226 -28.902 6.680 719 HA2 GLY 92 HA2 GLY 92 -18.746 -29.900 9.460 720 HA3 GLY 92 HA3 GLY 92 -20.306 -29.967 8.610 721 H SER 93 H SER 93 -17.201 -30.691 7.056 722 HA SER 93 HA SER 93 -17.837 -33.602 7.063 723 HB2 SER 93 HB2 SER 93 -17.227 -31.901 4.608 724 HB3 SER 93 HB3 SER 93 -17.346 -33.675 4.636 725 HG SER 93 HG SER 93 -19.409 -31.834 5.338 726 H VAL 94 H VAL 94 -15.892 -34.673 5.701 727 HA VAL 94 HA VAL 94 -13.333 -33.533 6.636 728 HB VAL 94 HB VAL 94 -14.239 -34.981 8.412 729 HG11 VAL 94 HG11 VAL 94 -14.000 -37.269 6.421 730 HG12 VAL 94 HG12 VAL 94 -14.406 -37.396 8.140 731 HG13 VAL 94 HG13 VAL 94 -15.524 -36.575 7.027 732 HG21 VAL 94 HG21 VAL 94 -11.797 -34.745 8.108 733 HG22 VAL 94 HG22 VAL 94 -12.263 -36.308 8.813 734 HG23 VAL 94 HG23 VAL 94 -11.792 -36.213 7.107 735 H GLN 95 H GLN 95 -14.200 -33.333 4.154 736 HA GLN 95 HA GLN 95 -13.567 -35.363 2.319 737 HB2 GLN 95 HB2 GLN 95 -13.520 -33.548 0.685 738 HB3 GLN 95 HB3 GLN 95 -14.899 -33.371 1.783 739 HG2 GLN 95 HG2 GLN 95 -12.265 -31.891 2.191 740 HG3 GLN 95 HG3 GLN 95 -13.595 -31.242 1.225 741 HE21 GLN 95 HE22 GLN 95 -15.737 -30.972 2.326 742 HE22 GLN 95 HE21 GLN 95 -15.702 -30.502 4.015 743 H ILE 96 H ILE 96 -11.386 -34.048 4.451 744 HA ILE 96 HA ILE 96 -9.089 -34.761 2.727 745 HB ILE 96 HB ILE 96 -7.874 -32.761 3.725 746 HG12 ILE 96 HG12 ILE 96 -10.699 -31.779 4.271 747 HG13 ILE 96 HG13 ILE 96 -9.522 -32.272 5.507 748 HG21 ILE 96 HG21 ILE 96 -10.153 -32.115 1.825 749 HG22 ILE 96 HG22 ILE 96 -8.610 -31.247 1.978 750 HG23 ILE 96 HG23 ILE 96 -8.629 -32.905 1.368 751 HD11 ILE 96 HD11 ILE 96 -9.230 -29.954 3.557 752 HD12 ILE 96 HD12 ILE 96 -9.524 -29.860 5.299 753 HD13 ILE 96 HD13 ILE 96 -7.976 -30.492 4.700 754 HA PRO 97 HA PRO 97 -7.809 -36.821 6.385 755 HB2 PRO 97 HB2 PRO 97 -5.076 -36.652 6.325 756 HB3 PRO 97 HB3 PRO 97 -6.030 -37.638 5.167 757 HG2 PRO 97 HG2 PRO 97 -4.954 -34.834 4.776 758 HG3 PRO 97 HG3 PRO 97 -4.803 -36.243 3.671 759 HD2 PRO 97 HD2 PRO 97 -6.727 -34.364 3.315 760 HD3 PRO 97 HD3 PRO 97 -7.087 -36.091 3.037 761 H VAL 98 H VAL 98 -6.586 -36.629 8.432 762 HA VAL 98 HA VAL 98 -6.147 -33.861 9.364 763 HB VAL 98 HB VAL 98 -7.612 -34.239 11.328 764 HG11 VAL 98 HG11 VAL 98 -9.110 -34.492 8.694 765 HG12 VAL 98 HG12 VAL 98 -9.742 -33.843 10.222 766 HG13 VAL 98 HG13 VAL 98 -8.446 -32.986 9.362 767 HG21 VAL 98 HG21 VAL 98 -7.656 -36.730 11.278 768 HG22 VAL 98 HG22 VAL 98 -9.286 -36.039 11.291 769 HG23 VAL 98 HG23 VAL 98 -8.609 -36.669 9.775 770 H VAL 99 H VAL 99 -5.283 -37.067 9.200 771 HA VAL 99 HA VAL 99 -3.936 -38.467 10.305 772 HB VAL 99 HB VAL 99 -1.684 -37.578 10.608 773 HG11 VAL 99 HG11 VAL 99 -2.580 -38.086 8.364 774 HG12 VAL 99 HG12 VAL 99 -3.190 -36.416 8.224 775 HG13 VAL 99 HG13 VAL 99 -1.434 -36.720 8.308 776 HG21 VAL 99 HG21 VAL 99 -1.177 -35.220 10.279 777 HG22 VAL 99 HG22 VAL 99 -2.898 -34.828 10.121 778 HG23 VAL 99 HG23 VAL 99 -2.253 -35.395 11.679 779 H GLU 100 H GLU 100 -5.963 -37.382 12.150 780 HA GLU 100 HA GLU 100 -4.530 -38.137 14.624 781 HB2 GLU 100 HB2 GLU 100 -5.556 -36.387 15.877 782 HB3 GLU 100 HB3 GLU 100 -4.801 -35.654 14.443 783 HG2 GLU 100 HG2 GLU 100 -7.000 -35.586 13.315 784 HG3 GLU 100 HG3 GLU 100 -7.760 -36.301 14.748 785 H VAL 101 H VAL 101 -6.077 -38.835 16.347 786 HA VAL 101 HA VAL 101 -8.680 -39.824 15.382 787 HB VAL 101 HB VAL 101 -6.478 -41.645 16.457 788 HG11 VAL 101 HG11 VAL 101 -8.663 -42.415 17.226 789 HG12 VAL 101 HG12 VAL 101 -9.334 -42.240 15.581 790 HG13 VAL 101 HG13 VAL 101 -8.100 -43.473 15.925 791 HG21 VAL 101 HG21 VAL 101 -6.058 -41.101 14.103 792 HG22 VAL 101 HG22 VAL 101 -6.635 -42.770 14.246 793 HG23 VAL 101 HG23 VAL 101 -7.745 -41.497 13.695 794 H ASP 102 H ASP 102 -10.052 -40.501 17.154 795 HA ASP 102 HA ASP 102 -9.081 -40.068 19.894 796 HB2 ASP 102 HB2 ASP 102 -9.877 -37.870 18.991 797 HB3 ASP 102 HB3 ASP 102 -11.462 -38.610 18.728 798 H GLU 103 H GLU 103 -10.726 -40.795 21.506 799 HA GLU 103 HA GLU 103 -11.899 -43.304 20.647 800 HB2 GLU 103 HB2 GLU 103 -12.163 -41.896 23.315 801 HB3 GLU 103 HB3 GLU 103 -12.463 -43.602 22.979 802 HG2 GLU 103 HG2 GLU 103 -9.768 -42.193 22.771 803 HG3 GLU 103 HG3 GLU 103 -10.274 -43.328 24.025 804 H LEU 104 H LEU 104 -14.149 -43.702 21.923 805 HA LEU 104 HA LEU 104 -16.116 -42.216 20.369 806 HB2 LEU 104 HB2 LEU 104 -16.660 -44.216 22.573 807 HB3 LEU 104 HB3 LEU 104 -17.677 -43.835 21.192 808 HG LEU 104 HG LEU 104 -15.000 -45.268 21.057 809 HD11 LEU 104 HD11 LEU 104 -17.857 -46.223 20.605 810 HD12 LEU 104 HD12 LEU 104 -16.382 -47.187 20.361 811 HD13 LEU 104 HD13 LEU 104 -16.825 -46.631 21.991 812 HD21 LEU 104 HD21 LEU 104 -15.594 -45.614 18.670 813 HD22 LEU 104 HD22 LEU 104 -17.021 -44.581 18.881 814 HD23 LEU 104 HD23 LEU 104 -15.389 -43.891 19.038 815 HA PRO 105 HA PRO 105 -17.218 -39.293 23.443 816 HB2 PRO 105 HB2 PRO 105 -19.875 -38.839 23.082 817 HB3 PRO 105 HB3 PRO 105 -18.680 -38.537 21.780 818 HG2 PRO 105 HG2 PRO 105 -20.445 -40.966 22.160 819 HG3 PRO 105 HG3 PRO 105 -20.159 -40.023 20.660 820 HD2 PRO 105 HD2 PRO 105 -18.838 -42.338 21.321 821 HD3 PRO 105 HD3 PRO 105 -18.089 -41.085 20.304 822 H GLU 106 H GLU 106 -17.658 -42.384 24.134 823 HA GLU 106 HA GLU 106 -18.450 -43.643 25.831 824 HB2 GLU 106 HB2 GLU 106 -16.921 -41.916 26.937 825 HB3 GLU 106 HB3 GLU 106 -18.391 -41.127 27.524 826 HG2 GLU 106 HG2 GLU 106 -19.044 -43.241 28.679 827 HG3 GLU 106 HG3 GLU 106 -17.617 -44.042 28.006 828 H GLY 107 H GLY 107 -20.417 -42.232 24.102 829 HA2 GLY 107 HA2 GLY 107 -22.816 -42.890 25.656 830 HA3 GLY 107 HA3 GLY 107 -22.686 -41.203 25.097 831 H TYR 108 H TYR 108 -21.185 -43.693 23.186 832 HA TYR 108 HA TYR 108 -22.618 -43.076 20.826 833 HB2 TYR 108 HB2 TYR 108 -21.414 -45.018 19.901 834 HB3 TYR 108 HB3 TYR 108 -20.371 -43.893 20.765 835 HD1 TYR 108 HD2 TYR 108 -19.430 -44.450 22.981 836 HD2 TYR 108 HD1 TYR 108 -21.740 -47.275 20.709 837 HE1 TYR 108 HE2 TYR 108 -18.565 -46.294 24.409 838 HE2 TYR 108 HE1 TYR 108 -20.901 -49.120 22.143 839 HH TYR 108 HH TYR 108 -19.535 -49.711 23.892 840 H ASP 109 H ASP 109 -23.579 -44.986 19.472 841 HA ASP 109 HA ASP 109 -26.107 -45.441 20.728 842 HB2 ASP 109 HB2 ASP 109 -25.031 -46.359 18.055 843 HB3 ASP 109 HB3 ASP 109 -26.737 -46.377 18.525 844 H ARG 110 H ARG 110 -23.685 -47.028 21.704 845 HA ARG 110 HA ARG 110 -25.113 -49.556 22.026 846 HB2 ARG 110 HB2 ARG 110 -23.869 -49.744 19.872 847 HB3 ARG 110 HB3 ARG 110 -22.370 -49.540 20.767 848 HG2 ARG 110 HG2 ARG 110 -22.841 -51.906 20.244 849 HG3 ARG 110 HG3 ARG 110 -22.792 -51.652 21.990 850 HD2 ARG 110 HD2 ARG 110 -25.259 -51.595 22.068 851 HD3 ARG 110 HD3 ARG 110 -25.330 -51.734 20.301 852 HE ARG 110 HE ARG 110 -23.819 -53.909 21.378 853 HH11 ARG 110 HH11 ARG 110 -27.141 -52.714 21.202 854 HH12 ARG 110 HH12 ARG 110 -27.849 -54.306 21.306 855 HH21 ARG 110 HH21 ARG 110 -24.771 -55.978 21.501 856 HH22 ARG 110 HH22 ARG 110 -26.508 -56.146 21.485 857 H SER 111 H SER 111 -23.712 -47.101 23.467 858 HA SER 111 HA SER 111 -21.694 -48.126 25.156 859 HB2 SER 111 HB2 SER 111 -22.263 -46.215 26.611 860 HB3 SER 111 HB3 SER 111 -22.125 -45.740 24.909 861 HG SER 111 HG SER 111 -24.565 -46.357 26.249 Start of MODEL 11 1 H1 SER 2 H1 SER 2 5.595 -5.899 -8.391 2 H2 SER 2 H2 SER 2 5.047 -4.355 -8.248 3 H3 SER 2 H3 SER 2 4.121 -5.614 -7.734 4 HA SER 2 HA SER 2 6.676 -4.773 -6.572 5 HB2 SER 2 HB2 SER 2 5.337 -4.095 -4.629 6 HB3 SER 2 HB3 SER 2 4.800 -3.244 -6.092 7 HG SER 2 HG SER 2 3.040 -4.099 -4.906 8 H GLN 3 H GLN 3 6.550 -5.762 -4.126 9 HA GLN 3 HA GLN 3 7.018 -8.532 -4.396 10 HB2 GLN 3 HB2 GLN 3 7.959 -7.010 -2.667 11 HB3 GLN 3 HB3 GLN 3 6.371 -6.943 -1.882 12 HG2 GLN 3 HG2 GLN 3 6.463 -9.376 -1.470 13 HG3 GLN 3 HG3 GLN 3 7.985 -9.487 -2.360 14 HE21 GLN 3 HE22 GLN 3 8.963 -10.418 -0.441 15 HE22 GLN 3 HE21 GLN 3 9.438 -9.384 0.891 16 H PHE 4 H PHE 4 4.013 -6.808 -4.024 17 HA PHE 4 HA PHE 4 2.369 -8.698 -2.730 18 HB2 PHE 4 HB2 PHE 4 1.782 -6.378 -3.363 19 HB3 PHE 4 HB3 PHE 4 1.788 -6.827 -5.059 20 HD1 PHE 4 HD1 PHE 4 0.134 -8.754 -5.780 21 HD2 PHE 4 HD2 PHE 4 -0.242 -6.446 -2.179 22 HE1 PHE 4 HE1 PHE 4 -2.222 -9.426 -5.610 23 HE2 PHE 4 HE2 PHE 4 -2.644 -7.056 -2.044 24 HZ PHE 4 HZ PHE 4 -3.640 -8.552 -3.752 25 H GLU 5 H GLU 5 3.647 -8.546 -6.019 26 HA GLU 5 HA GLU 5 1.974 -10.835 -6.884 27 HB2 GLU 5 HB2 GLU 5 3.815 -8.939 -8.390 28 HB3 GLU 5 HB3 GLU 5 2.882 -10.258 -9.125 29 HG2 GLU 5 HG2 GLU 5 0.781 -9.253 -8.333 30 HG3 GLU 5 HG3 GLU 5 1.683 -7.948 -7.551 31 H LYS 6 H LYS 6 4.666 -10.734 -5.100 32 HA LYS 6 HA LYS 6 6.003 -12.939 -6.585 33 HB2 LYS 6 HB2 LYS 6 7.259 -10.794 -6.403 34 HB3 LYS 6 HB3 LYS 6 7.152 -10.950 -4.641 35 HG2 LYS 6 HG2 LYS 6 9.287 -11.717 -5.398 36 HG3 LYS 6 HG3 LYS 6 8.388 -13.114 -4.784 37 HD2 LYS 6 HD2 LYS 6 7.811 -13.779 -7.087 38 HD3 LYS 6 HD3 LYS 6 8.604 -12.319 -7.723 39 HE2 LYS 6 HE2 LYS 6 10.760 -13.091 -6.771 40 HE3 LYS 6 HE3 LYS 6 9.971 -14.549 -6.152 41 HZ1 LYS 6 HZ1 LYS 6 9.447 -15.149 -8.424 42 HZ2 LYS 6 HZ2 LYS 6 10.187 -13.794 -8.990 43 HZ3 LYS 6 HZ3 LYS 6 11.071 -14.957 -8.242 44 H GLN 7 H GLN 7 5.488 -11.673 -3.200 45 HA GLN 7 HA GLN 7 6.138 -14.163 -2.005 46 HB2 GLN 7 HB2 GLN 7 5.553 -11.588 -1.172 47 HB3 GLN 7 HB3 GLN 7 4.123 -12.471 -0.626 48 HG2 GLN 7 HG2 GLN 7 7.030 -13.165 -0.030 49 HG3 GLN 7 HG3 GLN 7 5.870 -12.450 1.110 50 HE21 GLN 7 HE22 GLN 7 3.691 -13.813 1.237 51 HE22 GLN 7 HE21 GLN 7 3.915 -15.530 1.377 52 H LYS 8 H LYS 8 3.187 -12.863 -3.387 53 HA LYS 8 HA LYS 8 1.275 -14.712 -2.342 54 HB2 LYS 8 HB2 LYS 8 0.896 -12.434 -3.289 55 HB3 LYS 8 HB3 LYS 8 1.390 -13.043 -4.832 56 HG2 LYS 8 HG2 LYS 8 -0.612 -14.721 -4.569 57 HG3 LYS 8 HG3 LYS 8 -1.157 -13.634 -3.299 58 HD2 LYS 8 HD2 LYS 8 -2.182 -13.052 -5.428 59 HD3 LYS 8 HD3 LYS 8 -1.073 -11.746 -4.963 60 HE2 LYS 8 HE2 LYS 8 0.625 -12.518 -6.488 61 HE3 LYS 8 HE3 LYS 8 -0.180 -14.067 -6.713 62 HZ1 LYS 8 HZ1 LYS 8 -0.527 -12.593 -8.585 63 HZ2 LYS 8 HZ2 LYS 8 -1.962 -12.896 -7.849 64 HZ3 LYS 8 HZ3 LYS 8 -1.210 -11.444 -7.620 65 H GLU 9 H GLU 9 3.707 -15.027 -4.783 66 HA GLU 9 HA GLU 9 2.292 -17.388 -5.960 67 HB2 GLU 9 HB2 GLU 9 4.231 -15.354 -7.062 68 HB3 GLU 9 HB3 GLU 9 3.846 -16.862 -7.922 69 HG2 GLU 9 HG2 GLU 9 1.872 -14.694 -7.095 70 HG3 GLU 9 HG3 GLU 9 2.499 -14.954 -8.732 71 H GLN 10 H GLN 10 5.101 -16.301 -4.192 72 HA GLN 10 HA GLN 10 6.812 -18.530 -4.834 73 HB2 GLN 10 HB2 GLN 10 6.723 -16.454 -2.637 74 HB3 GLN 10 HB3 GLN 10 7.910 -17.767 -2.618 75 HG2 GLN 10 HG2 GLN 10 8.753 -17.108 -4.814 76 HG3 GLN 10 HG3 GLN 10 7.575 -15.794 -4.918 77 HE21 GLN 10 HE22 GLN 10 10.732 -16.158 -4.523 78 HE22 GLN 10 HE21 GLN 10 11.084 -14.920 -3.343 79 H GLY 11 H GLY 11 3.836 -18.637 -3.444 80 HA2 GLY 11 HA2 GLY 11 4.572 -21.050 -1.866 81 HA3 GLY 11 HA3 GLY 11 3.408 -19.893 -1.241 82 H ASN 12 H ASN 12 3.042 -19.997 -4.623 83 HA ASN 12 HA ASN 12 0.553 -21.383 -4.454 84 HB2 ASN 12 HB2 ASN 12 0.323 -20.891 -6.666 85 HB3 ASN 12 HB3 ASN 12 1.591 -19.733 -6.279 86 HD21 ASN 12 HD22 ASN 12 3.756 -20.198 -6.985 87 HD22 ASN 12 HD21 ASN 12 4.023 -21.347 -8.283 88 H SER 13 H SER 13 3.867 -22.417 -4.961 89 HA SER 13 HA SER 13 3.152 -25.089 -5.847 90 HB2 SER 13 HB2 SER 13 5.588 -25.511 -5.528 91 HB3 SER 13 HB3 SER 13 5.270 -24.080 -6.535 92 HG SER 13 HG SER 13 6.849 -23.676 -4.911 93 H LEU 14 H LEU 14 3.973 -23.484 -2.743 94 HA LEU 14 HA LEU 14 4.254 -25.827 -1.171 95 HB2 LEU 14 HB2 LEU 14 3.219 -23.036 -0.495 96 HB3 LEU 14 HB3 LEU 14 3.734 -24.236 0.675 97 HG LEU 14 HG LEU 14 5.508 -22.942 -1.421 98 HD11 LEU 14 HD11 LEU 14 5.405 -22.688 1.612 99 HD12 LEU 14 HD12 LEU 14 6.568 -21.879 0.532 100 HD13 LEU 14 HD13 LEU 14 4.843 -21.460 0.449 101 HD21 LEU 14 HD21 LEU 14 7.356 -24.068 -0.206 102 HD22 LEU 14 HD22 LEU 14 6.163 -24.950 0.766 103 HD23 LEU 14 HD23 LEU 14 6.270 -25.223 -0.990 104 H PHE 15 H PHE 15 1.431 -23.949 -2.258 105 HA PHE 15 HA PHE 15 -0.560 -25.232 -0.682 106 HB2 PHE 15 HB2 PHE 15 -1.002 -23.164 -1.867 107 HB3 PHE 15 HB3 PHE 15 -0.532 -23.890 -3.400 108 HD1 PHE 15 HD2 PHE 15 -2.932 -24.848 -0.645 109 HD2 PHE 15 HD1 PHE 15 -2.241 -24.219 -4.834 110 HE1 PHE 15 HE2 PHE 15 -5.288 -25.461 -1.118 111 HE2 PHE 15 HE1 PHE 15 -4.640 -24.765 -5.306 112 HZ PHE 15 HZ PHE 15 -6.149 -25.383 -3.438 113 H LYS 16 H LYS 16 1.326 -26.340 -3.348 114 HA LYS 16 HA LYS 16 -0.613 -28.510 -3.959 115 HB2 LYS 16 HB2 LYS 16 1.723 -27.430 -5.579 116 HB3 LYS 16 HB3 LYS 16 0.559 -28.671 -6.111 117 HG2 LYS 16 HG2 LYS 16 -1.285 -27.082 -5.975 118 HG3 LYS 16 HG3 LYS 16 -0.236 -25.859 -5.235 119 HD2 LYS 16 HD2 LYS 16 1.162 -25.852 -7.321 120 HD3 LYS 16 HD3 LYS 16 -0.080 -26.885 -8.083 121 HE2 LYS 16 HE2 LYS 16 -1.792 -25.144 -7.462 122 HE3 LYS 16 HE3 LYS 16 -0.476 -24.125 -6.839 123 HZ1 LYS 16 HZ1 LYS 16 -1.083 -23.537 -9.085 124 HZ2 LYS 16 HZ2 LYS 16 0.474 -24.061 -9.015 125 HZ3 LYS 16 HZ3 LYS 16 -0.696 -25.041 -9.628 126 H GLN 17 H GLN 17 2.215 -27.946 -2.169 127 HA GLN 17 HA GLN 17 3.422 -30.581 -2.610 128 HB2 GLN 17 HB2 GLN 17 3.939 -28.395 -0.584 129 HB3 GLN 17 HB3 GLN 17 4.782 -29.953 -0.632 130 HG2 GLN 17 HG2 GLN 17 5.279 -29.420 -3.121 131 HG3 GLN 17 HG3 GLN 17 4.833 -27.755 -2.708 132 HE21 GLN 17 HE22 GLN 17 5.803 -27.472 -0.139 133 HE22 GLN 17 HE21 GLN 17 7.538 -27.619 -0.153 134 H GLY 18 H GLY 18 0.824 -29.308 -0.612 135 HA2 GLY 18 HA2 GLY 18 -0.681 -30.753 0.478 136 HA3 GLY 18 HA3 GLY 18 0.576 -31.985 0.627 137 H LEU 19 H LEU 19 1.248 -28.623 1.459 138 HA LEU 19 HA LEU 19 0.985 -29.196 4.349 139 HB2 LEU 19 HB2 LEU 19 3.198 -27.964 4.645 140 HB3 LEU 19 HB3 LEU 19 3.217 -29.647 4.116 141 HG LEU 19 HG LEU 19 3.613 -28.960 1.788 142 HD11 LEU 19 HD11 LEU 19 3.837 -26.161 2.958 143 HD12 LEU 19 HD12 LEU 19 4.262 -26.636 1.295 144 HD13 LEU 19 HD13 LEU 19 2.576 -26.721 1.841 145 HD21 LEU 19 HD21 LEU 19 5.478 -29.473 3.310 146 HD22 LEU 19 HD22 LEU 19 5.939 -28.199 2.152 147 HD23 LEU 19 HD23 LEU 19 5.526 -27.772 3.831 148 H TYR 20 H TYR 20 -0.993 -28.056 3.347 149 HA TYR 20 HA TYR 20 -1.055 -25.523 2.321 150 HB2 TYR 20 HB2 TYR 20 -3.113 -26.621 4.250 151 HB3 TYR 20 HB3 TYR 20 -3.367 -25.522 2.887 152 HD1 TYR 20 HD2 TYR 20 -1.996 -26.797 0.645 153 HD2 TYR 20 HD1 TYR 20 -4.255 -28.573 3.856 154 HE1 TYR 20 HE2 TYR 20 -2.520 -28.744 -0.786 155 HE2 TYR 20 HE1 TYR 20 -4.789 -30.514 2.412 156 HH TYR 20 HH TYR 20 -4.484 -31.512 0.367 157 H ARG 21 H ARG 21 -0.441 -26.316 5.695 158 HA ARG 21 HA ARG 21 -1.369 -23.965 6.940 159 HB2 ARG 21 HB2 ARG 21 -0.627 -25.994 8.121 160 HB3 ARG 21 HB3 ARG 21 1.028 -25.763 7.532 161 HG2 ARG 21 HG2 ARG 21 0.750 -25.049 9.885 162 HG3 ARG 21 HG3 ARG 21 1.289 -23.726 8.833 163 HD2 ARG 21 HD2 ARG 21 -0.998 -22.853 8.706 164 HD3 ARG 21 HD3 ARG 21 -1.601 -24.205 9.678 165 HE ARG 21 HE ARG 21 -0.109 -21.839 10.597 166 HH11 ARG 21 HH11 ARG 21 -1.272 -25.080 11.415 167 HH12 ARG 21 HH12 ARG 21 -1.136 -24.815 13.137 168 HH21 ARG 21 HH21 ARG 21 0.033 -21.527 12.853 169 HH22 ARG 21 HH22 ARG 21 -0.416 -22.814 13.939 170 H GLU 22 H GLU 22 1.468 -24.487 4.930 171 HA GLU 22 HA GLU 22 2.729 -21.935 5.671 172 HB2 GLU 22 HB2 GLU 22 3.220 -23.841 3.352 173 HB3 GLU 22 HB3 GLU 22 4.335 -22.594 3.928 174 HG2 GLU 22 HG2 GLU 22 3.383 -24.927 5.656 175 HG3 GLU 22 HG3 GLU 22 4.796 -24.980 4.611 176 H ALA 23 H ALA 23 0.812 -23.382 3.087 177 HA ALA 23 HA ALA 23 1.057 -21.278 1.179 178 HB1 ALA 23 HB1 ALA 23 -1.061 -23.428 1.505 179 HB2 ALA 23 HB2 ALA 23 -0.739 -22.480 0.041 180 HB3 ALA 23 HB3 ALA 23 0.494 -23.612 0.664 181 H VAL 24 H VAL 24 -0.991 -21.495 4.029 182 HA VAL 24 HA VAL 24 -3.047 -19.629 3.057 183 HB VAL 24 HB VAL 24 -2.065 -20.430 5.846 184 HG11 VAL 24 HG11 VAL 24 -4.229 -19.506 6.650 185 HG12 VAL 24 HG12 VAL 24 -3.226 -18.254 5.899 186 HG13 VAL 24 HG13 VAL 24 -4.597 -18.948 5.001 187 HG21 VAL 24 HG21 VAL 24 -3.125 -22.305 4.534 188 HG22 VAL 24 HG22 VAL 24 -4.148 -21.824 5.900 189 HG23 VAL 24 HG23 VAL 24 -4.546 -21.295 4.251 190 H HIS 25 H HIS 25 -0.219 -19.769 4.988 191 HA HIS 25 HA HIS 25 0.149 -17.067 5.777 192 HB2 HIS 25 HB2 HIS 25 1.212 -19.769 6.065 193 HB3 HIS 25 HB3 HIS 25 2.489 -18.660 5.853 194 HD2 HIS 25 HD2 HIS 25 3.090 -17.169 8.050 195 HE1 HIS 25 HE1 HIS 25 -0.218 -18.363 10.457 196 HE2 HIS 25 HE2 HIS 25 1.982 -17.058 10.425 197 H CYS 26 H CYS 26 0.189 -18.144 2.719 198 HA CYS 26 HA CYS 26 2.459 -16.389 1.906 199 HB2 CYS 26 HB2 CYS 26 1.422 -18.993 0.726 200 HB3 CYS 26 HB3 CYS 26 2.354 -17.821 -0.211 201 HG CYS 26 HG CYS 26 4.405 -17.698 1.388 202 H TYR 27 H TYR 27 -0.870 -16.651 2.004 203 HA TYR 27 HA TYR 27 -1.118 -14.719 -0.270 204 HB2 TYR 27 HB2 TYR 27 -3.299 -16.492 0.823 205 HB3 TYR 27 HB3 TYR 27 -3.381 -15.474 -0.622 206 HD1 TYR 27 HD2 TYR 27 -0.770 -16.285 -1.968 207 HD2 TYR 27 HD1 TYR 27 -3.787 -18.569 0.076 208 HE1 TYR 27 HE2 TYR 27 -0.162 -18.289 -3.309 209 HE2 TYR 27 HE1 TYR 27 -3.177 -20.580 -1.261 210 HH TYR 27 HH TYR 27 -1.838 -21.432 -2.909 211 H ASP 28 H ASP 28 -1.198 -15.128 3.082 212 HA ASP 28 HA ASP 28 -3.465 -13.448 3.730 213 HB2 ASP 28 HB2 ASP 28 -2.426 -15.228 5.169 214 HB3 ASP 28 HB3 ASP 28 -1.003 -14.208 5.375 215 H GLN 29 H GLN 29 -0.040 -12.871 2.962 216 HA GLN 29 HA GLN 29 0.058 -10.387 4.405 217 HB2 GLN 29 HB2 GLN 29 2.233 -10.173 3.662 218 HB3 GLN 29 HB3 GLN 29 2.008 -11.905 3.919 219 HG2 GLN 29 HG2 GLN 29 1.783 -10.468 1.277 220 HG3 GLN 29 HG3 GLN 29 3.251 -11.280 1.810 221 HE21 GLN 29 HE22 GLN 29 1.881 -11.814 -0.607 222 HE22 GLN 29 HE21 GLN 29 1.276 -13.445 -0.580 223 H LEU 30 H LEU 30 -1.347 -11.233 1.367 224 HA LEU 30 HA LEU 30 -1.069 -8.573 0.183 225 HB2 LEU 30 HB2 LEU 30 -2.999 -10.873 -0.386 226 HB3 LEU 30 HB3 LEU 30 -2.784 -9.433 -1.391 227 HG LEU 30 HG LEU 30 -1.505 -10.880 -2.561 228 HD11 LEU 30 HD11 LEU 30 0.089 -9.131 -1.781 229 HD12 LEU 30 HD12 LEU 30 0.540 -10.169 -0.421 230 HD13 LEU 30 HD13 LEU 30 0.887 -10.681 -2.074 231 HD21 LEU 30 HD21 LEU 30 -2.055 -12.781 -1.174 232 HD22 LEU 30 HD22 LEU 30 -0.329 -12.814 -1.562 233 HD23 LEU 30 HD23 LEU 30 -0.864 -12.286 0.042 234 H ILE 31 H ILE 31 -3.364 -10.288 2.255 235 HA ILE 31 HA ILE 31 -5.430 -8.292 2.030 236 HB ILE 31 HB ILE 31 -4.893 -10.499 4.064 237 HG12 ILE 31 HG12 ILE 31 -6.889 -10.575 1.781 238 HG13 ILE 31 HG13 ILE 31 -5.225 -11.094 1.559 239 HG21 ILE 31 HG21 ILE 31 -7.445 -8.926 3.506 240 HG22 ILE 31 HG22 ILE 31 -7.331 -10.351 4.567 241 HG23 ILE 31 HG23 ILE 31 -6.484 -8.864 4.992 242 HD11 ILE 31 HD11 ILE 31 -7.150 -12.268 3.562 243 HD12 ILE 31 HD12 ILE 31 -6.547 -13.024 2.064 244 HD13 ILE 31 HD13 ILE 31 -5.416 -12.667 3.405 245 H THR 32 H THR 32 -2.478 -8.629 3.760 246 HA THR 32 HA THR 32 -3.220 -6.493 5.704 247 HB THR 32 HB THR 32 -0.741 -8.245 5.538 248 HG1 THR 32 HG1 THR 32 -1.762 -9.344 7.241 249 HG21 THR 32 HG21 THR 32 -1.797 -6.378 7.712 250 HG22 THR 32 HG22 THR 32 -0.456 -7.530 7.916 251 HG23 THR 32 HG23 THR 32 -0.292 -6.185 6.786 252 H ALA 33 H ALA 33 -1.376 -6.987 2.730 253 HA ALA 33 HA ALA 33 0.232 -4.563 3.184 254 HB1 ALA 33 HB1 ALA 33 1.190 -5.112 0.972 255 HB2 ALA 33 HB2 ALA 33 1.256 -6.498 2.083 256 HB3 ALA 33 HB3 ALA 33 0.023 -6.439 0.797 257 H GLN 34 H GLN 34 -2.588 -5.625 1.296 258 HA GLN 34 HA GLN 34 -3.607 -3.018 0.899 259 HB2 GLN 34 HB2 GLN 34 -3.280 -2.908 -1.613 260 HB3 GLN 34 HB3 GLN 34 -1.891 -2.498 -0.607 261 HG2 GLN 34 HG2 GLN 34 -1.325 -5.085 -0.970 262 HG3 GLN 34 HG3 GLN 34 -2.338 -4.850 -2.402 263 HE21 GLN 34 HE22 GLN 34 0.527 -3.641 -0.627 264 HE22 GLN 34 HE21 GLN 34 1.345 -2.982 -2.023 265 HA PRO 35 HA PRO 35 -6.304 -6.715 0.474 266 HB2 PRO 35 HB2 PRO 35 -8.382 -5.727 2.013 267 HB3 PRO 35 HB3 PRO 35 -6.936 -6.535 2.678 268 HG2 PRO 35 HG2 PRO 35 -7.460 -3.569 2.384 269 HG3 PRO 35 HG3 PRO 35 -6.847 -4.437 3.824 270 HD2 PRO 35 HD2 PRO 35 -5.173 -3.170 2.118 271 HD3 PRO 35 HD3 PRO 35 -4.714 -4.738 2.846 272 H GLN 36 H GLN 36 -6.361 -3.595 -0.745 273 HA GLN 36 HA GLN 36 -9.001 -3.388 -1.763 274 HB2 GLN 36 HB2 GLN 36 -8.102 -1.615 -3.160 275 HB3 GLN 36 HB3 GLN 36 -7.451 -1.499 -1.514 276 HG2 GLN 36 HG2 GLN 36 -5.386 -2.668 -2.279 277 HG3 GLN 36 HG3 GLN 36 -6.036 -2.712 -3.919 278 HE21 GLN 36 HE22 GLN 36 -3.612 -1.543 -3.622 279 HE22 GLN 36 HE21 GLN 36 -3.744 0.199 -3.746 280 H ASN 37 H ASN 37 -7.284 -5.980 -2.340 281 HA ASN 37 HA ASN 37 -8.077 -6.171 -5.193 282 HB2 ASN 37 HB2 ASN 37 -5.391 -6.853 -3.943 283 HB3 ASN 37 HB3 ASN 37 -5.899 -7.435 -5.540 284 HD21 ASN 37 HD22 ASN 37 -4.112 -5.101 -4.019 285 HD22 ASN 37 HD21 ASN 37 -4.168 -3.860 -5.253 286 HA PRO 38 HA PRO 38 -9.932 -9.855 -3.431 287 HB2 PRO 38 HB2 PRO 38 -10.995 -10.904 -5.662 288 HB3 PRO 38 HB3 PRO 38 -11.531 -9.300 -5.068 289 HG2 PRO 38 HG2 PRO 38 -9.429 -9.816 -7.202 290 HG3 PRO 38 HG3 PRO 38 -10.909 -8.807 -7.340 291 HD2 PRO 38 HD2 PRO 38 -8.578 -7.633 -6.633 292 HD3 PRO 38 HD3 PRO 38 -10.077 -7.207 -5.837 293 H VAL 39 H VAL 39 -7.346 -9.928 -5.868 294 HA VAL 39 HA VAL 39 -7.189 -12.763 -6.091 295 HB VAL 39 HB VAL 39 -6.121 -11.069 -7.588 296 HG11 VAL 39 HG11 VAL 39 -5.103 -9.633 -5.828 297 HG12 VAL 39 HG12 VAL 39 -3.981 -10.951 -5.427 298 HG13 VAL 39 HG13 VAL 39 -3.921 -10.187 -7.029 299 HG21 VAL 39 HG21 VAL 39 -4.150 -12.461 -8.061 300 HG22 VAL 39 HG22 VAL 39 -4.264 -13.205 -6.451 301 HG23 VAL 39 HG23 VAL 39 -5.543 -13.486 -7.650 302 H GLY 40 H GLY 40 -6.191 -10.491 -3.647 303 HA2 GLY 40 HA2 GLY 40 -4.339 -12.098 -2.188 304 HA3 GLY 40 HA3 GLY 40 -5.290 -10.739 -1.556 305 H TYR 41 H TYR 41 -7.819 -12.257 -2.555 306 HA TYR 41 HA TYR 41 -8.001 -14.124 -0.232 307 HB2 TYR 41 HB2 TYR 41 -10.372 -12.986 -1.755 308 HB3 TYR 41 HB3 TYR 41 -10.342 -13.699 -0.232 309 HD1 TYR 41 HD1 TYR 41 -9.056 -10.630 -1.890 310 HD2 TYR 41 HD2 TYR 41 -10.187 -12.549 1.766 311 HE1 TYR 41 HE1 TYR 41 -8.938 -8.443 -0.730 312 HE2 TYR 41 HE2 TYR 41 -10.047 -10.373 2.954 313 HH TYR 41 HH TYR 41 -9.188 -7.339 1.245 314 H SER 42 H SER 42 -8.009 -13.828 -3.685 315 HA SER 42 HA SER 42 -9.763 -15.950 -4.378 316 HB2 SER 42 HB2 SER 42 -8.963 -14.116 -5.873 317 HB3 SER 42 HB3 SER 42 -7.376 -14.911 -5.942 318 HG SER 42 HG SER 42 -8.676 -15.536 -7.690 319 H ASN 43 H ASN 43 -6.618 -16.109 -2.967 320 HA ASN 43 HA ASN 43 -6.338 -18.946 -3.878 321 HB2 ASN 43 HB2 ASN 43 -4.208 -16.908 -3.132 322 HB3 ASN 43 HB3 ASN 43 -3.900 -18.588 -3.547 323 HD21 ASN 43 HD22 ASN 43 -3.194 -15.875 -4.821 324 HD22 ASN 43 HD21 ASN 43 -3.638 -16.102 -6.501 325 H LYS 44 H LYS 44 -6.224 -16.661 -1.116 326 HA LYS 44 HA LYS 44 -5.589 -18.711 0.830 327 HB2 LYS 44 HB2 LYS 44 -5.352 -16.228 1.111 328 HB3 LYS 44 HB3 LYS 44 -7.072 -16.082 1.113 329 HG2 LYS 44 HG2 LYS 44 -7.223 -17.566 3.115 330 HG3 LYS 44 HG3 LYS 44 -5.455 -17.750 3.094 331 HD2 LYS 44 HD2 LYS 44 -5.170 -15.344 3.505 332 HD3 LYS 44 HD3 LYS 44 -6.932 -15.114 3.433 333 HE2 LYS 44 HE2 LYS 44 -7.210 -16.695 5.338 334 HE3 LYS 44 HE3 LYS 44 -5.443 -16.830 5.457 335 HZ1 LYS 44 HZ1 LYS 44 -6.998 -14.347 5.783 336 HZ2 LYS 44 HZ2 LYS 44 -6.329 -15.233 7.004 337 HZ3 LYS 44 HZ3 LYS 44 -5.358 -14.471 5.922 338 H ALA 45 H ALA 45 -8.524 -17.320 -0.537 339 HA ALA 45 HA ALA 45 -10.408 -18.889 0.950 340 HB1 ALA 45 HB1 ALA 45 -10.707 -17.687 -1.838 341 HB2 ALA 45 HB2 ALA 45 -12.009 -18.163 -0.735 342 HB3 ALA 45 HB3 ALA 45 -10.948 -16.785 -0.326 343 H MET 46 H MET 46 -8.019 -20.110 -0.924 344 HA MET 46 HA MET 46 -9.632 -22.483 -1.701 345 HB2 MET 46 HB2 MET 46 -9.019 -20.798 -3.627 346 HB3 MET 46 HB3 MET 46 -7.368 -21.400 -3.403 347 HG2 MET 46 HG2 MET 46 -8.385 -22.641 -5.185 348 HG3 MET 46 HG3 MET 46 -8.215 -23.718 -3.804 349 HE1 MET 46 HE1 MET 46 -12.107 -21.921 -5.511 350 HE2 MET 46 HE2 MET 46 -10.929 -20.906 -4.646 351 HE3 MET 46 HE3 MET 46 -10.468 -21.718 -6.161 352 H ALA 47 H ALA 47 -7.112 -21.258 0.117 353 HA ALA 47 HA ALA 47 -5.882 -23.973 0.216 354 HB1 ALA 47 HB1 ALA 47 -4.509 -21.296 0.672 355 HB2 ALA 47 HB2 ALA 47 -3.760 -22.908 0.828 356 HB3 ALA 47 HB3 ALA 47 -4.325 -22.341 -0.761 357 H LEU 48 H LEU 48 -7.292 -21.253 1.992 358 HA LEU 48 HA LEU 48 -6.605 -22.347 4.586 359 HB2 LEU 48 HB2 LEU 48 -7.087 -19.949 4.191 360 HB3 LEU 48 HB3 LEU 48 -8.742 -20.359 3.706 361 HG LEU 48 HG LEU 48 -9.240 -21.192 5.942 362 HD11 LEU 48 HD11 LEU 48 -6.353 -20.442 6.586 363 HD12 LEU 48 HD12 LEU 48 -7.589 -20.864 7.792 364 HD13 LEU 48 HD13 LEU 48 -7.044 -22.080 6.630 365 HD21 LEU 48 HD21 LEU 48 -9.547 -18.793 5.512 366 HD22 LEU 48 HD22 LEU 48 -8.980 -19.037 7.181 367 HD23 LEU 48 HD23 LEU 48 -7.848 -18.483 5.933 368 H ILE 49 H ILE 49 -9.197 -22.719 2.181 369 HA ILE 49 HA ILE 49 -11.028 -24.200 3.771 370 HB ILE 49 HB ILE 49 -11.731 -25.233 1.623 371 HG12 ILE 49 HG12 ILE 49 -9.727 -23.394 0.335 372 HG13 ILE 49 HG13 ILE 49 -9.319 -25.058 0.649 373 HG21 ILE 49 HG21 ILE 49 -12.583 -23.146 0.648 374 HG22 ILE 49 HG22 ILE 49 -12.689 -23.103 2.420 375 HG23 ILE 49 HG23 ILE 49 -11.397 -22.207 1.574 376 HD11 ILE 49 HD11 ILE 49 -10.124 -24.870 -1.619 377 HD12 ILE 49 HD12 ILE 49 -11.142 -25.919 -0.614 378 HD13 ILE 49 HD13 ILE 49 -11.690 -24.267 -1.020 379 H LYS 50 H LYS 50 -7.954 -24.939 2.307 380 HA LYS 50 HA LYS 50 -8.426 -27.712 1.919 381 HB2 LYS 50 HB2 LYS 50 -6.631 -25.841 1.020 382 HB3 LYS 50 HB3 LYS 50 -5.622 -26.793 2.106 383 HG2 LYS 50 HG2 LYS 50 -5.368 -27.868 0.070 384 HG3 LYS 50 HG3 LYS 50 -6.625 -28.863 0.816 385 HD2 LYS 50 HD2 LYS 50 -7.047 -26.588 -1.173 386 HD3 LYS 50 HD3 LYS 50 -7.002 -28.298 -1.607 387 HE2 LYS 50 HE2 LYS 50 -8.994 -27.059 0.317 388 HE3 LYS 50 HE3 LYS 50 -9.292 -27.306 -1.409 389 HZ1 LYS 50 HZ1 LYS 50 -8.687 -29.458 0.524 390 HZ2 LYS 50 HZ2 LYS 50 -10.173 -29.120 -0.103 391 HZ3 LYS 50 HZ3 LYS 50 -8.965 -29.661 -1.078 392 H LEU 51 H LEU 51 -7.491 -25.873 4.721 393 HA LEU 51 HA LEU 51 -6.276 -28.189 6.099 394 HB2 LEU 51 HB2 LEU 51 -6.994 -25.370 7.040 395 HB3 LEU 51 HB3 LEU 51 -6.251 -26.621 8.037 396 HG LEU 51 HG LEU 51 -4.600 -25.072 7.430 397 HD11 LEU 51 HD11 LEU 51 -4.220 -27.658 5.874 398 HD12 LEU 51 HD12 LEU 51 -2.939 -26.577 6.477 399 HD13 LEU 51 HD13 LEU 51 -3.983 -27.450 7.629 400 HD21 LEU 51 HD21 LEU 51 -5.628 -24.235 5.343 401 HD22 LEU 51 HD22 LEU 51 -3.910 -24.618 5.160 402 HD23 LEU 51 HD23 LEU 51 -5.136 -25.728 4.516 403 H GLY 52 H GLY 52 -9.408 -26.795 5.573 404 HA2 GLY 52 HA2 GLY 52 -11.360 -28.047 6.241 405 HA3 GLY 52 HA3 GLY 52 -10.545 -28.465 7.764 406 H GLU 53 H GLU 53 -9.687 -25.324 7.252 407 HA GLU 53 HA GLU 53 -11.565 -24.319 9.222 408 HB2 GLU 53 HB2 GLU 53 -9.293 -22.977 7.695 409 HB3 GLU 53 HB3 GLU 53 -10.245 -22.217 8.973 410 HG2 GLU 53 HG2 GLU 53 -9.576 -24.109 10.510 411 HG3 GLU 53 HG3 GLU 53 -8.481 -24.682 9.236 412 H TYR 54 H TYR 54 -13.133 -25.070 7.115 413 HA TYR 54 HA TYR 54 -13.564 -23.206 5.061 414 HB2 TYR 54 HB2 TYR 54 -15.576 -24.938 6.542 415 HB3 TYR 54 HB3 TYR 54 -15.856 -24.152 4.989 416 HD1 TYR 54 HD1 TYR 54 -14.212 -24.723 3.066 417 HD2 TYR 54 HD2 TYR 54 -14.721 -27.118 6.597 418 HE1 TYR 54 HE1 TYR 54 -13.305 -26.701 1.853 419 HE2 TYR 54 HE2 TYR 54 -13.804 -29.092 5.405 420 HH TYR 54 HH TYR 54 -12.756 -28.919 1.977 421 H THR 55 H THR 55 -14.547 -23.113 8.476 422 HA THR 55 HA THR 55 -16.562 -21.126 8.293 423 HB THR 55 HB THR 55 -14.547 -21.729 10.487 424 HG1 THR 55 HG1 THR 55 -16.269 -22.990 11.281 425 HG21 THR 55 HG21 THR 55 -16.300 -20.747 11.984 426 HG22 THR 55 HG22 THR 55 -15.674 -19.540 10.841 427 HG23 THR 55 HG23 THR 55 -17.256 -20.295 10.553 428 H GLN 56 H GLN 56 -12.982 -20.858 8.467 429 HA GLN 56 HA GLN 56 -13.089 -17.939 8.689 430 HB2 GLN 56 HB2 GLN 56 -10.865 -19.980 8.364 431 HB3 GLN 56 HB3 GLN 56 -10.605 -18.226 8.296 432 HG2 GLN 56 HG2 GLN 56 -10.161 -18.918 10.497 433 HG3 GLN 56 HG3 GLN 56 -11.657 -17.984 10.540 434 HE21 GLN 56 HE22 GLN 56 -10.195 -21.218 10.848 435 HE22 GLN 56 HE21 GLN 56 -11.586 -21.974 11.605 436 H ALA 57 H ALA 57 -12.980 -20.373 6.133 437 HA ALA 57 HA ALA 57 -11.691 -18.749 4.145 438 HB1 ALA 57 HB1 ALA 57 -11.761 -21.219 4.083 439 HB2 ALA 57 HB2 ALA 57 -13.526 -21.167 3.881 440 HB3 ALA 57 HB3 ALA 57 -12.469 -20.504 2.611 441 H ILE 58 H ILE 58 -15.122 -19.395 4.982 442 HA ILE 58 HA ILE 58 -16.321 -17.987 2.773 443 HB ILE 58 HB ILE 58 -17.274 -18.382 5.665 444 HG12 ILE 58 HG12 ILE 58 -17.900 -20.115 3.263 445 HG13 ILE 58 HG13 ILE 58 -16.584 -20.501 4.367 446 HG21 ILE 58 HG21 ILE 58 -18.603 -16.773 4.241 447 HG22 ILE 58 HG22 ILE 58 -18.912 -18.136 3.122 448 HG23 ILE 58 HG23 ILE 58 -19.522 -18.184 4.779 449 HD11 ILE 58 HD11 ILE 58 -18.550 -21.746 5.067 450 HD12 ILE 58 HD12 ILE 58 -18.201 -20.493 6.273 451 HD13 ILE 58 HD13 ILE 58 -19.530 -20.270 5.111 452 H GLN 59 H GLN 59 -15.042 -16.933 5.959 453 HA GLN 59 HA GLN 59 -16.132 -14.290 5.761 454 HB2 GLN 59 HB2 GLN 59 -15.427 -15.403 7.883 455 HB3 GLN 59 HB3 GLN 59 -13.741 -15.328 7.346 456 HG2 GLN 59 HG2 GLN 59 -14.257 -13.491 8.899 457 HG3 GLN 59 HG3 GLN 59 -13.852 -12.862 7.309 458 HE21 GLN 59 HE22 GLN 59 -14.984 -10.901 7.504 459 HE22 GLN 59 HE21 GLN 59 -16.728 -10.826 7.597 460 H MET 60 H MET 60 -13.345 -15.904 4.356 461 HA MET 60 HA MET 60 -12.069 -13.360 3.612 462 HB2 MET 60 HB2 MET 60 -11.464 -16.250 2.887 463 HB3 MET 60 HB3 MET 60 -10.440 -14.884 2.460 464 HG2 MET 60 HG2 MET 60 -11.143 -15.355 5.358 465 HG3 MET 60 HG3 MET 60 -9.951 -16.383 4.578 466 HE1 MET 60 HE1 MET 60 -10.353 -12.427 3.850 467 HE2 MET 60 HE2 MET 60 -10.910 -12.740 5.515 468 HE3 MET 60 HE3 MET 60 -9.393 -11.832 5.206 469 H CYS 61 H CYS 61 -14.278 -15.788 2.250 470 HA CYS 61 HA CYS 61 -13.889 -14.965 -0.474 471 HB2 CYS 61 HB2 CYS 61 -16.265 -16.326 0.936 472 HB3 CYS 61 HB3 CYS 61 -16.111 -16.150 -0.804 473 HG CYS 61 HG CYS 61 -15.544 -18.588 -0.182 474 H GLN 62 H GLN 62 -16.319 -14.059 2.085 475 HA GLN 62 HA GLN 62 -17.755 -12.253 0.385 476 HB2 GLN 62 HB2 GLN 62 -17.425 -12.336 3.411 477 HB3 GLN 62 HB3 GLN 62 -18.666 -11.412 2.537 478 HG2 GLN 62 HG2 GLN 62 -19.681 -13.445 1.678 479 HG3 GLN 62 HG3 GLN 62 -18.355 -14.426 2.299 480 HE21 GLN 62 HE22 GLN 62 -20.073 -15.639 3.296 481 HE22 GLN 62 HE21 GLN 62 -20.740 -15.073 4.802 482 H GLN 63 H GLN 63 -14.658 -11.958 2.005 483 HA GLN 63 HA GLN 63 -14.733 -9.012 1.964 484 HB2 GLN 63 HB2 GLN 63 -12.590 -11.078 2.584 485 HB3 GLN 63 HB3 GLN 63 -12.286 -9.337 2.614 486 HG2 GLN 63 HG2 GLN 63 -14.518 -10.565 4.265 487 HG3 GLN 63 HG3 GLN 63 -12.842 -10.543 4.830 488 HE21 GLN 63 HE22 GLN 63 -12.808 -9.046 6.427 489 HE22 GLN 63 HE21 GLN 63 -13.343 -7.395 6.255 490 H GLY 64 H GLY 64 -13.537 -11.703 -0.071 491 HA2 GLY 64 HA2 GLY 64 -11.859 -10.000 -1.700 492 HA3 GLY 64 HA3 GLY 64 -12.370 -11.654 -2.062 493 H LEU 65 H LEU 65 -15.239 -11.091 -1.767 494 HA LEU 65 HA LEU 65 -15.831 -10.187 -4.436 495 HB2 LEU 65 HB2 LEU 65 -17.482 -10.842 -1.970 496 HB3 LEU 65 HB3 LEU 65 -18.229 -10.413 -3.519 497 HG LEU 65 HG LEU 65 -16.211 -12.675 -3.269 498 HD11 LEU 65 HD11 LEU 65 -19.253 -12.795 -3.173 499 HD12 LEU 65 HD12 LEU 65 -18.146 -14.189 -3.215 500 HD13 LEU 65 HD13 LEU 65 -18.158 -13.114 -1.804 501 HD21 LEU 65 HD21 LEU 65 -18.321 -11.971 -5.352 502 HD22 LEU 65 HD22 LEU 65 -16.559 -11.788 -5.547 503 HD23 LEU 65 HD23 LEU 65 -17.266 -13.403 -5.381 504 H ARG 66 H ARG 66 -14.737 -8.307 -2.028 505 HA ARG 66 HA ARG 66 -16.590 -6.031 -2.511 506 HB2 ARG 66 HB2 ARG 66 -14.257 -6.332 -0.579 507 HB3 ARG 66 HB3 ARG 66 -15.397 -4.991 -0.646 508 HG2 ARG 66 HG2 ARG 66 -17.245 -6.545 -0.031 509 HG3 ARG 66 HG3 ARG 66 -16.073 -7.871 0.025 510 HD2 ARG 66 HD2 ARG 66 -16.450 -7.061 2.282 511 HD3 ARG 66 HD3 ARG 66 -14.800 -6.660 1.785 512 HE ARG 66 HE ARG 66 -16.653 -4.508 1.211 513 HH11 ARG 66 HH11 ARG 66 -14.783 -6.011 3.813 514 HH12 ARG 66 HH12 ARG 66 -14.691 -4.538 4.753 515 HH21 ARG 66 HH21 ARG 66 -16.516 -2.611 2.455 516 HH22 ARG 66 HH22 ARG 66 -15.673 -2.618 3.988 517 H TYR 67 H TYR 67 -14.048 -7.391 -4.026 518 HA TYR 67 HA TYR 67 -12.713 -4.825 -4.743 519 HB2 TYR 67 HB2 TYR 67 -11.402 -7.426 -3.894 520 HB3 TYR 67 HB3 TYR 67 -10.528 -6.009 -4.467 521 HD1 TYR 67 HD1 TYR 67 -11.309 -3.729 -3.157 522 HD2 TYR 67 HD2 TYR 67 -11.480 -7.739 -1.622 523 HE1 TYR 67 HE1 TYR 67 -11.356 -2.838 -0.841 524 HE2 TYR 67 HE2 TYR 67 -11.531 -6.864 0.698 525 HH TYR 67 HH TYR 67 -11.444 -3.343 1.395 526 H THR 68 H THR 68 -14.588 -7.204 -5.825 527 HA THR 68 HA THR 68 -13.150 -7.698 -8.363 528 HB THR 68 HB THR 68 -15.020 -9.378 -8.677 529 HG1 THR 68 HG1 THR 68 -16.208 -9.868 -6.823 530 HG21 THR 68 HG21 THR 68 -14.024 -10.984 -7.107 531 HG22 THR 68 HG22 THR 68 -12.759 -9.947 -7.821 532 HG23 THR 68 HG23 THR 68 -13.335 -9.645 -6.164 533 H SER 69 H SER 69 -14.576 -5.152 -7.445 534 HA SER 69 HA SER 69 -16.968 -4.868 -8.991 535 HB2 SER 69 HB2 SER 69 -16.697 -2.472 -8.378 536 HB3 SER 69 HB3 SER 69 -16.538 -3.557 -6.981 537 HG SER 69 HG SER 69 -14.880 -1.962 -7.071 538 H THR 70 H THR 70 -14.167 -5.547 -10.402 539 HA THR 70 HA THR 70 -14.633 -3.616 -12.620 540 HB THR 70 HB THR 70 -12.330 -3.172 -12.902 541 HG1 THR 70 HG1 THR 70 -10.776 -4.174 -11.560 542 HG21 THR 70 HG21 THR 70 -13.358 -1.851 -11.044 543 HG22 THR 70 HG22 THR 70 -12.775 -3.077 -9.886 544 HG23 THR 70 HG23 THR 70 -11.618 -2.117 -10.821 545 H ALA 71 H ALA 71 -13.584 -4.334 -14.669 546 HA ALA 71 HA ALA 71 -14.217 -7.085 -15.208 547 HB1 ALA 71 HB1 ALA 71 -14.487 -5.254 -16.847 548 HB2 ALA 71 HB2 ALA 71 -12.720 -5.010 -16.870 549 HB3 ALA 71 HB3 ALA 71 -13.424 -6.532 -17.472 550 H GLU 72 H GLU 72 -11.405 -5.608 -13.879 551 HA GLU 72 HA GLU 72 -9.423 -7.355 -15.038 552 HB2 GLU 72 HB2 GLU 72 -9.386 -5.719 -12.503 553 HB3 GLU 72 HB3 GLU 72 -7.971 -6.458 -13.265 554 HG2 GLU 72 HG2 GLU 72 -9.757 -4.302 -14.483 555 HG3 GLU 72 HG3 GLU 72 -8.135 -4.063 -13.830 556 H HIS 73 H HIS 73 -11.967 -8.062 -13.043 557 HA HIS 73 HA HIS 73 -10.569 -10.394 -11.847 558 HB2 HIS 73 HB2 HIS 73 -12.646 -8.780 -10.351 559 HB3 HIS 73 HB3 HIS 73 -11.558 -10.013 -9.716 560 HD2 HIS 73 HD2 HIS 73 -12.022 -6.416 -9.727 561 HE1 HIS 73 HE1 HIS 73 -7.825 -6.813 -9.251 562 HE2 HIS 73 HE2 HIS 73 -9.788 -5.199 -9.105 563 H VAL 74 H VAL 74 -12.409 -9.926 -14.202 564 HA VAL 74 HA VAL 74 -15.085 -10.453 -13.703 565 HB VAL 74 HB VAL 74 -14.003 -9.759 -15.834 566 HG11 VAL 74 HG11 VAL 74 -13.418 -12.720 -16.193 567 HG12 VAL 74 HG12 VAL 74 -13.176 -11.433 -17.391 568 HG13 VAL 74 HG13 VAL 74 -12.205 -11.459 -15.908 569 HG21 VAL 74 HG21 VAL 74 -16.369 -10.504 -15.723 570 HG22 VAL 74 HG22 VAL 74 -15.616 -10.859 -17.291 571 HG23 VAL 74 HG23 VAL 74 -15.845 -12.164 -16.104 572 H ALA 75 H ALA 75 -12.423 -12.739 -13.517 573 HA ALA 75 HA ALA 75 -14.368 -14.997 -13.343 574 HB1 ALA 75 HB1 ALA 75 -11.322 -14.959 -13.451 575 HB2 ALA 75 HB2 ALA 75 -12.347 -16.414 -13.452 576 HB3 ALA 75 HB3 ALA 75 -12.417 -15.280 -14.821 577 H ILE 76 H ILE 76 -11.905 -13.241 -11.392 578 HA ILE 76 HA ILE 76 -12.091 -14.955 -9.110 579 HB ILE 76 HB ILE 76 -11.336 -12.035 -9.426 580 HG12 ILE 76 HG12 ILE 76 -9.697 -14.577 -9.036 581 HG13 ILE 76 HG13 ILE 76 -9.906 -13.712 -10.562 582 HG21 ILE 76 HG21 ILE 76 -11.043 -13.863 -7.005 583 HG22 ILE 76 HG22 ILE 76 -10.309 -12.253 -7.166 584 HG23 ILE 76 HG23 ILE 76 -12.061 -12.404 -7.113 585 HD11 ILE 76 HD11 ILE 76 -7.766 -13.093 -9.633 586 HD12 ILE 76 HD12 ILE 76 -8.851 -11.686 -9.544 587 HD13 ILE 76 HD13 ILE 76 -8.500 -12.647 -8.083 588 H ARG 77 H ARG 77 -14.118 -12.374 -10.379 589 HA ARG 77 HA ARG 77 -15.706 -11.730 -8.158 590 HB2 ARG 77 HB2 ARG 77 -15.654 -10.642 -10.418 591 HB3 ARG 77 HB3 ARG 77 -16.496 -12.056 -11.077 592 HG2 ARG 77 HG2 ARG 77 -18.418 -11.585 -9.545 593 HG3 ARG 77 HG3 ARG 77 -17.549 -10.144 -8.948 594 HD2 ARG 77 HD2 ARG 77 -17.460 -9.273 -11.282 595 HD3 ARG 77 HD3 ARG 77 -18.314 -10.720 -11.837 596 HE ARG 77 HE ARG 77 -20.323 -9.880 -10.995 597 HH11 ARG 77 HH11 ARG 77 -17.638 -7.840 -9.887 598 HH12 ARG 77 HH12 ARG 77 -18.701 -6.617 -9.248 599 HH21 ARG 77 HH21 ARG 77 -21.660 -8.234 -10.173 600 HH22 ARG 77 HH22 ARG 77 -20.965 -6.822 -9.433 601 H SER 78 H SER 78 -15.449 -14.691 -9.923 602 HA SER 78 HA SER 78 -17.953 -15.726 -8.655 603 HB2 SER 78 HB2 SER 78 -17.788 -15.726 -11.168 604 HB3 SER 78 HB3 SER 78 -16.394 -16.827 -11.022 605 HG SER 78 HG SER 78 -18.393 -17.933 -11.320 606 H LYS 79 H LYS 79 -14.418 -15.974 -8.631 607 HA LYS 79 HA LYS 79 -14.452 -18.731 -7.788 608 HB2 LYS 79 HB2 LYS 79 -12.289 -16.598 -7.718 609 HB3 LYS 79 HB3 LYS 79 -12.054 -18.243 -7.161 610 HG2 LYS 79 HG2 LYS 79 -12.663 -17.348 -9.987 611 HG3 LYS 79 HG3 LYS 79 -11.204 -18.132 -9.384 612 HD2 LYS 79 HD2 LYS 79 -13.957 -19.354 -9.783 613 HD3 LYS 79 HD3 LYS 79 -12.438 -19.787 -10.584 614 HE2 LYS 79 HE2 LYS 79 -11.539 -20.537 -8.342 615 HE3 LYS 79 HE3 LYS 79 -13.151 -20.223 -7.653 616 HZ1 LYS 79 HZ1 LYS 79 -14.052 -21.824 -9.199 617 HZ2 LYS 79 HZ2 LYS 79 -12.560 -22.116 -9.828 618 HZ3 LYS 79 HZ3 LYS 79 -12.884 -22.522 -8.272 619 H LEU 80 H LEU 80 -14.525 -15.580 -5.995 620 HA LEU 80 HA LEU 80 -14.096 -16.939 -3.459 621 HB2 LEU 80 HB2 LEU 80 -15.383 -14.291 -4.222 622 HB3 LEU 80 HB3 LEU 80 -15.222 -14.866 -2.563 623 HG LEU 80 HG LEU 80 -13.440 -13.469 -2.671 624 HD11 LEU 80 HD11 LEU 80 -12.602 -15.736 -2.084 625 HD12 LEU 80 HD12 LEU 80 -12.164 -15.997 -3.794 626 HD13 LEU 80 HD13 LEU 80 -11.366 -14.729 -2.854 627 HD21 LEU 80 HD21 LEU 80 -11.991 -13.101 -4.601 628 HD22 LEU 80 HD22 LEU 80 -12.857 -14.337 -5.527 629 HD23 LEU 80 HD23 LEU 80 -13.690 -12.836 -5.027 630 H GLN 81 H GLN 81 -16.878 -16.075 -5.516 631 HA GLN 81 HA GLN 81 -18.898 -16.856 -3.657 632 HB2 GLN 81 HB2 GLN 81 -18.651 -16.259 -6.584 633 HB3 GLN 81 HB3 GLN 81 -20.007 -17.264 -6.124 634 HG2 GLN 81 HG2 GLN 81 -19.403 -14.470 -5.100 635 HG3 GLN 81 HG3 GLN 81 -20.773 -14.987 -6.091 636 HE21 GLN 81 HE22 GLN 81 -21.556 -17.372 -4.725 637 HE22 GLN 81 HE21 GLN 81 -22.072 -16.934 -3.103 638 H TYR 82 H TYR 82 -17.031 -18.645 -6.119 639 HA TYR 82 HA TYR 82 -18.594 -21.010 -6.191 640 HB2 TYR 82 HB2 TYR 82 -16.904 -20.629 -7.871 641 HB3 TYR 82 HB3 TYR 82 -15.702 -20.239 -6.663 642 HD1 TYR 82 HD2 TYR 82 -17.487 -23.024 -8.335 643 HD2 TYR 82 HD1 TYR 82 -14.436 -21.897 -5.508 644 HE1 TYR 82 HE2 TYR 82 -16.594 -25.342 -8.377 645 HE2 TYR 82 HE1 TYR 82 -13.522 -24.220 -5.576 646 HH TYR 82 HH TYR 82 -13.729 -26.324 -6.453 647 H ARG 83 H ARG 83 -15.866 -20.085 -3.977 648 HA ARG 83 HA ARG 83 -16.159 -22.696 -2.647 649 HB2 ARG 83 HB2 ARG 83 -14.308 -20.337 -2.416 650 HB3 ARG 83 HB3 ARG 83 -14.502 -21.412 -1.009 651 HG2 ARG 83 HG2 ARG 83 -13.416 -22.069 -3.750 652 HG3 ARG 83 HG3 ARG 83 -12.628 -22.216 -2.183 653 HD2 ARG 83 HD2 ARG 83 -14.813 -23.968 -3.341 654 HD3 ARG 83 HD3 ARG 83 -13.174 -24.432 -2.883 655 HE ARG 83 HE ARG 83 -14.511 -23.411 -0.583 656 HH11 ARG 83 HH11 ARG 83 -14.528 -26.205 -2.743 657 HH12 ARG 83 HH12 ARG 83 -15.185 -27.286 -1.540 658 HH21 ARG 83 HH21 ARG 83 -15.394 -24.830 0.963 659 HH22 ARG 83 HH22 ARG 83 -15.673 -26.509 0.562 660 H LEU 84 H LEU 84 -17.419 -19.441 -2.249 661 HA LEU 84 HA LEU 84 -18.298 -19.804 0.467 662 HB2 LEU 84 HB2 LEU 84 -18.134 -17.718 -1.150 663 HB3 LEU 84 HB3 LEU 84 -19.771 -18.164 -1.607 664 HG LEU 84 HG LEU 84 -18.752 -17.524 1.163 665 HD11 LEU 84 HD11 LEU 84 -20.536 -15.958 -0.716 666 HD12 LEU 84 HD12 LEU 84 -20.133 -15.495 0.954 667 HD13 LEU 84 HD13 LEU 84 -18.854 -15.568 -0.275 668 HD21 LEU 84 HD21 LEU 84 -20.578 -19.068 1.427 669 HD22 LEU 84 HD22 LEU 84 -21.169 -17.448 1.802 670 HD23 LEU 84 HD23 LEU 84 -21.561 -18.191 0.233 671 H GLU 85 H GLU 85 -19.544 -20.478 -2.738 672 HA GLU 85 HA GLU 85 -22.111 -21.568 -2.053 673 HB2 GLU 85 HB2 GLU 85 -20.326 -21.409 -4.478 674 HB3 GLU 85 HB3 GLU 85 -21.744 -22.431 -4.545 675 HG2 GLU 85 HG2 GLU 85 -23.210 -20.577 -3.945 676 HG3 GLU 85 HG3 GLU 85 -21.823 -19.516 -3.695 677 H LEU 86 H LEU 86 -19.124 -22.862 -1.327 678 HA LEU 86 HA LEU 86 -20.257 -25.616 -1.408 679 HB2 LEU 86 HB2 LEU 86 -17.464 -24.728 -2.218 680 HB3 LEU 86 HB3 LEU 86 -17.905 -26.419 -1.905 681 HG LEU 86 HG LEU 86 -19.206 -24.669 -4.035 682 HD11 LEU 86 HD11 LEU 86 -17.109 -26.867 -4.256 683 HD12 LEU 86 HD12 LEU 86 -17.899 -26.045 -5.611 684 HD13 LEU 86 HD13 LEU 86 -16.838 -25.130 -4.525 685 HD21 LEU 86 HD21 LEU 86 -19.358 -27.661 -3.461 686 HD22 LEU 86 HD22 LEU 86 -20.677 -26.486 -3.237 687 HD23 LEU 86 HD23 LEU 86 -20.075 -26.835 -4.870 688 H ALA 87 H ALA 87 -18.509 -23.117 0.330 689 HA ALA 87 HA ALA 87 -17.465 -24.847 2.388 690 HB1 ALA 87 HB1 ALA 87 -18.168 -21.884 2.338 691 HB2 ALA 87 HB2 ALA 87 -17.207 -22.694 3.607 692 HB3 ALA 87 HB3 ALA 87 -16.577 -22.591 1.956 693 H GLN 88 H GLN 88 -20.547 -23.162 1.789 694 HA GLN 88 HA GLN 88 -21.664 -23.609 4.398 695 HB2 GLN 88 HB2 GLN 88 -22.898 -22.979 1.687 696 HB3 GLN 88 HB3 GLN 88 -23.771 -22.960 3.228 697 HG2 GLN 88 HG2 GLN 88 -22.198 -21.234 4.096 698 HG3 GLN 88 HG3 GLN 88 -21.359 -21.210 2.546 699 HE21 GLN 88 HE22 GLN 88 -22.752 -19.004 3.917 700 HE22 GLN 88 HE21 GLN 88 -24.001 -18.462 2.818 701 H GLY 89 H GLY 89 -20.643 -25.861 2.333 702 HA2 GLY 89 HA2 GLY 89 -22.732 -27.818 3.114 703 HA3 GLY 89 HA3 GLY 89 -22.180 -27.718 1.421 704 H ALA 90 H ALA 90 -19.780 -26.960 3.806 705 HA ALA 90 HA ALA 90 -18.810 -29.749 3.992 706 HB1 ALA 90 HB1 ALA 90 -17.159 -27.428 2.928 707 HB2 ALA 90 HB2 ALA 90 -16.560 -29.069 3.263 708 HB3 ALA 90 HB3 ALA 90 -17.756 -28.808 1.973 709 H VAL 91 H VAL 91 -19.241 -26.596 5.314 710 HA VAL 91 HA VAL 91 -17.227 -26.736 7.377 711 HB VAL 91 HB VAL 91 -18.309 -24.706 6.387 712 HG11 VAL 91 HG11 VAL 91 -20.662 -25.470 6.420 713 HG12 VAL 91 HG12 VAL 91 -20.642 -25.433 8.195 714 HG13 VAL 91 HG13 VAL 91 -20.457 -23.931 7.275 715 HG21 VAL 91 HG21 VAL 91 -18.529 -24.892 9.411 716 HG22 VAL 91 HG22 VAL 91 -17.021 -24.629 8.504 717 HG23 VAL 91 HG23 VAL 91 -18.313 -23.414 8.454 718 H GLY 92 H GLY 92 -20.170 -28.337 6.888 719 HA2 GLY 92 HA2 GLY 92 -20.363 -29.049 9.778 720 HA3 GLY 92 HA3 GLY 92 -21.807 -28.562 8.871 721 H SER 93 H SER 93 -19.375 -30.414 7.157 722 HA SER 93 HA SER 93 -21.137 -32.583 6.595 723 HB2 SER 93 HB2 SER 93 -18.122 -32.303 6.369 724 HB3 SER 93 HB3 SER 93 -19.048 -33.689 5.739 725 HG SER 93 HG SER 93 -18.742 -32.075 4.147 726 H VAL 94 H VAL 94 -20.236 -34.914 6.931 727 HA VAL 94 HA VAL 94 -19.419 -35.382 9.690 728 HB VAL 94 HB VAL 94 -21.880 -35.001 9.705 729 HG11 VAL 94 HG11 VAL 94 -23.415 -36.625 8.738 730 HG12 VAL 94 HG12 VAL 94 -22.398 -35.925 7.469 731 HG13 VAL 94 HG13 VAL 94 -22.067 -37.563 8.072 732 HG21 VAL 94 HG21 VAL 94 -22.478 -36.908 11.075 733 HG22 VAL 94 HG22 VAL 94 -21.142 -37.866 10.418 734 HG23 VAL 94 HG23 VAL 94 -20.806 -36.437 11.415 735 H GLN 95 H GLN 95 -18.161 -35.735 7.254 736 HA GLN 95 HA GLN 95 -18.197 -38.186 5.970 737 HB2 GLN 95 HB2 GLN 95 -15.973 -36.289 6.725 738 HB3 GLN 95 HB3 GLN 95 -15.862 -37.382 5.421 739 HG2 GLN 95 HG2 GLN 95 -17.076 -36.184 3.966 740 HG3 GLN 95 HG3 GLN 95 -18.272 -35.730 5.197 741 HE21 GLN 95 HE22 GLN 95 -16.711 -34.625 7.174 742 HE22 GLN 95 HE21 GLN 95 -15.992 -33.176 6.583 743 H ILE 96 H ILE 96 -17.372 -37.559 9.249 744 HA ILE 96 HA ILE 96 -16.283 -40.279 9.581 745 HB ILE 96 HB ILE 96 -14.527 -39.394 11.112 746 HG12 ILE 96 HG12 ILE 96 -15.294 -36.677 9.966 747 HG13 ILE 96 HG13 ILE 96 -15.616 -37.218 11.621 748 HG21 ILE 96 HG21 ILE 96 -14.067 -39.965 8.718 749 HG22 ILE 96 HG22 ILE 96 -14.281 -38.249 8.303 750 HG23 ILE 96 HG23 ILE 96 -12.963 -38.757 9.387 751 HD11 ILE 96 HD11 ILE 96 -12.872 -36.825 10.372 752 HD12 ILE 96 HD12 ILE 96 -13.637 -35.822 11.611 753 HD13 ILE 96 HD13 ILE 96 -13.172 -37.500 11.992 754 HA PRO 97 HA PRO 97 -18.916 -40.482 13.085 755 HB2 PRO 97 HB2 PRO 97 -16.477 -41.070 14.749 756 HB3 PRO 97 HB3 PRO 97 -18.044 -41.943 14.716 757 HG2 PRO 97 HG2 PRO 97 -15.897 -42.962 13.409 758 HG3 PRO 97 HG3 PRO 97 -17.505 -42.949 12.607 759 HD2 PRO 97 HD2 PRO 97 -15.201 -41.028 12.221 760 HD3 PRO 97 HD3 PRO 97 -16.266 -41.785 10.991 761 H VAL 98 H VAL 98 -19.608 -39.403 14.986 762 HA VAL 98 HA VAL 98 -17.942 -37.194 16.002 763 HB VAL 98 HB VAL 98 -19.888 -35.635 15.834 764 HG11 VAL 98 HG11 VAL 98 -18.946 -36.709 13.152 765 HG12 VAL 98 HG12 VAL 98 -19.605 -35.091 13.475 766 HG13 VAL 98 HG13 VAL 98 -18.048 -35.568 14.180 767 HG21 VAL 98 HG21 VAL 98 -21.699 -37.306 15.576 768 HG22 VAL 98 HG22 VAL 98 -21.705 -36.123 14.260 769 HG23 VAL 98 HG23 VAL 98 -21.058 -37.756 13.984 770 H VAL 99 H VAL 99 -19.338 -39.921 16.789 771 HA VAL 99 HA VAL 99 -20.148 -38.961 19.470 772 HB VAL 99 HB VAL 99 -22.034 -40.589 19.476 773 HG11 VAL 99 HG11 VAL 99 -23.594 -39.217 18.212 774 HG12 VAL 99 HG12 VAL 99 -22.403 -38.173 19.023 775 HG13 VAL 99 HG13 VAL 99 -22.265 -38.505 17.280 776 HG21 VAL 99 HG21 VAL 99 -21.262 -42.058 17.637 777 HG22 VAL 99 HG22 VAL 99 -22.907 -41.456 17.359 778 HG23 VAL 99 HG23 VAL 99 -21.551 -40.743 16.465 779 H GLU 100 H GLU 100 -17.940 -40.623 17.847 780 HA GLU 100 HA GLU 100 -17.955 -43.240 18.966 781 HB2 GLU 100 HB2 GLU 100 -15.619 -43.311 18.263 782 HB3 GLU 100 HB3 GLU 100 -16.629 -42.593 17.000 783 HG2 GLU 100 HG2 GLU 100 -15.935 -40.329 17.719 784 HG3 GLU 100 HG3 GLU 100 -14.925 -41.035 18.990 785 H VAL 101 H VAL 101 -16.184 -44.053 20.463 786 HA VAL 101 HA VAL 101 -16.479 -42.890 23.030 787 HB VAL 101 HB VAL 101 -14.373 -44.835 21.991 788 HG11 VAL 101 HG11 VAL 101 -15.323 -44.233 24.827 789 HG12 VAL 101 HG12 VAL 101 -14.228 -45.558 24.361 790 HG13 VAL 101 HG13 VAL 101 -13.712 -43.878 24.161 791 HG21 VAL 101 HG21 VAL 101 -16.674 -45.648 21.633 792 HG22 VAL 101 HG22 VAL 101 -15.883 -46.561 22.930 793 HG23 VAL 101 HG23 VAL 101 -17.074 -45.299 23.331 794 H ASP 102 H ASP 102 -15.127 -41.617 24.301 795 HA ASP 102 HA ASP 102 -12.608 -40.592 23.211 796 HB2 ASP 102 HB2 ASP 102 -14.510 -39.238 22.239 797 HB3 ASP 102 HB3 ASP 102 -14.923 -38.761 23.885 798 H GLU 103 H GLU 103 -11.676 -38.953 24.859 799 HA GLU 103 HA GLU 103 -12.454 -39.664 27.636 800 HB2 GLU 103 HB2 GLU 103 -9.584 -39.448 26.660 801 HB3 GLU 103 HB3 GLU 103 -10.184 -40.043 28.222 802 HG2 GLU 103 HG2 GLU 103 -11.369 -41.889 26.938 803 HG3 GLU 103 HG3 GLU 103 -10.462 -41.376 25.500 804 H LEU 104 H LEU 104 -10.788 -38.218 29.085 805 HA LEU 104 HA LEU 104 -11.785 -35.593 28.864 806 HB2 LEU 104 HB2 LEU 104 -9.869 -35.208 30.604 807 HB3 LEU 104 HB3 LEU 104 -11.286 -36.156 31.006 808 HG LEU 104 HG LEU 104 -10.036 -38.245 30.702 809 HD11 LEU 104 HD11 LEU 104 -7.551 -38.157 30.406 810 HD12 LEU 104 HD12 LEU 104 -8.419 -37.638 28.961 811 HD13 LEU 104 HD13 LEU 104 -7.676 -36.429 30.035 812 HD21 LEU 104 HD21 LEU 104 -8.547 -36.198 32.397 813 HD22 LEU 104 HD22 LEU 104 -10.014 -37.086 32.883 814 HD23 LEU 104 HD23 LEU 104 -8.496 -37.966 32.593 815 HA PRO 105 HA PRO 105 -8.814 -33.526 26.311 816 HB2 PRO 105 HB2 PRO 105 -9.087 -30.945 27.148 817 HB3 PRO 105 HB3 PRO 105 -10.461 -31.821 26.390 818 HG2 PRO 105 HG2 PRO 105 -9.892 -31.468 29.348 819 HG3 PRO 105 HG3 PRO 105 -11.424 -31.135 28.474 820 HD2 PRO 105 HD2 PRO 105 -10.958 -33.493 29.783 821 HD3 PRO 105 HD3 PRO 105 -11.904 -33.423 28.267 822 H GLU 106 H GLU 106 -8.064 -34.547 29.247 823 HA GLU 106 HA GLU 106 -6.258 -34.504 30.598 824 HB2 GLU 106 HB2 GLU 106 -4.950 -33.579 28.024 825 HB3 GLU 106 HB3 GLU 106 -4.056 -34.121 29.466 826 HG2 GLU 106 HG2 GLU 106 -5.223 -36.311 29.353 827 HG3 GLU 106 HG3 GLU 106 -6.071 -35.774 27.888 828 H GLY 107 H GLY 107 -7.914 -31.997 30.369 829 HA2 GLY 107 HA2 GLY 107 -6.219 -30.332 32.040 830 HA3 GLY 107 HA3 GLY 107 -6.613 -29.604 30.467 831 H TYR 108 H TYR 108 -8.994 -31.770 31.809 832 HA TYR 108 HA TYR 108 -10.983 -29.740 31.938 833 HB2 TYR 108 HB2 TYR 108 -12.465 -31.411 32.576 834 HB3 TYR 108 HB3 TYR 108 -11.339 -32.158 31.442 835 HD1 TYR 108 HD2 TYR 108 -9.123 -33.186 32.811 836 HD2 TYR 108 HD1 TYR 108 -13.119 -32.714 34.302 837 HE1 TYR 108 HE2 TYR 108 -8.716 -34.984 34.468 838 HE2 TYR 108 HE1 TYR 108 -12.725 -34.508 35.975 839 HH TYR 108 HH TYR 108 -11.239 -36.085 36.754 840 H ASP 109 H ASP 109 -12.479 -30.023 34.147 841 HA ASP 109 HA ASP 109 -10.744 -29.136 36.383 842 HB2 ASP 109 HB2 ASP 109 -11.429 -27.235 34.885 843 HB3 ASP 109 HB3 ASP 109 -13.114 -27.570 35.293 844 H ARG 110 H ARG 110 -12.207 -31.616 36.095 845 HA ARG 110 HA ARG 110 -14.135 -31.281 38.329 846 HB2 ARG 110 HB2 ARG 110 -14.516 -33.094 35.916 847 HB3 ARG 110 HB3 ARG 110 -15.574 -32.989 37.332 848 HG2 ARG 110 HG2 ARG 110 -16.037 -30.606 36.833 849 HG3 ARG 110 HG3 ARG 110 -15.005 -30.719 35.386 850 HD2 ARG 110 HD2 ARG 110 -16.469 -32.491 34.478 851 HD3 ARG 110 HD3 ARG 110 -17.504 -32.374 35.921 852 HE ARG 110 HE ARG 110 -17.281 -29.784 34.803 853 HH11 ARG 110 HH21 ARG 110 -18.625 -32.941 33.929 854 HH12 ARG 110 HH22 ARG 110 -19.892 -32.264 32.940 855 HH21 ARG 110 HH11 ARG 110 -18.949 -28.925 33.503 856 HH22 ARG 110 HH12 ARG 110 -20.078 -29.992 32.710 857 H SER 111 H SER 111 -11.199 -32.238 37.862 858 HA SER 111 HA SER 111 -11.078 -34.976 38.615 859 HB2 SER 111 HB2 SER 111 -8.755 -34.404 39.286 860 HB3 SER 111 HB3 SER 111 -9.181 -33.792 37.672 861 HG SER 111 HG SER 111 -8.117 -32.212 38.964 Start of MODEL 12 1 H1 SER 2 H1 SER 2 6.198 -4.569 1.462 2 H2 SER 2 H2 SER 2 7.406 -3.466 1.672 3 H3 SER 2 H3 SER 2 7.770 -5.007 1.229 4 HA SER 2 HA SER 2 6.282 -3.067 -0.386 5 HB2 SER 2 HB2 SER 2 8.274 -3.088 -1.853 6 HB3 SER 2 HB3 SER 2 8.677 -2.526 -0.222 7 HG SER 2 HG SER 2 10.170 -4.079 -1.006 8 H GLN 3 H GLN 3 6.420 -3.862 -2.781 9 HA GLN 3 HA GLN 3 5.486 -5.240 -4.301 10 HB2 GLN 3 HB2 GLN 3 7.061 -7.347 -2.775 11 HB3 GLN 3 HB3 GLN 3 6.392 -7.541 -4.404 12 HG2 GLN 3 HG2 GLN 3 8.472 -5.475 -3.580 13 HG3 GLN 3 HG3 GLN 3 8.797 -6.977 -4.454 14 HE21 GLN 3 HE22 GLN 3 9.298 -4.178 -5.298 15 HE22 GLN 3 HE21 GLN 3 8.418 -3.967 -6.797 16 H PHE 4 H PHE 4 4.393 -7.617 -4.521 17 HA PHE 4 HA PHE 4 2.565 -8.193 -2.280 18 HB2 PHE 4 HB2 PHE 4 1.487 -6.291 -3.374 19 HB3 PHE 4 HB3 PHE 4 1.706 -7.001 -4.947 20 HD1 PHE 4 HD2 PHE 4 0.459 -9.287 -5.417 21 HD2 PHE 4 HD1 PHE 4 -0.513 -6.593 -2.221 22 HE1 PHE 4 HE2 PHE 4 -1.778 -10.311 -5.251 23 HE2 PHE 4 HE1 PHE 4 -2.794 -7.559 -2.102 24 HZ PHE 4 HZ PHE 4 -3.436 -9.425 -3.619 25 H GLU 5 H GLU 5 3.221 -8.680 -5.804 26 HA GLU 5 HA GLU 5 2.144 -11.381 -5.741 27 HB2 GLU 5 HB2 GLU 5 3.814 -9.895 -7.811 28 HB3 GLU 5 HB3 GLU 5 3.038 -11.462 -8.069 29 HG2 GLU 5 HG2 GLU 5 0.817 -10.443 -7.621 30 HG3 GLU 5 HG3 GLU 5 1.594 -8.860 -7.395 31 H LYS 6 H LYS 6 5.235 -9.962 -5.003 32 HA LYS 6 HA LYS 6 6.980 -12.036 -5.851 33 HB2 LYS 6 HB2 LYS 6 7.598 -9.741 -5.251 34 HB3 LYS 6 HB3 LYS 6 7.326 -10.144 -3.550 35 HG2 LYS 6 HG2 LYS 6 9.079 -11.794 -3.559 36 HG3 LYS 6 HG3 LYS 6 9.182 -11.771 -5.339 37 HD2 LYS 6 HD2 LYS 6 9.943 -9.470 -5.315 38 HD3 LYS 6 HD3 LYS 6 9.818 -9.406 -3.535 39 HE2 LYS 6 HE2 LYS 6 11.491 -11.228 -3.360 40 HE3 LYS 6 HE3 LYS 6 11.621 -11.283 -5.123 41 HZ1 LYS 6 HZ1 LYS 6 12.414 -9.009 -5.068 42 HZ2 LYS 6 HZ2 LYS 6 12.301 -8.968 -3.429 43 HZ3 LYS 6 HZ3 LYS 6 13.380 -9.976 -4.158 44 H GLN 7 H GLN 7 5.094 -11.613 -2.849 45 HA GLN 7 HA GLN 7 6.354 -13.951 -1.613 46 HB2 GLN 7 HB2 GLN 7 5.056 -11.607 -0.748 47 HB3 GLN 7 HB3 GLN 7 3.917 -12.909 -0.361 48 HG2 GLN 7 HG2 GLN 7 6.844 -12.768 0.419 49 HG3 GLN 7 HG3 GLN 7 5.453 -12.500 1.494 50 HE21 GLN 7 HE22 GLN 7 3.750 -14.452 1.327 51 HE22 GLN 7 HE21 GLN 7 4.480 -16.041 1.451 52 H LYS 8 H LYS 8 3.253 -13.062 -3.122 53 HA LYS 8 HA LYS 8 1.806 -15.403 -2.251 54 HB2 LYS 8 HB2 LYS 8 0.893 -13.146 -2.827 55 HB3 LYS 8 HB3 LYS 8 1.329 -13.420 -4.494 56 HG2 LYS 8 HG2 LYS 8 -0.202 -15.600 -4.223 57 HG3 LYS 8 HG3 LYS 8 -0.866 -14.686 -2.870 58 HD2 LYS 8 HD2 LYS 8 -2.227 -13.958 -4.669 59 HD3 LYS 8 HD3 LYS 8 -0.978 -12.705 -4.596 60 HE2 LYS 8 HE2 LYS 8 -1.013 -13.278 -6.882 61 HE3 LYS 8 HE3 LYS 8 0.381 -14.147 -6.256 62 HZ1 LYS 8 HZ1 LYS 8 -2.307 -15.296 -6.667 63 HZ2 LYS 8 HZ2 LYS 8 -1.003 -15.540 -7.646 64 HZ3 LYS 8 HZ3 LYS 8 -0.994 -16.123 -6.104 65 H GLU 9 H GLU 9 3.196 -14.419 -5.449 66 HA GLU 9 HA GLU 9 2.633 -16.952 -6.662 67 HB2 GLU 9 HB2 GLU 9 2.875 -14.584 -7.648 68 HB3 GLU 9 HB3 GLU 9 4.624 -14.912 -7.634 69 HG2 GLU 9 HG2 GLU 9 4.208 -16.933 -9.028 70 HG3 GLU 9 HG3 GLU 9 2.469 -16.602 -8.964 71 H GLN 10 H GLN 10 4.647 -16.512 -4.190 72 HA GLN 10 HA GLN 10 6.573 -18.540 -5.231 73 HB2 GLN 10 HB2 GLN 10 7.022 -16.336 -3.180 74 HB3 GLN 10 HB3 GLN 10 8.116 -17.706 -3.428 75 HG2 GLN 10 HG2 GLN 10 8.325 -17.079 -5.846 76 HG3 GLN 10 HG3 GLN 10 7.342 -15.640 -5.533 77 HE21 GLN 10 HE22 GLN 10 9.539 -14.822 -6.537 78 HE22 GLN 10 HE21 GLN 10 10.756 -14.362 -5.365 79 H GLY 11 H GLY 11 3.825 -18.211 -3.631 80 HA2 GLY 11 HA2 GLY 11 4.384 -20.600 -1.937 81 HA3 GLY 11 HA3 GLY 11 3.246 -19.329 -1.443 82 H ASN 12 H ASN 12 2.833 -19.265 -4.696 83 HA ASN 12 HA ASN 12 0.416 -20.736 -4.787 84 HB2 ASN 12 HB2 ASN 12 0.594 -20.431 -7.191 85 HB3 ASN 12 HB3 ASN 12 1.150 -18.975 -6.386 86 HD21 ASN 12 HD22 ASN 12 1.749 -20.108 -9.111 87 HD22 ASN 12 HD21 ASN 12 3.495 -20.184 -9.179 88 H SER 13 H SER 13 3.751 -21.790 -5.104 89 HA SER 13 HA SER 13 2.918 -24.367 -6.221 90 HB2 SER 13 HB2 SER 13 5.364 -24.856 -6.156 91 HB3 SER 13 HB3 SER 13 4.999 -23.347 -7.026 92 HG SER 13 HG SER 13 6.732 -23.094 -5.530 93 H LEU 14 H LEU 14 3.958 -22.959 -3.101 94 HA LEU 14 HA LEU 14 4.368 -25.374 -1.672 95 HB2 LEU 14 HB2 LEU 14 3.654 -22.515 -1.021 96 HB3 LEU 14 HB3 LEU 14 3.504 -23.734 0.232 97 HG LEU 14 HG LEU 14 5.843 -24.354 0.015 98 HD11 LEU 14 HD11 LEU 14 7.379 -22.984 -1.397 99 HD12 LEU 14 HD12 LEU 14 6.232 -23.918 -2.376 100 HD13 LEU 14 HD13 LEU 14 5.974 -22.173 -2.111 101 HD21 LEU 14 HD21 LEU 14 5.187 -22.522 1.528 102 HD22 LEU 14 HD22 LEU 14 6.815 -22.255 0.857 103 HD23 LEU 14 HD23 LEU 14 5.432 -21.348 0.205 104 H PHE 15 H PHE 15 1.449 -23.512 -2.515 105 HA PHE 15 HA PHE 15 -0.414 -24.941 -0.894 106 HB2 PHE 15 HB2 PHE 15 -0.970 -22.832 -1.917 107 HB3 PHE 15 HB3 PHE 15 -0.580 -23.436 -3.521 108 HD1 PHE 15 HD2 PHE 15 -2.801 -24.558 -0.683 109 HD2 PHE 15 HD1 PHE 15 -2.355 -23.803 -4.890 110 HE1 PHE 15 HE2 PHE 15 -5.168 -25.203 -1.043 111 HE2 PHE 15 HE1 PHE 15 -4.739 -24.417 -5.254 112 HZ PHE 15 HZ PHE 15 -6.142 -25.129 -3.337 113 H LYS 16 H LYS 16 1.325 -25.835 -3.775 114 HA LYS 16 HA LYS 16 -0.560 -28.070 -4.296 115 HB2 LYS 16 HB2 LYS 16 1.627 -26.836 -6.009 116 HB3 LYS 16 HB3 LYS 16 0.565 -28.179 -6.504 117 HG2 LYS 16 HG2 LYS 16 -1.411 -26.776 -6.296 118 HG3 LYS 16 HG3 LYS 16 -0.463 -25.458 -5.575 119 HD2 LYS 16 HD2 LYS 16 0.814 -25.196 -7.669 120 HD3 LYS 16 HD3 LYS 16 -0.179 -26.481 -8.419 121 HE2 LYS 16 HE2 LYS 16 -2.221 -25.147 -7.905 122 HE3 LYS 16 HE3 LYS 16 -1.197 -23.874 -7.212 123 HZ1 LYS 16 HZ1 LYS 16 -1.787 -23.389 -9.483 124 HZ2 LYS 16 HZ2 LYS 16 -0.164 -23.623 -9.375 125 HZ3 LYS 16 HZ3 LYS 16 -1.116 -24.796 -10.013 126 H GLN 17 H GLN 17 2.335 -27.454 -2.646 127 HA GLN 17 HA GLN 17 3.610 -30.026 -3.163 128 HB2 GLN 17 HB2 GLN 17 4.025 -27.982 -0.976 129 HB3 GLN 17 HB3 GLN 17 4.983 -29.456 -1.211 130 HG2 GLN 17 HG2 GLN 17 5.356 -28.634 -3.639 131 HG3 GLN 17 HG3 GLN 17 4.784 -27.073 -3.040 132 HE21 GLN 17 HE22 GLN 17 5.794 -26.765 -0.576 133 HE22 GLN 17 HE21 GLN 17 7.532 -26.858 -0.595 134 H GLY 18 H GLY 18 0.892 -28.994 -1.245 135 HA2 GLY 18 HA2 GLY 18 -0.575 -30.482 -0.201 136 HA3 GLY 18 HA3 GLY 18 0.677 -31.735 -0.160 137 H LEU 19 H LEU 19 1.286 -28.436 0.950 138 HA LEU 19 HA LEU 19 1.089 -29.272 3.781 139 HB2 LEU 19 HB2 LEU 19 3.289 -28.059 4.166 140 HB3 LEU 19 HB3 LEU 19 3.328 -29.668 3.432 141 HG LEU 19 HG LEU 19 3.653 -28.704 1.197 142 HD11 LEU 19 HD11 LEU 19 3.834 -26.044 2.675 143 HD12 LEU 19 HD12 LEU 19 4.248 -26.312 0.968 144 HD13 LEU 19 HD13 LEU 19 2.568 -26.506 1.512 145 HD21 LEU 19 HD21 LEU 19 5.564 -29.329 2.624 146 HD22 LEU 19 HD22 LEU 19 5.964 -27.936 1.592 147 HD23 LEU 19 HD23 LEU 19 5.591 -27.690 3.314 148 H TYR 20 H TYR 20 -0.878 -28.024 2.689 149 HA TYR 20 HA TYR 20 -1.020 -25.433 1.984 150 HB2 TYR 20 HB2 TYR 20 -2.990 -26.724 3.864 151 HB3 TYR 20 HB3 TYR 20 -3.339 -25.526 2.629 152 HD1 TYR 20 HD2 TYR 20 -1.982 -26.612 0.241 153 HD2 TYR 20 HD1 TYR 20 -4.155 -28.628 3.359 154 HE1 TYR 20 HE2 TYR 20 -2.528 -28.463 -1.319 155 HE2 TYR 20 HE1 TYR 20 -4.713 -30.458 1.795 156 HH TYR 20 HH TYR 20 -4.439 -31.315 -0.320 157 H ARG 21 H ARG 21 -0.447 -26.434 5.373 158 HA ARG 21 HA ARG 21 -1.483 -24.104 6.583 159 HB2 ARG 21 HB2 ARG 21 -0.125 -26.481 7.383 160 HB3 ARG 21 HB3 ARG 21 0.849 -25.137 8.004 161 HG2 ARG 21 HG2 ARG 21 -2.146 -25.540 8.428 162 HG3 ARG 21 HG3 ARG 21 -0.884 -25.871 9.626 163 HD2 ARG 21 HD2 ARG 21 -0.236 -23.492 9.636 164 HD3 ARG 21 HD3 ARG 21 -1.428 -23.129 8.397 165 HE ARG 21 HE ARG 21 -1.927 -23.647 11.244 166 HH11 ARG 21 HH11 ARG 21 -3.331 -23.334 8.018 167 HH12 ARG 21 HH12 ARG 21 -4.952 -23.054 8.617 168 HH21 ARG 21 HH21 ARG 21 -4.056 -23.262 11.992 169 HH22 ARG 21 HH22 ARG 21 -5.365 -23.029 10.848 170 H GLU 22 H GLU 22 1.513 -24.620 4.834 171 HA GLU 22 HA GLU 22 2.794 -22.164 5.774 172 HB2 GLU 22 HB2 GLU 22 3.283 -23.851 3.283 173 HB3 GLU 22 HB3 GLU 22 4.397 -22.673 3.989 174 HG2 GLU 22 HG2 GLU 22 3.434 -25.195 5.421 175 HG3 GLU 22 HG3 GLU 22 4.885 -25.081 4.437 176 H ALA 23 H ALA 23 0.906 -23.329 3.035 177 HA ALA 23 HA ALA 23 1.181 -21.060 1.343 178 HB1 ALA 23 HB1 ALA 23 0.632 -23.318 0.594 179 HB2 ALA 23 HB2 ALA 23 -0.956 -23.204 1.402 180 HB3 ALA 23 HB3 ALA 23 -0.577 -22.125 0.044 181 H VAL 24 H VAL 24 -0.839 -21.489 4.184 182 HA VAL 24 HA VAL 24 -2.907 -19.572 3.352 183 HB VAL 24 HB VAL 24 -1.902 -20.481 6.109 184 HG11 VAL 24 HG11 VAL 24 -4.491 -19.069 5.287 185 HG12 VAL 24 HG12 VAL 24 -4.127 -19.691 6.910 186 HG13 VAL 24 HG13 VAL 24 -3.157 -18.371 6.249 187 HG21 VAL 24 HG21 VAL 24 -4.321 -21.417 4.451 188 HG22 VAL 24 HG22 VAL 24 -2.862 -22.371 4.777 189 HG23 VAL 24 HG23 VAL 24 -3.948 -21.940 6.105 190 H HIS 25 H HIS 25 -0.022 -19.801 5.180 191 HA HIS 25 HA HIS 25 0.284 -17.137 6.148 192 HB2 HIS 25 HB2 HIS 25 1.327 -19.839 6.367 193 HB3 HIS 25 HB3 HIS 25 2.638 -18.755 6.181 194 HD2 HIS 25 HD2 HIS 25 3.250 -17.293 8.393 195 HE1 HIS 25 HE1 HIS 25 -0.083 -18.483 10.773 196 HE2 HIS 25 HE2 HIS 25 2.141 -17.216 10.777 197 H CYS 26 H CYS 26 0.350 -18.057 3.067 198 HA CYS 26 HA CYS 26 2.695 -16.368 2.330 199 HB2 CYS 26 HB2 CYS 26 1.579 -18.890 1.081 200 HB3 CYS 26 HB3 CYS 26 2.595 -17.748 0.199 201 HG CYS 26 HG CYS 26 3.207 -19.315 3.042 202 H TYR 27 H TYR 27 -0.600 -16.433 2.424 203 HA TYR 27 HA TYR 27 -0.786 -14.552 0.104 204 HB2 TYR 27 HB2 TYR 27 -2.987 -16.314 1.190 205 HB3 TYR 27 HB3 TYR 27 -3.071 -15.298 -0.251 206 HD1 TYR 27 HD2 TYR 27 -0.377 -16.124 -1.482 207 HD2 TYR 27 HD1 TYR 27 -3.530 -18.375 0.352 208 HE1 TYR 27 HE2 TYR 27 0.228 -18.081 -2.885 209 HE2 TYR 27 HE1 TYR 27 -2.924 -20.360 -1.017 210 HH TYR 27 HH TYR 27 -1.567 -21.180 -2.672 211 H ASP 28 H ASP 28 -0.996 -14.909 3.481 212 HA ASP 28 HA ASP 28 -3.214 -13.141 4.014 213 HB2 ASP 28 HB2 ASP 28 -2.240 -14.930 5.512 214 HB3 ASP 28 HB3 ASP 28 -0.833 -13.904 5.753 215 H GLN 29 H GLN 29 0.220 -12.684 3.296 216 HA GLN 29 HA GLN 29 0.447 -10.106 4.527 217 HB2 GLN 29 HB2 GLN 29 2.536 -9.949 3.514 218 HB3 GLN 29 HB3 GLN 29 2.338 -11.658 3.921 219 HG2 GLN 29 HG2 GLN 29 1.765 -10.441 1.210 220 HG3 GLN 29 HG3 GLN 29 3.310 -11.180 1.628 221 HE21 GLN 29 HE22 GLN 29 1.580 -11.940 -0.528 222 HE22 GLN 29 HE21 GLN 29 1.092 -13.596 -0.265 223 H LEU 30 H LEU 30 -1.344 -11.106 1.849 224 HA LEU 30 HA LEU 30 -1.115 -8.613 0.299 225 HB2 LEU 30 HB2 LEU 30 -3.086 -10.939 0.146 226 HB3 LEU 30 HB3 LEU 30 -2.758 -9.751 -1.122 227 HG LEU 30 HG LEU 30 -0.891 -11.886 -0.024 228 HD11 LEU 30 HD11 LEU 30 -2.243 -11.471 -2.709 229 HD12 LEU 30 HD12 LEU 30 -1.044 -12.719 -2.334 230 HD13 LEU 30 HD13 LEU 30 -2.597 -12.739 -1.501 231 HD21 LEU 30 HD21 LEU 30 0.446 -9.902 -0.546 232 HD22 LEU 30 HD22 LEU 30 0.705 -11.147 -1.772 233 HD23 LEU 30 HD23 LEU 30 -0.347 -9.772 -2.121 234 H ILE 31 H ILE 31 -3.368 -10.228 2.525 235 HA ILE 31 HA ILE 31 -5.397 -8.192 2.322 236 HB ILE 31 HB ILE 31 -4.822 -10.377 4.361 237 HG12 ILE 31 HG12 ILE 31 -6.895 -10.518 2.154 238 HG13 ILE 31 HG13 ILE 31 -5.227 -10.967 1.843 239 HG21 ILE 31 HG21 ILE 31 -7.243 -10.226 4.925 240 HG22 ILE 31 HG22 ILE 31 -6.359 -8.750 5.334 241 HG23 ILE 31 HG23 ILE 31 -7.370 -8.794 3.874 242 HD11 ILE 31 HD11 ILE 31 -6.991 -12.215 3.951 243 HD12 ILE 31 HD12 ILE 31 -6.455 -12.948 2.415 244 HD13 ILE 31 HD13 ILE 31 -5.262 -12.562 3.690 245 H THR 32 H THR 32 -2.375 -8.517 3.822 246 HA THR 32 HA THR 32 -2.878 -6.464 5.907 247 HB THR 32 HB THR 32 -0.450 -8.203 5.308 248 HG1 THR 32 HG1 THR 32 -2.180 -9.440 5.986 249 HG21 THR 32 HG21 THR 32 -1.158 -6.430 7.688 250 HG22 THR 32 HG22 THR 32 0.170 -7.611 7.681 251 HG23 THR 32 HG23 THR 32 0.216 -6.230 6.578 252 H ALA 33 H ALA 33 -1.654 -6.719 2.654 253 HA ALA 33 HA ALA 33 -0.056 -4.233 3.092 254 HB1 ALA 33 HB1 ALA 33 0.284 -6.345 0.924 255 HB2 ALA 33 HB2 ALA 33 1.266 -4.887 1.135 256 HB3 ALA 33 HB3 ALA 33 1.302 -6.154 2.384 257 H GLN 34 H GLN 34 -2.320 -5.877 0.832 258 HA GLN 34 HA GLN 34 -3.259 -3.261 -0.115 259 HB2 GLN 34 HB2 GLN 34 -2.275 -5.389 -2.052 260 HB3 GLN 34 HB3 GLN 34 -2.963 -3.830 -2.475 261 HG2 GLN 34 HG2 GLN 34 -0.326 -4.250 -1.019 262 HG3 GLN 34 HG3 GLN 34 -0.495 -3.928 -2.740 263 HE21 GLN 34 HE22 GLN 34 1.069 -2.228 -1.222 264 HE22 GLN 34 HE21 GLN 34 0.273 -0.671 -1.080 265 HA PRO 35 HA PRO 35 -6.280 -6.748 0.564 266 HB2 PRO 35 HB2 PRO 35 -8.038 -5.389 2.173 267 HB3 PRO 35 HB3 PRO 35 -6.536 -6.175 2.768 268 HG2 PRO 35 HG2 PRO 35 -6.904 -3.259 2.037 269 HG3 PRO 35 HG3 PRO 35 -6.218 -3.939 3.554 270 HD2 PRO 35 HD2 PRO 35 -4.606 -3.154 1.530 271 HD3 PRO 35 HD3 PRO 35 -4.247 -4.661 2.434 272 H GLN 36 H GLN 36 -6.213 -3.701 -0.918 273 HA GLN 36 HA GLN 36 -8.909 -3.439 -1.767 274 HB2 GLN 36 HB2 GLN 36 -7.989 -1.750 -3.343 275 HB3 GLN 36 HB3 GLN 36 -7.544 -1.528 -1.650 276 HG2 GLN 36 HG2 GLN 36 -5.559 -1.140 -2.862 277 HG3 GLN 36 HG3 GLN 36 -5.384 -2.738 -2.132 278 HE21 GLN 36 HE22 GLN 36 -4.501 -4.227 -3.476 279 HE22 GLN 36 HE21 GLN 36 -4.650 -4.218 -5.220 280 H ASN 37 H ASN 37 -7.245 -6.072 -2.428 281 HA ASN 37 HA ASN 37 -8.391 -6.284 -5.156 282 HB2 ASN 37 HB2 ASN 37 -5.559 -6.395 -4.406 283 HB3 ASN 37 HB3 ASN 37 -6.091 -7.899 -5.161 284 HD21 ASN 37 HD22 ASN 37 -7.007 -4.457 -5.715 285 HD22 ASN 37 HD21 ASN 37 -6.580 -4.446 -7.407 286 HA PRO 38 HA PRO 38 -10.091 -9.953 -3.390 287 HB2 PRO 38 HB2 PRO 38 -11.045 -11.157 -5.593 288 HB3 PRO 38 HB3 PRO 38 -11.638 -9.554 -5.099 289 HG2 PRO 38 HG2 PRO 38 -9.431 -10.098 -7.118 290 HG3 PRO 38 HG3 PRO 38 -10.953 -9.157 -7.370 291 HD2 PRO 38 HD2 PRO 38 -8.715 -7.840 -6.626 292 HD3 PRO 38 HD3 PRO 38 -10.260 -7.466 -5.892 293 H VAL 39 H VAL 39 -7.268 -9.956 -5.424 294 HA VAL 39 HA VAL 39 -6.969 -12.731 -5.950 295 HB VAL 39 HB VAL 39 -4.786 -10.658 -5.443 296 HG11 VAL 39 HG11 VAL 39 -4.852 -13.182 -7.151 297 HG12 VAL 39 HG12 VAL 39 -3.487 -12.045 -7.011 298 HG13 VAL 39 HG13 VAL 39 -3.999 -13.008 -5.609 299 HG21 VAL 39 HG21 VAL 39 -4.882 -10.273 -7.899 300 HG22 VAL 39 HG22 VAL 39 -6.332 -11.291 -7.986 301 HG23 VAL 39 HG23 VAL 39 -6.370 -9.755 -7.085 302 H GLY 40 H GLY 40 -5.972 -10.707 -3.172 303 HA2 GLY 40 HA2 GLY 40 -4.617 -12.693 -1.666 304 HA3 GLY 40 HA3 GLY 40 -5.368 -11.214 -1.032 305 H TYR 41 H TYR 41 -7.970 -12.382 -2.403 306 HA TYR 41 HA TYR 41 -8.625 -14.323 -0.248 307 HB2 TYR 41 HB2 TYR 41 -10.715 -12.665 -1.632 308 HB3 TYR 41 HB3 TYR 41 -10.796 -13.481 -0.133 309 HD1 TYR 41 HD1 TYR 41 -9.171 -10.521 -1.723 310 HD2 TYR 41 HD2 TYR 41 -10.392 -12.412 1.929 311 HE1 TYR 41 HE1 TYR 41 -8.722 -8.422 -0.499 312 HE2 TYR 41 HE2 TYR 41 -9.921 -10.314 3.176 313 HH TYR 41 HH TYR 41 -8.760 -7.349 1.515 314 H SER 42 H SER 42 -7.490 -14.676 -3.028 315 HA SER 42 HA SER 42 -9.640 -16.459 -4.076 316 HB2 SER 42 HB2 SER 42 -9.272 -14.432 -5.490 317 HB3 SER 42 HB3 SER 42 -7.579 -14.931 -5.703 318 HG SER 42 HG SER 42 -8.866 -15.679 -7.411 319 H ASN 43 H ASN 43 -6.642 -16.259 -2.604 320 HA ASN 43 HA ASN 43 -5.990 -19.019 -3.517 321 HB2 ASN 43 HB2 ASN 43 -4.086 -16.732 -2.844 322 HB3 ASN 43 HB3 ASN 43 -3.608 -18.409 -3.128 323 HD21 ASN 43 HD22 ASN 43 -4.561 -19.357 -5.301 324 HD22 ASN 43 HD21 ASN 43 -4.363 -18.307 -6.686 325 H LYS 44 H LYS 44 -5.919 -16.590 -0.809 326 HA LYS 44 HA LYS 44 -5.339 -18.599 1.195 327 HB2 LYS 44 HB2 LYS 44 -5.076 -16.101 1.412 328 HB3 LYS 44 HB3 LYS 44 -6.804 -15.940 1.381 329 HG2 LYS 44 HG2 LYS 44 -6.974 -17.379 3.420 330 HG3 LYS 44 HG3 LYS 44 -5.201 -17.510 3.447 331 HD2 LYS 44 HD2 LYS 44 -5.025 -15.062 3.731 332 HD3 LYS 44 HD3 LYS 44 -6.801 -14.924 3.648 333 HE2 LYS 44 HE2 LYS 44 -6.965 -16.415 5.651 334 HE3 LYS 44 HE3 LYS 44 -5.197 -16.427 5.760 335 HZ1 LYS 44 HZ1 LYS 44 -6.208 -14.802 7.211 336 HZ2 LYS 44 HZ2 LYS 44 -5.270 -14.045 6.095 337 HZ3 LYS 44 HZ3 LYS 44 -6.913 -14.030 5.944 338 H ALA 45 H ALA 45 -8.213 -17.142 -0.220 339 HA ALA 45 HA ALA 45 -10.188 -18.546 1.301 340 HB1 ALA 45 HB1 ALA 45 -10.415 -17.412 -1.514 341 HB2 ALA 45 HB2 ALA 45 -11.742 -17.687 -0.362 342 HB3 ALA 45 HB3 ALA 45 -10.537 -16.423 -0.033 343 H MET 46 H MET 46 -7.913 -19.928 -0.661 344 HA MET 46 HA MET 46 -9.715 -22.171 -1.422 345 HB2 MET 46 HB2 MET 46 -9.097 -20.497 -3.310 346 HB3 MET 46 HB3 MET 46 -7.471 -21.201 -3.203 347 HG2 MET 46 HG2 MET 46 -8.496 -23.455 -3.592 348 HG3 MET 46 HG3 MET 46 -10.075 -22.676 -3.783 349 HE1 MET 46 HE1 MET 46 -10.768 -21.135 -5.751 350 HE2 MET 46 HE2 MET 46 -9.409 -20.033 -5.426 351 HE3 MET 46 HE3 MET 46 -9.688 -20.639 -7.079 352 H ALA 47 H ALA 47 -7.206 -21.197 0.462 353 HA ALA 47 HA ALA 47 -5.998 -23.923 0.368 354 HB1 ALA 47 HB1 ALA 47 -4.699 -21.307 1.218 355 HB2 ALA 47 HB2 ALA 47 -3.944 -22.919 1.257 356 HB3 ALA 47 HB3 ALA 47 -4.398 -22.193 -0.301 357 H LEU 48 H LEU 48 -7.667 -21.482 2.266 358 HA LEU 48 HA LEU 48 -7.227 -22.751 4.843 359 HB2 LEU 48 HB2 LEU 48 -9.314 -20.858 3.673 360 HB3 LEU 48 HB3 LEU 48 -9.412 -21.446 5.337 361 HG LEU 48 HG LEU 48 -6.967 -20.006 4.234 362 HD11 LEU 48 HD11 LEU 48 -8.916 -18.526 4.140 363 HD12 LEU 48 HD12 LEU 48 -9.354 -18.959 5.802 364 HD13 LEU 48 HD13 LEU 48 -7.865 -18.056 5.493 365 HD21 LEU 48 HD21 LEU 48 -6.520 -21.385 6.231 366 HD22 LEU 48 HD22 LEU 48 -6.543 -19.671 6.690 367 HD23 LEU 48 HD23 LEU 48 -7.941 -20.711 7.046 368 H ILE 49 H ILE 49 -9.557 -23.094 2.161 369 HA ILE 49 HA ILE 49 -11.329 -24.881 3.473 370 HB ILE 49 HB ILE 49 -11.970 -25.571 1.179 371 HG12 ILE 49 HG12 ILE 49 -9.988 -23.504 0.248 372 HG13 ILE 49 HG13 ILE 49 -9.491 -25.167 0.368 373 HG21 ILE 49 HG21 ILE 49 -11.652 -22.557 1.522 374 HG22 ILE 49 HG22 ILE 49 -12.841 -23.381 0.504 375 HG23 ILE 49 HG23 ILE 49 -12.937 -23.537 2.265 376 HD11 ILE 49 HD11 ILE 49 -10.195 -24.736 -1.895 377 HD12 ILE 49 HD12 ILE 49 -11.181 -25.971 -1.087 378 HD13 ILE 49 HD13 ILE 49 -11.827 -24.313 -1.318 379 H LYS 50 H LYS 50 -8.171 -25.220 2.104 380 HA LYS 50 HA LYS 50 -8.447 -27.957 1.329 381 HB2 LYS 50 HB2 LYS 50 -6.767 -25.849 0.706 382 HB3 LYS 50 HB3 LYS 50 -5.714 -26.856 1.698 383 HG2 LYS 50 HG2 LYS 50 -5.325 -27.683 -0.423 384 HG3 LYS 50 HG3 LYS 50 -6.578 -28.809 0.120 385 HD2 LYS 50 HD2 LYS 50 -6.981 -26.290 -1.560 386 HD3 LYS 50 HD3 LYS 50 -6.887 -27.928 -2.231 387 HE2 LYS 50 HE2 LYS 50 -8.963 -27.011 -0.224 388 HE3 LYS 50 HE3 LYS 50 -9.201 -26.991 -1.971 389 HZ1 LYS 50 HZ1 LYS 50 -10.089 -28.996 -0.978 390 HZ2 LYS 50 HZ2 LYS 50 -8.859 -29.358 -2.010 391 HZ3 LYS 50 HZ3 LYS 50 -8.612 -29.406 -0.383 392 H LEU 51 H LEU 51 -8.177 -26.490 4.301 393 HA LEU 51 HA LEU 51 -6.740 -28.775 5.575 394 HB2 LEU 51 HB2 LEU 51 -6.846 -25.813 6.256 395 HB3 LEU 51 HB3 LEU 51 -6.235 -27.039 7.376 396 HG LEU 51 HG LEU 51 -5.096 -26.650 4.591 397 HD11 LEU 51 HD11 LEU 51 -4.167 -25.551 7.274 398 HD12 LEU 51 HD12 LEU 51 -3.269 -25.429 5.739 399 HD13 LEU 51 HD13 LEU 51 -4.825 -24.595 5.922 400 HD21 LEU 51 HD21 LEU 51 -4.654 -28.862 5.624 401 HD22 LEU 51 HD22 LEU 51 -3.174 -27.895 5.618 402 HD23 LEU 51 HD23 LEU 51 -4.112 -28.057 7.117 403 H GLY 52 H GLY 52 -9.708 -27.108 5.196 404 HA2 GLY 52 HA2 GLY 52 -11.702 -28.072 6.096 405 HA3 GLY 52 HA3 GLY 52 -10.823 -28.512 7.571 406 H GLU 53 H GLU 53 -9.747 -25.417 6.841 407 HA GLU 53 HA GLU 53 -11.468 -24.325 8.930 408 HB2 GLU 53 HB2 GLU 53 -9.295 -22.816 7.446 409 HB3 GLU 53 HB3 GLU 53 -9.987 -22.491 9.012 410 HG2 GLU 53 HG2 GLU 53 -9.042 -24.580 9.921 411 HG3 GLU 53 HG3 GLU 53 -8.341 -24.964 8.343 412 H TYR 54 H TYR 54 -13.100 -24.902 6.811 413 HA TYR 54 HA TYR 54 -13.496 -22.939 4.855 414 HB2 TYR 54 HB2 TYR 54 -15.531 -24.556 6.428 415 HB3 TYR 54 HB3 TYR 54 -15.907 -23.639 4.974 416 HD1 TYR 54 HD1 TYR 54 -15.057 -24.341 2.769 417 HD2 TYR 54 HD2 TYR 54 -14.378 -26.690 6.305 418 HE1 TYR 54 HE1 TYR 54 -14.460 -26.290 1.358 419 HE2 TYR 54 HE2 TYR 54 -13.780 -28.646 4.899 420 HH TYR 54 HH TYR 54 -13.792 -28.485 1.315 421 H THR 55 H THR 55 -14.215 -22.898 8.322 422 HA THR 55 HA THR 55 -16.015 -20.759 8.477 423 HB THR 55 HB THR 55 -13.688 -21.504 10.318 424 HG1 THR 55 HG1 THR 55 -15.283 -22.764 11.344 425 HG21 THR 55 HG21 THR 55 -15.175 -20.550 12.110 426 HG22 THR 55 HG22 THR 55 -14.636 -19.327 10.943 427 HG23 THR 55 HG23 THR 55 -16.290 -19.975 10.839 428 H GLN 56 H GLN 56 -12.584 -20.782 7.746 429 HA GLN 56 HA GLN 56 -12.335 -17.855 8.164 430 HB2 GLN 56 HB2 GLN 56 -10.285 -20.001 7.480 431 HB3 GLN 56 HB3 GLN 56 -9.941 -18.325 7.964 432 HG2 GLN 56 HG2 GLN 56 -10.944 -18.755 10.160 433 HG3 GLN 56 HG3 GLN 56 -11.428 -20.371 9.680 434 HE21 GLN 56 HE22 GLN 56 -10.329 -21.359 11.354 435 HE22 GLN 56 HE21 GLN 56 -8.596 -21.542 11.305 436 H ALA 57 H ALA 57 -12.696 -20.305 5.673 437 HA ALA 57 HA ALA 57 -11.591 -18.715 3.510 438 HB1 ALA 57 HB1 ALA 57 -11.676 -21.198 3.501 439 HB2 ALA 57 HB2 ALA 57 -13.447 -21.131 3.509 440 HB3 ALA 57 HB3 ALA 57 -12.546 -20.509 2.108 441 H ILE 58 H ILE 58 -14.865 -19.404 4.801 442 HA ILE 58 HA ILE 58 -16.395 -18.025 2.780 443 HB ILE 58 HB ILE 58 -16.798 -18.531 5.801 444 HG12 ILE 58 HG12 ILE 58 -17.914 -20.094 3.451 445 HG13 ILE 58 HG13 ILE 58 -16.470 -20.578 4.337 446 HG21 ILE 58 HG21 ILE 58 -19.134 -18.169 5.561 447 HG22 ILE 58 HG22 ILE 58 -18.389 -16.793 4.751 448 HG23 ILE 58 HG23 ILE 58 -19.030 -18.166 3.800 449 HD11 ILE 58 HD11 ILE 58 -17.804 -20.635 6.449 450 HD12 ILE 58 HD12 ILE 58 -19.271 -20.298 5.495 451 HD13 ILE 58 HD13 ILE 58 -18.366 -21.799 5.233 452 H GLN 59 H GLN 59 -14.825 -16.934 5.857 453 HA GLN 59 HA GLN 59 -15.941 -14.293 5.729 454 HB2 GLN 59 HB2 GLN 59 -13.424 -15.389 7.053 455 HB3 GLN 59 HB3 GLN 59 -14.064 -13.754 7.309 456 HG2 GLN 59 HG2 GLN 59 -16.183 -14.689 8.159 457 HG3 GLN 59 HG3 GLN 59 -15.602 -16.334 7.876 458 HE21 GLN 59 HE22 GLN 59 -16.468 -15.618 10.403 459 HE22 GLN 59 HE21 GLN 59 -15.097 -15.511 11.488 460 H MET 60 H MET 60 -12.949 -15.786 4.418 461 HA MET 60 HA MET 60 -11.909 -13.310 3.359 462 HB2 MET 60 HB2 MET 60 -11.353 -16.234 3.093 463 HB3 MET 60 HB3 MET 60 -10.832 -15.203 1.759 464 HG2 MET 60 HG2 MET 60 -9.094 -15.592 3.489 465 HG3 MET 60 HG3 MET 60 -9.413 -13.898 3.127 466 HE1 MET 60 HE1 MET 60 -10.177 -12.268 6.352 467 HE2 MET 60 HE2 MET 60 -9.309 -12.229 4.792 468 HE3 MET 60 HE3 MET 60 -11.093 -12.354 4.840 469 H CYS 61 H CYS 61 -14.185 -15.794 2.111 470 HA CYS 61 HA CYS 61 -14.041 -14.915 -0.584 471 HB2 CYS 61 HB2 CYS 61 -16.205 -16.370 0.991 472 HB3 CYS 61 HB3 CYS 61 -16.324 -16.060 -0.743 473 HG CYS 61 HG CYS 61 -13.840 -17.564 0.822 474 H GLN 62 H GLN 62 -16.281 -13.983 2.100 475 HA GLN 62 HA GLN 62 -17.668 -12.056 0.409 476 HB2 GLN 62 HB2 GLN 62 -17.674 -12.441 3.434 477 HB3 GLN 62 HB3 GLN 62 -18.864 -11.518 2.484 478 HG2 GLN 62 HG2 GLN 62 -19.546 -13.569 1.292 479 HG3 GLN 62 HG3 GLN 62 -18.309 -14.496 2.132 480 HE21 GLN 62 HE22 GLN 62 -19.640 -15.913 3.063 481 HE22 GLN 62 HE21 GLN 62 -20.881 -15.491 4.204 482 H GLN 63 H GLN 63 -14.597 -11.985 1.744 483 HA GLN 63 HA GLN 63 -14.663 -9.018 2.079 484 HB2 GLN 63 HB2 GLN 63 -12.738 -11.186 2.993 485 HB3 GLN 63 HB3 GLN 63 -12.346 -9.459 3.079 486 HG2 GLN 63 HG2 GLN 63 -14.888 -10.511 4.351 487 HG3 GLN 63 HG3 GLN 63 -13.321 -10.661 5.166 488 HE21 GLN 63 HE22 GLN 63 -13.460 -9.208 6.806 489 HE22 GLN 63 HE21 GLN 63 -13.759 -7.504 6.577 490 H GLY 64 H GLY 64 -14.106 -11.356 -0.256 491 HA2 GLY 64 HA2 GLY 64 -12.005 -9.698 -1.595 492 HA3 GLY 64 HA3 GLY 64 -12.342 -11.401 -1.920 493 H LEU 65 H LEU 65 -15.284 -11.125 -1.859 494 HA LEU 65 HA LEU 65 -15.812 -10.256 -4.526 495 HB2 LEU 65 HB2 LEU 65 -17.488 -10.889 -2.086 496 HB3 LEU 65 HB3 LEU 65 -18.248 -10.334 -3.581 497 HG LEU 65 HG LEU 65 -16.387 -12.747 -3.488 498 HD11 LEU 65 HD11 LEU 65 -19.441 -12.587 -3.419 499 HD12 LEU 65 HD12 LEU 65 -18.471 -14.077 -3.558 500 HD13 LEU 65 HD13 LEU 65 -18.386 -13.105 -2.077 501 HD21 LEU 65 HD21 LEU 65 -18.401 -11.746 -5.554 502 HD22 LEU 65 HD22 LEU 65 -16.629 -11.718 -5.714 503 HD23 LEU 65 HD23 LEU 65 -17.484 -13.271 -5.642 504 H ARG 66 H ARG 66 -15.106 -8.429 -1.776 505 HA ARG 66 HA ARG 66 -16.695 -6.065 -2.440 506 HB2 ARG 66 HB2 ARG 66 -14.264 -6.403 -0.624 507 HB3 ARG 66 HB3 ARG 66 -15.400 -5.046 -0.643 508 HG2 ARG 66 HG2 ARG 66 -17.224 -6.605 0.069 509 HG3 ARG 66 HG3 ARG 66 -16.042 -7.927 0.118 510 HD2 ARG 66 HD2 ARG 66 -16.354 -7.052 2.361 511 HD3 ARG 66 HD3 ARG 66 -14.720 -6.664 1.787 512 HE ARG 66 HE ARG 66 -16.570 -4.523 1.205 513 HH11 ARG 66 HH11 ARG 66 -14.734 -5.983 3.853 514 HH12 ARG 66 HH12 ARG 66 -14.627 -4.488 4.750 515 HH21 ARG 66 HH21 ARG 66 -16.411 -2.597 2.397 516 HH22 ARG 66 HH22 ARG 66 -15.581 -2.577 3.932 517 H TYR 67 H TYR 67 -14.176 -7.528 -4.012 518 HA TYR 67 HA TYR 67 -12.868 -4.978 -4.834 519 HB2 TYR 67 HB2 TYR 67 -11.535 -7.517 -3.868 520 HB3 TYR 67 HB3 TYR 67 -10.680 -6.147 -4.572 521 HD1 TYR 67 HD2 TYR 67 -11.360 -3.769 -3.409 522 HD2 TYR 67 HD1 TYR 67 -11.578 -7.652 -1.566 523 HE1 TYR 67 HE2 TYR 67 -11.320 -2.710 -1.173 524 HE2 TYR 67 HE1 TYR 67 -11.521 -6.598 0.675 525 HH TYR 67 HH TYR 67 -11.428 -4.638 1.862 526 H THR 68 H THR 68 -14.528 -7.719 -5.800 527 HA THR 68 HA THR 68 -13.043 -8.106 -8.305 528 HB THR 68 HB THR 68 -14.915 -9.752 -8.741 529 HG1 THR 68 HG1 THR 68 -16.481 -8.802 -7.397 530 HG21 THR 68 HG21 THR 68 -14.063 -11.358 -7.095 531 HG22 THR 68 HG22 THR 68 -12.733 -10.341 -7.695 532 HG23 THR 68 HG23 THR 68 -13.446 -10.027 -6.102 533 H SER 69 H SER 69 -14.451 -5.508 -7.522 534 HA SER 69 HA SER 69 -16.739 -5.183 -9.199 535 HB2 SER 69 HB2 SER 69 -14.847 -3.118 -8.003 536 HB3 SER 69 HB3 SER 69 -16.499 -2.816 -8.594 537 HG SER 69 HG SER 69 -16.440 -3.129 -6.320 538 H THR 70 H THR 70 -13.925 -5.997 -10.498 539 HA THR 70 HA THR 70 -14.239 -4.081 -12.753 540 HB THR 70 HB THR 70 -11.890 -3.710 -12.943 541 HG1 THR 70 HG1 THR 70 -10.433 -4.696 -11.565 542 HG21 THR 70 HG21 THR 70 -12.541 -3.438 -9.978 543 HG22 THR 70 HG22 THR 70 -11.296 -2.556 -10.881 544 HG23 THR 70 HG23 THR 70 -13.012 -2.268 -11.247 545 H ALA 71 H ALA 71 -13.035 -4.838 -14.718 546 HA ALA 71 HA ALA 71 -13.761 -7.551 -15.305 547 HB1 ALA 71 HB1 ALA 71 -12.804 -7.031 -17.510 548 HB2 ALA 71 HB2 ALA 71 -13.825 -5.696 -16.945 549 HB3 ALA 71 HB3 ALA 71 -12.048 -5.563 -16.851 550 H GLU 72 H GLU 72 -10.945 -6.205 -13.834 551 HA GLU 72 HA GLU 72 -9.027 -8.099 -14.891 552 HB2 GLU 72 HB2 GLU 72 -8.972 -6.244 -12.506 553 HB3 GLU 72 HB3 GLU 72 -7.619 -7.269 -13.000 554 HG2 GLU 72 HG2 GLU 72 -7.176 -5.151 -13.945 555 HG3 GLU 72 HG3 GLU 72 -7.715 -6.178 -15.277 556 H HIS 73 H HIS 73 -11.667 -8.604 -12.965 557 HA HIS 73 HA HIS 73 -10.400 -10.943 -11.640 558 HB2 HIS 73 HB2 HIS 73 -12.524 -9.268 -10.291 559 HB3 HIS 73 HB3 HIS 73 -11.474 -10.477 -9.577 560 HD2 HIS 73 HD2 HIS 73 -11.898 -6.885 -9.683 561 HE1 HIS 73 HE1 HIS 73 -7.713 -7.301 -9.117 562 HE2 HIS 73 HE2 HIS 73 -9.670 -5.672 -9.041 563 H VAL 74 H VAL 74 -12.104 -10.499 -14.116 564 HA VAL 74 HA VAL 74 -14.802 -10.979 -13.759 565 HB VAL 74 HB VAL 74 -13.597 -10.377 -15.843 566 HG11 VAL 74 HG11 VAL 74 -12.990 -13.358 -16.041 567 HG12 VAL 74 HG12 VAL 74 -12.683 -12.137 -17.292 568 HG13 VAL 74 HG13 VAL 74 -11.796 -12.063 -15.762 569 HG21 VAL 74 HG21 VAL 74 -15.432 -12.785 -16.131 570 HG22 VAL 74 HG22 VAL 74 -15.964 -11.104 -15.874 571 HG23 VAL 74 HG23 VAL 74 -15.103 -11.552 -17.365 572 H ALA 75 H ALA 75 -12.193 -13.318 -13.362 573 HA ALA 75 HA ALA 75 -14.165 -15.548 -13.262 574 HB1 ALA 75 HB1 ALA 75 -12.090 -15.891 -14.547 575 HB2 ALA 75 HB2 ALA 75 -11.126 -15.525 -13.093 576 HB3 ALA 75 HB3 ALA 75 -12.155 -16.972 -13.130 577 H ILE 76 H ILE 76 -11.790 -13.805 -11.170 578 HA ILE 76 HA ILE 76 -12.197 -15.421 -8.853 579 HB ILE 76 HB ILE 76 -11.421 -12.494 -9.185 580 HG12 ILE 76 HG12 ILE 76 -9.754 -15.015 -8.807 581 HG13 ILE 76 HG13 ILE 76 -9.866 -14.036 -10.273 582 HG21 ILE 76 HG21 ILE 76 -11.172 -14.297 -6.753 583 HG22 ILE 76 HG22 ILE 76 -10.496 -12.662 -6.891 584 HG23 ILE 76 HG23 ILE 76 -12.243 -12.884 -6.900 585 HD11 ILE 76 HD11 ILE 76 -8.920 -12.086 -9.030 586 HD12 ILE 76 HD12 ILE 76 -8.649 -13.163 -7.643 587 HD13 ILE 76 HD13 ILE 76 -7.817 -13.473 -9.177 588 H ARG 77 H ARG 77 -14.062 -12.804 -10.329 589 HA ARG 77 HA ARG 77 -15.774 -12.062 -8.223 590 HB2 ARG 77 HB2 ARG 77 -15.489 -10.992 -10.480 591 HB3 ARG 77 HB3 ARG 77 -16.348 -12.364 -11.196 592 HG2 ARG 77 HG2 ARG 77 -18.355 -11.804 -9.838 593 HG3 ARG 77 HG3 ARG 77 -17.480 -10.408 -9.155 594 HD2 ARG 77 HD2 ARG 77 -17.183 -9.513 -11.455 595 HD3 ARG 77 HD3 ARG 77 -18.025 -10.929 -12.102 596 HE ARG 77 HE ARG 77 -20.074 -10.079 -11.361 597 HH11 ARG 77 HH11 ARG 77 -17.429 -8.019 -10.226 598 HH12 ARG 77 HH12 ARG 77 -18.501 -6.732 -9.736 599 HH21 ARG 77 HH21 ARG 77 -21.434 -8.375 -10.724 600 HH22 ARG 77 HH22 ARG 77 -20.753 -6.930 -10.016 601 H SER 78 H SER 78 -15.564 -15.042 -9.990 602 HA SER 78 HA SER 78 -18.209 -15.917 -8.903 603 HB2 SER 78 HB2 SER 78 -16.631 -16.912 -11.310 604 HB3 SER 78 HB3 SER 78 -18.172 -17.589 -10.723 605 HG SER 78 HG SER 78 -18.470 -16.052 -12.415 606 H LYS 79 H LYS 79 -14.767 -16.359 -8.531 607 HA LYS 79 HA LYS 79 -15.052 -19.130 -7.678 608 HB2 LYS 79 HB2 LYS 79 -12.771 -17.123 -7.445 609 HB3 LYS 79 HB3 LYS 79 -12.694 -18.792 -6.886 610 HG2 LYS 79 HG2 LYS 79 -12.988 -17.820 -9.745 611 HG3 LYS 79 HG3 LYS 79 -11.646 -18.706 -9.028 612 HD2 LYS 79 HD2 LYS 79 -14.425 -19.733 -9.707 613 HD3 LYS 79 HD3 LYS 79 -12.867 -20.255 -10.356 614 HE2 LYS 79 HE2 LYS 79 -12.255 -21.015 -7.994 615 HE3 LYS 79 HE3 LYS 79 -13.944 -20.694 -7.538 616 HZ1 LYS 79 HZ1 LYS 79 -13.068 -22.568 -9.646 617 HZ2 LYS 79 HZ2 LYS 79 -13.607 -22.992 -8.149 618 HZ3 LYS 79 HZ3 LYS 79 -14.628 -22.269 -9.223 619 H LEU 80 H LEU 80 -14.966 -15.900 -6.093 620 HA LEU 80 HA LEU 80 -14.933 -17.076 -3.432 621 HB2 LEU 80 HB2 LEU 80 -15.280 -14.303 -4.614 622 HB3 LEU 80 HB3 LEU 80 -15.499 -14.622 -2.885 623 HG LEU 80 HG LEU 80 -13.229 -15.339 -2.618 624 HD11 LEU 80 HD11 LEU 80 -11.592 -15.184 -4.522 625 HD12 LEU 80 HD12 LEU 80 -12.744 -16.522 -4.680 626 HD13 LEU 80 HD13 LEU 80 -12.962 -15.035 -5.631 627 HD21 LEU 80 HD21 LEU 80 -12.071 -13.250 -3.270 628 HD22 LEU 80 HD22 LEU 80 -13.423 -12.841 -4.349 629 HD23 LEU 80 HD23 LEU 80 -13.689 -12.936 -2.594 630 H GLN 81 H GLN 81 -17.197 -16.932 -5.893 631 HA GLN 81 HA GLN 81 -19.499 -16.927 -4.020 632 HB2 GLN 81 HB2 GLN 81 -19.049 -16.482 -6.951 633 HB3 GLN 81 HB3 GLN 81 -20.524 -17.310 -6.512 634 HG2 GLN 81 HG2 GLN 81 -19.646 -14.583 -5.506 635 HG3 GLN 81 HG3 GLN 81 -20.959 -14.927 -6.646 636 HE21 GLN 81 HE22 GLN 81 -22.136 -17.215 -5.333 637 HE22 GLN 81 HE21 GLN 81 -22.851 -16.640 -3.848 638 H TYR 82 H TYR 82 -17.702 -18.889 -6.445 639 HA TYR 82 HA TYR 82 -19.382 -21.188 -6.350 640 HB2 TYR 82 HB2 TYR 82 -17.695 -20.853 -8.115 641 HB3 TYR 82 HB3 TYR 82 -16.433 -20.689 -6.916 642 HD1 TYR 82 HD2 TYR 82 -18.692 -23.118 -8.566 643 HD2 TYR 82 HD1 TYR 82 -15.342 -22.572 -5.932 644 HE1 TYR 82 HE2 TYR 82 -18.192 -25.545 -8.710 645 HE2 TYR 82 HE1 TYR 82 -14.834 -24.994 -6.059 646 HH TYR 82 HH TYR 82 -15.421 -27.022 -6.942 647 H ARG 83 H ARG 83 -16.305 -20.461 -4.517 648 HA ARG 83 HA ARG 83 -16.602 -22.982 -3.123 649 HB2 ARG 83 HB2 ARG 83 -14.403 -21.929 -3.571 650 HB3 ARG 83 HB3 ARG 83 -14.828 -20.582 -2.505 651 HG2 ARG 83 HG2 ARG 83 -13.375 -22.283 -1.421 652 HG3 ARG 83 HG3 ARG 83 -14.914 -22.040 -0.577 653 HD2 ARG 83 HD2 ARG 83 -14.388 -24.413 -0.670 654 HD3 ARG 83 HD3 ARG 83 -15.816 -24.098 -1.658 655 HE ARG 83 HE ARG 83 -13.503 -23.941 -3.316 656 HH11 ARG 83 HH11 ARG 83 -15.398 -26.316 -1.517 657 HH12 ARG 83 HH12 ARG 83 -14.939 -27.649 -2.554 658 HH21 ARG 83 HH21 ARG 83 -12.897 -25.708 -4.644 659 HH22 ARG 83 HH22 ARG 83 -13.539 -27.300 -4.320 660 H LEU 84 H LEU 84 -17.643 -19.659 -2.585 661 HA LEU 84 HA LEU 84 -18.402 -20.000 0.171 662 HB2 LEU 84 HB2 LEU 84 -17.920 -17.840 -0.943 663 HB3 LEU 84 HB3 LEU 84 -19.320 -18.079 -2.008 664 HG LEU 84 HG LEU 84 -20.792 -18.037 0.030 665 HD11 LEU 84 HD11 LEU 84 -18.251 -17.192 1.442 666 HD12 LEU 84 HD12 LEU 84 -19.903 -17.239 2.114 667 HD13 LEU 84 HD13 LEU 84 -19.093 -18.747 1.673 668 HD21 LEU 84 HD21 LEU 84 -20.398 -16.015 -1.337 669 HD22 LEU 84 HD22 LEU 84 -20.596 -15.604 0.382 670 HD23 LEU 84 HD23 LEU 84 -18.969 -15.627 -0.344 671 H GLU 85 H GLU 85 -19.716 -20.996 -2.888 672 HA GLU 85 HA GLU 85 -22.461 -21.352 -1.940 673 HB2 GLU 85 HB2 GLU 85 -20.952 -21.526 -4.515 674 HB3 GLU 85 HB3 GLU 85 -22.371 -22.538 -4.381 675 HG2 GLU 85 HG2 GLU 85 -23.780 -20.636 -3.817 676 HG3 GLU 85 HG3 GLU 85 -22.374 -19.569 -3.723 677 H LEU 86 H LEU 86 -19.589 -23.063 -1.497 678 HA LEU 86 HA LEU 86 -21.146 -25.575 -1.030 679 HB2 LEU 86 HB2 LEU 86 -18.324 -25.233 -2.125 680 HB3 LEU 86 HB3 LEU 86 -18.868 -26.707 -1.340 681 HG LEU 86 HG LEU 86 -18.997 -27.128 -3.614 682 HD11 LEU 86 HD11 LEU 86 -21.846 -26.461 -2.784 683 HD12 LEU 86 HD12 LEU 86 -21.329 -27.653 -3.992 684 HD13 LEU 86 HD13 LEU 86 -20.935 -27.906 -2.273 685 HD21 LEU 86 HD21 LEU 86 -20.213 -25.804 -5.256 686 HD22 LEU 86 HD22 LEU 86 -20.643 -24.613 -4.017 687 HD23 LEU 86 HD23 LEU 86 -18.939 -24.844 -4.485 688 H ALA 87 H ALA 87 -18.971 -23.121 0.226 689 HA ALA 87 HA ALA 87 -17.895 -24.650 2.390 690 HB1 ALA 87 HB1 ALA 87 -18.463 -21.657 2.182 691 HB2 ALA 87 HB2 ALA 87 -17.383 -22.454 3.344 692 HB3 ALA 87 HB3 ALA 87 -16.988 -22.474 1.617 693 H GLN 88 H GLN 88 -20.978 -22.960 1.884 694 HA GLN 88 HA GLN 88 -21.842 -23.028 4.623 695 HB2 GLN 88 HB2 GLN 88 -23.344 -22.787 1.985 696 HB3 GLN 88 HB3 GLN 88 -24.038 -22.492 3.592 697 HG2 GLN 88 HG2 GLN 88 -22.387 -20.681 3.984 698 HG3 GLN 88 HG3 GLN 88 -21.697 -20.968 2.382 699 HE21 GLN 88 HE22 GLN 88 -22.435 -19.697 0.761 700 HE22 GLN 88 HE21 GLN 88 -23.977 -18.854 0.774 701 H GLY 89 H GLY 89 -21.058 -25.588 2.781 702 HA2 GLY 89 HA2 GLY 89 -23.090 -27.341 4.052 703 HA3 GLY 89 HA3 GLY 89 -22.751 -27.474 2.308 704 H ALA 90 H ALA 90 -20.061 -26.543 4.309 705 HA ALA 90 HA ALA 90 -19.170 -29.333 4.712 706 HB1 ALA 90 HB1 ALA 90 -17.613 -27.278 3.096 707 HB2 ALA 90 HB2 ALA 90 -17.022 -28.889 3.573 708 HB3 ALA 90 HB3 ALA 90 -18.390 -28.738 2.448 709 H VAL 91 H VAL 91 -19.341 -26.048 5.711 710 HA VAL 91 HA VAL 91 -16.977 -25.982 7.359 711 HB VAL 91 HB VAL 91 -18.236 -24.041 6.437 712 HG11 VAL 91 HG11 VAL 91 -20.259 -24.647 8.623 713 HG12 VAL 91 HG12 VAL 91 -20.248 -23.229 7.557 714 HG13 VAL 91 HG13 VAL 91 -20.537 -24.838 6.873 715 HG21 VAL 91 HG21 VAL 91 -18.017 -23.984 9.473 716 HG22 VAL 91 HG22 VAL 91 -16.652 -23.800 8.347 717 HG23 VAL 91 HG23 VAL 91 -17.953 -22.591 8.377 718 H GLY 92 H GLY 92 -20.023 -27.523 7.628 719 HA2 GLY 92 HA2 GLY 92 -19.397 -28.574 10.268 720 HA3 GLY 92 HA3 GLY 92 -20.766 -27.435 10.285 721 H SER 93 H SER 93 -19.993 -29.585 7.553 722 HA SER 93 HA SER 93 -22.634 -30.590 7.354 723 HB2 SER 93 HB2 SER 93 -21.616 -32.185 5.740 724 HB3 SER 93 HB3 SER 93 -21.125 -30.503 5.460 725 HG SER 93 HG SER 93 -19.356 -31.953 5.398 726 H VAL 94 H VAL 94 -23.021 -33.053 7.190 727 HA VAL 94 HA VAL 94 -21.912 -34.510 9.474 728 HB VAL 94 HB VAL 94 -23.664 -32.983 10.341 729 HG11 VAL 94 HG11 VAL 94 -26.011 -33.309 9.802 730 HG12 VAL 94 HG12 VAL 94 -25.102 -32.925 8.325 731 HG13 VAL 94 HG13 VAL 94 -25.613 -34.603 8.651 732 HG21 VAL 94 HG21 VAL 94 -24.519 -35.895 10.551 733 HG22 VAL 94 HG22 VAL 94 -23.205 -35.137 11.478 734 HG23 VAL 94 HG23 VAL 94 -24.876 -34.585 11.685 735 H GLN 95 H GLN 95 -21.652 -34.956 6.742 736 HA GLN 95 HA GLN 95 -23.507 -36.833 5.685 737 HB2 GLN 95 HB2 GLN 95 -21.728 -37.352 4.074 738 HB3 GLN 95 HB3 GLN 95 -21.931 -35.600 4.291 739 HG2 GLN 95 HG2 GLN 95 -19.862 -36.996 5.973 740 HG3 GLN 95 HG3 GLN 95 -19.520 -36.711 4.258 741 HE21 GLN 95 HE22 GLN 95 -19.480 -35.315 7.374 742 HE22 GLN 95 HE21 GLN 95 -19.304 -33.640 6.875 743 H ILE 96 H ILE 96 -21.906 -37.316 8.480 744 HA ILE 96 HA ILE 96 -21.802 -40.244 8.130 745 HB ILE 96 HB ILE 96 -19.670 -40.240 9.517 746 HG12 ILE 96 HG12 ILE 96 -19.488 -37.346 8.539 747 HG13 ILE 96 HG13 ILE 96 -19.789 -37.824 10.218 748 HG21 ILE 96 HG21 ILE 96 -19.470 -39.071 6.717 749 HG22 ILE 96 HG22 ILE 96 -18.262 -40.060 7.555 750 HG23 ILE 96 HG23 ILE 96 -19.817 -40.772 7.093 751 HD11 ILE 96 HD11 ILE 96 -17.289 -38.449 8.584 752 HD12 ILE 96 HD12 ILE 96 -17.429 -37.308 9.933 753 HD13 ILE 96 HD13 ILE 96 -17.616 -39.059 10.226 754 HA PRO 97 HA PRO 97 -23.938 -38.438 11.878 755 HB2 PRO 97 HB2 PRO 97 -26.442 -39.433 11.497 756 HB3 PRO 97 HB3 PRO 97 -25.853 -37.984 10.616 757 HG2 PRO 97 HG2 PRO 97 -25.874 -40.865 9.656 758 HG3 PRO 97 HG3 PRO 97 -26.516 -39.414 8.806 759 HD2 PRO 97 HD2 PRO 97 -24.024 -40.409 8.292 760 HD3 PRO 97 HD3 PRO 97 -24.332 -38.650 8.324 761 H VAL 98 H VAL 98 -25.080 -39.559 13.667 762 HA VAL 98 HA VAL 98 -24.603 -42.470 13.800 763 HB VAL 98 HB VAL 98 -23.521 -42.221 16.022 764 HG11 VAL 98 HG11 VAL 98 -22.062 -40.693 13.826 765 HG12 VAL 98 HG12 VAL 98 -21.327 -41.501 15.225 766 HG13 VAL 98 HG13 VAL 98 -22.144 -42.467 13.973 767 HG21 VAL 98 HG21 VAL 98 -23.427 -39.253 15.329 768 HG22 VAL 98 HG22 VAL 98 -24.420 -39.987 16.623 769 HG23 VAL 98 HG23 VAL 98 -22.649 -40.031 16.722 770 H VAL 99 H VAL 99 -26.865 -40.283 13.810 771 HA VAL 99 HA VAL 99 -28.443 -41.568 15.946 772 HB VAL 99 HB VAL 99 -27.304 -39.511 16.849 773 HG11 VAL 99 HG11 VAL 99 -29.120 -38.020 14.912 774 HG12 VAL 99 HG12 VAL 99 -28.097 -37.300 16.173 775 HG13 VAL 99 HG13 VAL 99 -27.350 -38.140 14.795 776 HG21 VAL 99 HG21 VAL 99 -30.333 -39.278 16.757 777 HG22 VAL 99 HG22 VAL 99 -29.416 -40.374 17.812 778 HG23 VAL 99 HG23 VAL 99 -29.236 -38.617 17.980 779 H GLU 100 H GLU 100 -28.183 -41.271 12.852 780 HA GLU 100 HA GLU 100 -30.461 -39.938 11.847 781 HB2 GLU 100 HB2 GLU 100 -30.082 -41.244 9.835 782 HB3 GLU 100 HB3 GLU 100 -28.535 -40.684 10.489 783 HG2 GLU 100 HG2 GLU 100 -28.169 -42.897 11.545 784 HG3 GLU 100 HG3 GLU 100 -29.712 -43.474 10.889 785 H VAL 101 H VAL 101 -32.263 -41.132 10.627 786 HA VAL 101 HA VAL 101 -33.357 -43.383 12.181 787 HB VAL 101 HB VAL 101 -34.085 -41.134 13.034 788 HG11 VAL 101 HG11 VAL 101 -35.584 -40.988 10.390 789 HG12 VAL 101 HG12 VAL 101 -35.758 -39.872 11.754 790 HG13 VAL 101 HG13 VAL 101 -34.222 -39.953 10.871 791 HG21 VAL 101 HG21 VAL 101 -35.426 -43.200 13.390 792 HG22 VAL 101 HG22 VAL 101 -36.431 -41.734 13.280 793 HG23 VAL 101 HG23 VAL 101 -36.339 -42.837 11.902 794 H ASP 102 H ASP 102 -35.312 -44.320 11.042 795 HA ASP 102 HA ASP 102 -35.375 -43.912 8.129 796 HB2 ASP 102 HB2 ASP 102 -33.567 -45.554 8.649 797 HB3 ASP 102 HB3 ASP 102 -34.786 -46.586 9.416 798 H GLU 103 H GLU 103 -37.106 -45.509 7.197 799 HA GLU 103 HA GLU 103 -39.578 -45.028 8.554 800 HB2 GLU 103 HB2 GLU 103 -39.029 -47.025 6.334 801 HB3 GLU 103 HB3 GLU 103 -40.590 -46.313 6.759 802 HG2 GLU 103 HG2 GLU 103 -39.719 -44.053 6.198 803 HG3 GLU 103 HG3 GLU 103 -38.188 -44.786 5.682 804 H LEU 104 H LEU 104 -41.145 -47.121 8.493 805 HA LEU 104 HA LEU 104 -40.440 -48.535 10.897 806 HB2 LEU 104 HB2 LEU 104 -42.679 -49.253 8.993 807 HB3 LEU 104 HB3 LEU 104 -42.645 -49.475 10.731 808 HG LEU 104 HG LEU 104 -42.809 -46.810 9.303 809 HD11 LEU 104 HD11 LEU 104 -44.878 -48.149 9.248 810 HD12 LEU 104 HD12 LEU 104 -44.801 -48.332 11.017 811 HD13 LEU 104 HD13 LEU 104 -45.052 -46.726 10.300 812 HD21 LEU 104 HD21 LEU 104 -42.822 -47.474 12.280 813 HD22 LEU 104 HD22 LEU 104 -41.536 -46.606 11.417 814 HD23 LEU 104 HD23 LEU 104 -43.147 -45.878 11.572 815 HA PRO 105 HA PRO 105 -38.598 -52.155 9.180 816 HB2 PRO 105 HB2 PRO 105 -39.152 -54.093 10.988 817 HB3 PRO 105 HB3 PRO 105 -38.254 -52.611 11.464 818 HG2 PRO 105 HG2 PRO 105 -41.203 -53.197 11.811 819 HG3 PRO 105 HG3 PRO 105 -40.061 -52.544 13.024 820 HD2 PRO 105 HD2 PRO 105 -41.747 -51.013 11.466 821 HD3 PRO 105 HD3 PRO 105 -40.199 -50.385 12.081 822 H GLU 106 H GLU 106 -41.638 -51.588 8.474 823 HA GLU 106 HA GLU 106 -43.277 -52.580 7.271 824 HB2 GLU 106 HB2 GLU 106 -40.928 -54.262 6.336 825 HB3 GLU 106 HB3 GLU 106 -42.513 -54.205 5.540 826 HG2 GLU 106 HG2 GLU 106 -42.253 -51.753 5.233 827 HG3 GLU 106 HG3 GLU 106 -40.644 -51.836 5.975 828 H GLY 107 H GLY 107 -42.672 -53.661 9.999 829 HA2 GLY 107 HA2 GLY 107 -44.474 -55.977 9.849 830 HA3 GLY 107 HA3 GLY 107 -42.856 -56.290 10.510 831 H TYR 108 H TYR 108 -44.146 -53.100 10.996 832 HA TYR 108 HA TYR 108 -44.094 -53.315 13.826 833 HB2 TYR 108 HB2 TYR 108 -44.703 -51.065 13.861 834 HB3 TYR 108 HB3 TYR 108 -43.661 -51.271 12.451 835 HD1 TYR 108 HD2 TYR 108 -45.105 -51.889 10.197 836 HD2 TYR 108 HD1 TYR 108 -46.504 -49.699 13.621 837 HE1 TYR 108 HE2 TYR 108 -46.838 -50.808 8.786 838 HE2 TYR 108 HE1 TYR 108 -48.258 -48.624 12.227 839 HH TYR 108 HH TYR 108 -49.175 -48.445 10.131 840 H ASP 109 H ASP 109 -46.248 -52.086 14.899 841 HA ASP 109 HA ASP 109 -48.499 -53.925 14.335 842 HB2 ASP 109 HB2 ASP 109 -46.890 -54.874 16.017 843 HB3 ASP 109 HB3 ASP 109 -47.243 -53.500 17.068 844 H ARG 110 H ARG 110 -48.323 -51.121 13.739 845 HA ARG 110 HA ARG 110 -50.498 -50.102 15.507 846 HB2 ARG 110 HB2 ARG 110 -48.089 -48.520 14.544 847 HB3 ARG 110 HB3 ARG 110 -49.485 -47.863 15.400 848 HG2 ARG 110 HG2 ARG 110 -48.979 -49.345 17.339 849 HG3 ARG 110 HG3 ARG 110 -47.543 -49.943 16.484 850 HD2 ARG 110 HD2 ARG 110 -46.642 -47.641 16.369 851 HD3 ARG 110 HD3 ARG 110 -48.070 -47.047 17.245 852 HE ARG 110 HE ARG 110 -46.880 -49.123 18.772 853 HH11 ARG 110 HH11 ARG 110 -46.188 -45.815 17.732 854 HH12 ARG 110 HH12 ARG 110 -45.210 -45.457 19.127 855 HH21 ARG 110 HH21 ARG 110 -45.611 -48.617 20.597 856 HH22 ARG 110 HH22 ARG 110 -44.880 -47.040 20.748 857 H SER 111 H SER 111 -51.251 -47.880 14.366 858 HA SER 111 HA SER 111 -51.516 -48.249 11.443 859 HB2 SER 111 HB2 SER 111 -53.879 -48.116 13.368 860 HB3 SER 111 HB3 SER 111 -53.980 -48.061 11.590 861 HG SER 111 HG SER 111 -54.317 -50.180 12.437 Start of MODEL 13 1 H1 SER 2 H1 SER 2 4.744 -5.530 -9.312 2 H2 SER 2 H2 SER 2 3.952 -6.628 -8.379 3 H3 SER 2 H3 SER 2 5.400 -7.019 -9.064 4 HA SER 2 HA SER 2 6.530 -5.375 -7.757 5 HB2 SER 2 HB2 SER 2 5.316 -4.244 -5.952 6 HB3 SER 2 HB3 SER 2 4.604 -3.839 -7.530 7 HG SER 2 HG SER 2 3.010 -4.390 -5.982 8 H GLN 3 H GLN 3 6.643 -5.612 -5.106 9 HA GLN 3 HA GLN 3 7.290 -8.332 -4.651 10 HB2 GLN 3 HB2 GLN 3 6.790 -6.060 -2.694 11 HB3 GLN 3 HB3 GLN 3 7.555 -7.612 -2.283 12 HG2 GLN 3 HG2 GLN 3 9.337 -7.174 -3.958 13 HG3 GLN 3 HG3 GLN 3 8.622 -5.596 -4.312 14 HE21 GLN 3 HE22 GLN 3 11.254 -5.737 -3.491 15 HE22 GLN 3 HE21 GLN 3 11.398 -5.101 -1.865 16 H PHE 4 H PHE 4 4.218 -6.703 -4.449 17 HA PHE 4 HA PHE 4 2.870 -8.303 -2.533 18 HB2 PHE 4 HB2 PHE 4 1.960 -6.258 -3.499 19 HB3 PHE 4 HB3 PHE 4 1.990 -6.941 -5.105 20 HD1 PHE 4 HD2 PHE 4 0.526 -9.150 -5.457 21 HD2 PHE 4 HD1 PHE 4 -0.047 -6.275 -2.315 22 HE1 PHE 4 HE2 PHE 4 -1.786 -9.935 -5.175 23 HE2 PHE 4 HE1 PHE 4 -2.405 -7.020 -2.071 24 HZ PHE 4 HZ PHE 4 -3.281 -8.844 -3.517 25 H GLU 5 H GLU 5 3.326 -8.716 -6.084 26 HA GLU 5 HA GLU 5 1.890 -11.238 -6.120 27 HB2 GLU 5 HB2 GLU 5 3.719 -9.885 -8.144 28 HB3 GLU 5 HB3 GLU 5 2.738 -11.326 -8.471 29 HG2 GLU 5 HG2 GLU 5 0.677 -10.089 -8.001 30 HG3 GLU 5 HG3 GLU 5 1.605 -8.647 -7.546 31 H LYS 6 H LYS 6 5.231 -10.251 -5.589 32 HA LYS 6 HA LYS 6 6.498 -12.704 -6.357 33 HB2 LYS 6 HB2 LYS 6 7.619 -10.553 -6.159 34 HB3 LYS 6 HB3 LYS 6 7.431 -10.631 -4.396 35 HG2 LYS 6 HG2 LYS 6 8.828 -12.575 -4.234 36 HG3 LYS 6 HG3 LYS 6 8.771 -12.844 -5.990 37 HD2 LYS 6 HD2 LYS 6 9.952 -10.763 -6.387 38 HD3 LYS 6 HD3 LYS 6 9.997 -10.413 -4.644 39 HE2 LYS 6 HE2 LYS 6 11.313 -12.485 -4.267 40 HE3 LYS 6 HE3 LYS 6 11.277 -12.823 -6.008 41 HZ1 LYS 6 HZ1 LYS 6 12.474 -10.765 -6.367 42 HZ2 LYS 6 HZ2 LYS 6 12.507 -10.457 -4.745 43 HZ3 LYS 6 HZ3 LYS 6 13.318 -11.752 -5.356 44 H GLN 7 H GLN 7 5.532 -11.445 -3.089 45 HA GLN 7 HA GLN 7 6.400 -13.793 -1.734 46 HB2 GLN 7 HB2 GLN 7 5.577 -11.259 -1.077 47 HB3 GLN 7 HB3 GLN 7 4.172 -12.182 -0.548 48 HG2 GLN 7 HG2 GLN 7 6.945 -13.126 0.194 49 HG3 GLN 7 HG3 GLN 7 6.264 -11.728 1.023 50 HE21 GLN 7 HE22 GLN 7 5.154 -15.068 0.081 51 HE22 GLN 7 HE21 GLN 7 4.388 -15.382 1.625 52 H LYS 8 H LYS 8 3.332 -12.851 -3.244 53 HA LYS 8 HA LYS 8 1.705 -14.915 -2.071 54 HB2 LYS 8 HB2 LYS 8 0.955 -12.718 -3.000 55 HB3 LYS 8 HB3 LYS 8 1.420 -13.262 -4.584 56 HG2 LYS 8 HG2 LYS 8 -0.274 -15.247 -4.141 57 HG3 LYS 8 HG3 LYS 8 -0.878 -14.199 -2.859 58 HD2 LYS 8 HD2 LYS 8 -2.185 -13.606 -4.764 59 HD3 LYS 8 HD3 LYS 8 -0.946 -12.345 -4.664 60 HE2 LYS 8 HE2 LYS 8 -0.938 -13.026 -6.959 61 HE3 LYS 8 HE3 LYS 8 0.477 -13.796 -6.249 62 HZ1 LYS 8 HZ1 LYS 8 -2.145 -15.093 -6.654 63 HZ2 LYS 8 HZ2 LYS 8 -0.816 -15.314 -7.600 64 HZ3 LYS 8 HZ3 LYS 8 -0.801 -15.821 -6.038 65 H GLU 9 H GLU 9 3.105 -14.552 -5.417 66 HA GLU 9 HA GLU 9 2.230 -17.085 -6.320 67 HB2 GLU 9 HB2 GLU 9 2.921 -15.109 -7.690 68 HB3 GLU 9 HB3 GLU 9 4.612 -15.420 -7.236 69 HG2 GLU 9 HG2 GLU 9 4.458 -17.662 -8.250 70 HG3 GLU 9 HG3 GLU 9 2.751 -17.376 -8.627 71 H GLN 10 H GLN 10 5.139 -16.122 -4.470 72 HA GLN 10 HA GLN 10 6.610 -18.535 -5.006 73 HB2 GLN 10 HB2 GLN 10 6.783 -16.359 -2.905 74 HB3 GLN 10 HB3 GLN 10 7.825 -17.789 -2.842 75 HG2 GLN 10 HG2 GLN 10 8.651 -17.366 -5.104 76 HG3 GLN 10 HG3 GLN 10 7.622 -15.952 -5.267 77 HE21 GLN 10 HE22 GLN 10 10.546 -16.081 -5.455 78 HE22 GLN 10 HE21 GLN 10 11.178 -15.053 -4.184 79 H GLY 11 H GLY 11 3.673 -18.317 -3.480 80 HA2 GLY 11 HA2 GLY 11 4.316 -20.694 -1.792 81 HA3 GLY 11 HA3 GLY 11 3.089 -19.505 -1.351 82 H ASN 12 H ASN 12 2.855 -19.703 -4.679 83 HA ASN 12 HA ASN 12 0.440 -21.218 -4.600 84 HB2 ASN 12 HB2 ASN 12 0.250 -20.653 -6.788 85 HB3 ASN 12 HB3 ASN 12 1.533 -19.512 -6.398 86 HD21 ASN 12 HD22 ASN 12 3.681 -20.027 -7.103 87 HD22 ASN 12 HD21 ASN 12 3.936 -21.171 -8.398 88 H SER 13 H SER 13 3.802 -22.102 -5.001 89 HA SER 13 HA SER 13 3.199 -24.798 -5.935 90 HB2 SER 13 HB2 SER 13 5.307 -23.640 -6.542 91 HB3 SER 13 HB3 SER 13 5.759 -23.575 -4.822 92 HG SER 13 HG SER 13 6.694 -25.362 -5.938 93 H LEU 14 H LEU 14 4.020 -23.218 -2.811 94 HA LEU 14 HA LEU 14 4.310 -25.576 -1.267 95 HB2 LEU 14 HB2 LEU 14 3.608 -22.676 -0.767 96 HB3 LEU 14 HB3 LEU 14 3.427 -23.835 0.531 97 HG LEU 14 HG LEU 14 5.780 -24.500 0.370 98 HD11 LEU 14 HD11 LEU 14 7.348 -23.148 -1.021 99 HD12 LEU 14 HD12 LEU 14 6.228 -24.114 -2.008 100 HD13 LEU 14 HD13 LEU 14 5.959 -22.363 -1.794 101 HD21 LEU 14 HD21 LEU 14 6.730 -22.371 1.205 102 HD22 LEU 14 HD22 LEU 14 5.365 -21.481 0.493 103 HD23 LEU 14 HD23 LEU 14 5.081 -22.620 1.835 104 H PHE 15 H PHE 15 1.479 -23.737 -2.359 105 HA PHE 15 HA PHE 15 -0.490 -25.045 -0.765 106 HB2 PHE 15 HB2 PHE 15 -0.972 -22.972 -1.893 107 HB3 PHE 15 HB3 PHE 15 -0.482 -23.630 -3.443 108 HD1 PHE 15 HD1 PHE 15 -2.865 -24.690 -0.736 109 HD2 PHE 15 HD2 PHE 15 -2.174 -23.964 -4.908 110 HE1 PHE 15 HE1 PHE 15 -5.221 -25.326 -1.230 111 HE2 PHE 15 HE2 PHE 15 -4.561 -24.537 -5.408 112 HZ PHE 15 HZ PHE 15 -6.070 -25.217 -3.561 113 H LYS 16 H LYS 16 1.384 -26.116 -3.466 114 HA LYS 16 HA LYS 16 -0.549 -28.294 -4.067 115 HB2 LYS 16 HB2 LYS 16 1.768 -27.189 -5.679 116 HB3 LYS 16 HB3 LYS 16 0.652 -28.470 -6.211 117 HG2 LYS 16 HG2 LYS 16 -1.241 -26.924 -6.111 118 HG3 LYS 16 HG3 LYS 16 -0.235 -25.672 -5.369 119 HD2 LYS 16 HD2 LYS 16 1.204 -25.663 -7.432 120 HD3 LYS 16 HD3 LYS 16 0.001 -26.735 -8.200 121 HE2 LYS 16 HE2 LYS 16 -1.765 -25.027 -7.670 122 HE3 LYS 16 HE3 LYS 16 -0.507 -23.972 -6.992 123 HZ1 LYS 16 HZ1 LYS 16 -1.023 -23.409 -9.274 124 HZ2 LYS 16 HZ2 LYS 16 0.541 -23.891 -9.127 125 HZ3 LYS 16 HZ3 LYS 16 -0.576 -24.908 -9.786 126 H GLN 17 H GLN 17 2.283 -27.713 -2.292 127 HA GLN 17 HA GLN 17 3.536 -30.314 -2.714 128 HB2 GLN 17 HB2 GLN 17 3.951 -28.168 -0.634 129 HB3 GLN 17 HB3 GLN 17 4.862 -29.689 -0.717 130 HG2 GLN 17 HG2 GLN 17 5.382 -29.081 -3.166 131 HG3 GLN 17 HG3 GLN 17 4.800 -27.461 -2.763 132 HE21 GLN 17 HE22 GLN 17 5.675 -26.934 -0.287 133 HE22 GLN 17 HE21 GLN 17 7.411 -27.022 -0.198 134 H GLY 18 H GLY 18 0.810 -29.198 -0.866 135 HA2 GLY 18 HA2 GLY 18 -0.681 -30.648 0.218 136 HA3 GLY 18 HA3 GLY 18 0.569 -31.898 0.316 137 H LEU 19 H LEU 19 1.214 -28.578 1.309 138 HA LEU 19 HA LEU 19 0.973 -29.311 4.168 139 HB2 LEU 19 HB2 LEU 19 3.177 -28.112 4.537 140 HB3 LEU 19 HB3 LEU 19 3.219 -29.730 3.838 141 HG LEU 19 HG LEU 19 3.587 -28.810 1.592 142 HD11 LEU 19 HD11 LEU 19 3.707 -26.121 3.014 143 HD12 LEU 19 HD12 LEU 19 4.178 -26.417 1.328 144 HD13 LEU 19 HD13 LEU 19 2.484 -26.613 1.830 145 HD21 LEU 19 HD21 LEU 19 5.464 -29.396 3.059 146 HD22 LEU 19 HD22 LEU 19 5.882 -28.016 2.019 147 HD23 LEU 19 HD23 LEU 19 5.470 -27.745 3.729 148 H TYR 20 H TYR 20 -0.981 -28.103 3.018 149 HA TYR 20 HA TYR 20 -1.044 -25.534 2.206 150 HB2 TYR 20 HB2 TYR 20 -3.149 -26.716 4.031 151 HB3 TYR 20 HB3 TYR 20 -3.370 -25.568 2.706 152 HD1 TYR 20 HD2 TYR 20 -2.055 -26.703 0.414 153 HD2 TYR 20 HD1 TYR 20 -4.163 -28.710 3.581 154 HE1 TYR 20 HE2 TYR 20 -2.554 -28.591 -1.102 155 HE2 TYR 20 HE1 TYR 20 -4.676 -30.587 2.072 156 HH TYR 20 HH TYR 20 -4.407 -31.476 -0.028 157 H ARG 21 H ARG 21 -0.588 -26.428 5.622 158 HA ARG 21 HA ARG 21 -1.650 -24.069 6.758 159 HB2 ARG 21 HB2 ARG 21 -0.313 -26.407 7.623 160 HB3 ARG 21 HB3 ARG 21 0.701 -25.074 8.189 161 HG2 ARG 21 HG2 ARG 21 -2.283 -25.404 8.695 162 HG3 ARG 21 HG3 ARG 21 -0.990 -25.684 9.876 163 HD2 ARG 21 HD2 ARG 21 -0.332 -23.303 9.713 164 HD3 ARG 21 HD3 ARG 21 -1.624 -23.013 8.544 165 HE ARG 21 HE ARG 21 -1.893 -23.313 11.434 166 HH11 ARG 21 HH11 ARG 21 -3.583 -23.486 8.319 167 HH12 ARG 21 HH12 ARG 21 -5.165 -23.279 9.057 168 HH21 ARG 21 HH21 ARG 21 -3.989 -23.011 12.313 169 HH22 ARG 21 HH22 ARG 21 -5.380 -23.002 11.244 170 H GLU 22 H GLU 22 1.334 -24.585 5.012 171 HA GLU 22 HA GLU 22 2.571 -22.067 5.900 172 HB2 GLU 22 HB2 GLU 22 3.131 -23.861 3.500 173 HB3 GLU 22 HB3 GLU 22 4.220 -22.631 4.170 174 HG2 GLU 22 HG2 GLU 22 3.269 -25.116 5.675 175 HG3 GLU 22 HG3 GLU 22 4.746 -24.995 4.737 176 H ALA 23 H ALA 23 0.785 -23.394 3.156 177 HA ALA 23 HA ALA 23 1.101 -21.212 1.359 178 HB1 ALA 23 HB1 ALA 23 0.567 -23.529 0.727 179 HB2 ALA 23 HB2 ALA 23 -1.038 -23.359 1.472 180 HB3 ALA 23 HB3 ALA 23 -0.604 -22.365 0.063 181 H VAL 24 H VAL 24 -1.036 -21.518 4.121 182 HA VAL 24 HA VAL 24 -3.079 -19.646 3.124 183 HB VAL 24 HB VAL 24 -2.212 -20.503 5.935 184 HG11 VAL 24 HG11 VAL 24 -4.448 -19.665 6.638 185 HG12 VAL 24 HG12 VAL 24 -3.446 -18.369 5.974 186 HG13 VAL 24 HG13 VAL 24 -4.747 -19.068 4.992 187 HG21 VAL 24 HG21 VAL 24 -4.575 -21.425 4.203 188 HG22 VAL 24 HG22 VAL 24 -3.141 -22.393 4.566 189 HG23 VAL 24 HG23 VAL 24 -4.258 -21.950 5.869 190 H HIS 25 H HIS 25 -0.297 -19.804 5.133 191 HA HIS 25 HA HIS 25 -0.078 -17.118 6.062 192 HB2 HIS 25 HB2 HIS 25 0.998 -19.798 6.373 193 HB3 HIS 25 HB3 HIS 25 2.291 -18.682 6.232 194 HD2 HIS 25 HD2 HIS 25 2.857 -17.385 8.530 195 HE1 HIS 25 HE1 HIS 25 -0.758 -18.242 10.624 196 HE2 HIS 25 HE2 HIS 25 1.566 -17.178 10.806 197 H CYS 26 H CYS 26 0.135 -18.054 3.009 198 HA CYS 26 HA CYS 26 2.441 -16.281 2.326 199 HB2 CYS 26 HB2 CYS 26 1.476 -18.894 1.114 200 HB3 CYS 26 HB3 CYS 26 2.426 -17.716 0.195 201 HG CYS 26 HG CYS 26 3.994 -19.642 1.065 202 H TYR 27 H TYR 27 -0.868 -16.528 2.334 203 HA TYR 27 HA TYR 27 -1.067 -14.643 0.035 204 HB2 TYR 27 HB2 TYR 27 -3.245 -16.451 1.082 205 HB3 TYR 27 HB3 TYR 27 -3.333 -15.412 -0.347 206 HD1 TYR 27 HD2 TYR 27 -0.674 -16.123 -1.645 207 HD2 TYR 27 HD1 TYR 27 -3.683 -18.521 0.259 208 HE1 TYR 27 HE2 TYR 27 0.009 -18.066 -3.032 209 HE2 TYR 27 HE1 TYR 27 -3.011 -20.479 -1.127 210 HH TYR 27 HH TYR 27 -1.622 -21.250 -2.768 211 H ASP 28 H ASP 28 -1.200 -14.979 3.384 212 HA ASP 28 HA ASP 28 -3.491 -13.277 3.933 213 HB2 ASP 28 HB2 ASP 28 -2.457 -15.059 5.413 214 HB3 ASP 28 HB3 ASP 28 -1.080 -13.981 5.672 215 H GLN 29 H GLN 29 -0.090 -12.738 3.150 216 HA GLN 29 HA GLN 29 0.028 -10.200 4.521 217 HB2 GLN 29 HB2 GLN 29 2.212 -10.032 3.795 218 HB3 GLN 29 HB3 GLN 29 1.975 -11.751 4.112 219 HG2 GLN 29 HG2 GLN 29 1.782 -10.425 1.410 220 HG3 GLN 29 HG3 GLN 29 3.236 -11.230 1.997 221 HE21 GLN 29 HE22 GLN 29 1.924 -11.856 -0.408 222 HE22 GLN 29 HE21 GLN 29 1.263 -13.473 -0.329 223 H LEU 30 H LEU 30 -1.370 -11.183 1.517 224 HA LEU 30 HA LEU 30 -1.079 -8.582 0.217 225 HB2 LEU 30 HB2 LEU 30 -3.018 -10.886 -0.250 226 HB3 LEU 30 HB3 LEU 30 -2.805 -9.487 -1.301 227 HG LEU 30 HG LEU 30 -1.537 -10.995 -2.427 228 HD11 LEU 30 HD11 LEU 30 0.078 -9.239 -1.738 229 HD12 LEU 30 HD12 LEU 30 0.509 -10.195 -0.312 230 HD13 LEU 30 HD13 LEU 30 0.853 -10.819 -1.927 231 HD21 LEU 30 HD21 LEU 30 -2.084 -12.847 -0.977 232 HD22 LEU 30 HD22 LEU 30 -0.359 -12.880 -1.362 233 HD23 LEU 30 HD23 LEU 30 -0.889 -12.302 0.222 234 H ILE 31 H ILE 31 -3.410 -10.251 2.288 235 HA ILE 31 HA ILE 31 -5.452 -8.237 2.031 236 HB ILE 31 HB ILE 31 -4.937 -10.417 4.100 237 HG12 ILE 31 HG12 ILE 31 -6.934 -10.532 1.818 238 HG13 ILE 31 HG13 ILE 31 -5.270 -11.006 1.567 239 HG21 ILE 31 HG21 ILE 31 -6.508 -8.779 5.005 240 HG22 ILE 31 HG22 ILE 31 -7.478 -8.838 3.521 241 HG23 ILE 31 HG23 ILE 31 -7.375 -10.256 4.582 242 HD11 ILE 31 HD11 ILE 31 -5.392 -12.598 3.388 243 HD12 ILE 31 HD12 ILE 31 -7.121 -12.228 3.610 244 HD13 ILE 31 HD13 ILE 31 -6.561 -12.961 2.082 245 H THR 32 H THR 32 -2.494 -8.514 3.701 246 HA THR 32 HA THR 32 -3.204 -6.350 5.637 247 HB THR 32 HB THR 32 -0.720 -8.101 5.487 248 HG1 THR 32 HG1 THR 32 -2.552 -9.314 5.961 249 HG21 THR 32 HG21 THR 32 -1.793 -6.234 7.641 250 HG22 THR 32 HG22 THR 32 -0.445 -7.364 7.858 251 HG23 THR 32 HG23 THR 32 -0.297 -6.026 6.711 252 H ALA 33 H ALA 33 -1.318 -6.932 2.682 253 HA ALA 33 HA ALA 33 0.275 -4.500 3.089 254 HB1 ALA 33 HB1 ALA 33 0.040 -6.398 0.719 255 HB2 ALA 33 HB2 ALA 33 1.211 -5.071 0.879 256 HB3 ALA 33 HB3 ALA 33 1.286 -6.446 1.988 257 H GLN 34 H GLN 34 -2.542 -5.575 1.196 258 HA GLN 34 HA GLN 34 -3.563 -2.981 0.783 259 HB2 GLN 34 HB2 GLN 34 -3.216 -2.863 -1.729 260 HB3 GLN 34 HB3 GLN 34 -1.847 -2.449 -0.700 261 HG2 GLN 34 HG2 GLN 34 -1.228 -5.016 -1.056 262 HG3 GLN 34 HG3 GLN 34 -2.248 -4.814 -2.499 263 HE21 GLN 34 HE22 GLN 34 0.567 -3.524 -0.717 264 HE22 GLN 34 HE21 GLN 34 1.394 -2.877 -2.109 265 HA PRO 35 HA PRO 35 -6.228 -6.704 0.373 266 HB2 PRO 35 HB2 PRO 35 -8.337 -5.710 1.868 267 HB3 PRO 35 HB3 PRO 35 -6.890 -6.515 2.557 268 HG2 PRO 35 HG2 PRO 35 -7.418 -3.552 2.244 269 HG3 PRO 35 HG3 PRO 35 -6.819 -4.424 3.694 270 HD2 PRO 35 HD2 PRO 35 -5.128 -3.144 2.000 271 HD3 PRO 35 HD3 PRO 35 -4.665 -4.717 2.724 272 H GLN 36 H GLN 36 -6.339 -3.550 -0.842 273 HA GLN 36 HA GLN 36 -8.970 -3.415 -1.902 274 HB2 GLN 36 HB2 GLN 36 -8.075 -1.632 -3.301 275 HB3 GLN 36 HB3 GLN 36 -7.493 -1.488 -1.632 276 HG2 GLN 36 HG2 GLN 36 -5.376 -2.624 -2.287 277 HG3 GLN 36 HG3 GLN 36 -5.941 -2.674 -3.971 278 HE21 GLN 36 HE22 GLN 36 -3.568 -1.464 -3.580 279 HE22 GLN 36 HE21 GLN 36 -3.718 0.274 -3.704 280 H ASN 37 H ASN 37 -7.144 -5.949 -2.472 281 HA ASN 37 HA ASN 37 -7.928 -6.157 -5.334 282 HB2 ASN 37 HB2 ASN 37 -5.251 -6.848 -4.051 283 HB3 ASN 37 HB3 ASN 37 -5.736 -7.383 -5.664 284 HD21 ASN 37 HD22 ASN 37 -4.024 -5.059 -4.020 285 HD22 ASN 37 HD21 ASN 37 -4.034 -3.803 -5.242 286 HA PRO 38 HA PRO 38 -9.793 -9.827 -3.570 287 HB2 PRO 38 HB2 PRO 38 -10.800 -10.900 -5.815 288 HB3 PRO 38 HB3 PRO 38 -11.366 -9.308 -5.247 289 HG2 PRO 38 HG2 PRO 38 -9.209 -9.815 -7.324 290 HG3 PRO 38 HG3 PRO 38 -10.705 -8.829 -7.500 291 HD2 PRO 38 HD2 PRO 38 -8.434 -7.590 -6.758 292 HD3 PRO 38 HD3 PRO 38 -9.940 -7.227 -5.961 293 H VAL 39 H VAL 39 -7.113 -9.875 -5.915 294 HA VAL 39 HA VAL 39 -6.910 -12.706 -6.136 295 HB VAL 39 HB VAL 39 -5.744 -11.031 -7.578 296 HG11 VAL 39 HG11 VAL 39 -3.816 -10.807 -5.243 297 HG12 VAL 39 HG12 VAL 39 -3.612 -10.093 -6.851 298 HG13 VAL 39 HG13 VAL 39 -4.918 -9.522 -5.790 299 HG21 VAL 39 HG21 VAL 39 -5.101 -13.429 -7.539 300 HG22 VAL 39 HG22 VAL 39 -3.707 -12.372 -7.847 301 HG23 VAL 39 HG23 VAL 39 -3.938 -13.093 -6.232 302 H GLY 40 H GLY 40 -5.996 -10.401 -3.655 303 HA2 GLY 40 HA2 GLY 40 -4.227 -11.985 -2.090 304 HA3 GLY 40 HA3 GLY 40 -5.240 -10.648 -1.504 305 H TYR 41 H TYR 41 -7.646 -12.291 -2.677 306 HA TYR 41 HA TYR 41 -7.905 -14.156 -0.356 307 HB2 TYR 41 HB2 TYR 41 -10.224 -12.966 -1.920 308 HB3 TYR 41 HB3 TYR 41 -10.251 -13.729 -0.422 309 HD1 TYR 41 HD1 TYR 41 -9.032 -10.607 -2.010 310 HD2 TYR 41 HD2 TYR 41 -9.988 -12.629 1.652 311 HE1 TYR 41 HE1 TYR 41 -8.930 -8.448 -0.810 312 HE2 TYR 41 HE2 TYR 41 -9.867 -10.473 2.877 313 HH TYR 41 HH TYR 41 -9.158 -7.385 1.193 314 H SER 42 H SER 42 -7.679 -13.821 -3.749 315 HA SER 42 HA SER 42 -9.351 -15.959 -4.645 316 HB2 SER 42 HB2 SER 42 -8.519 -14.092 -6.044 317 HB3 SER 42 HB3 SER 42 -6.882 -14.799 -5.970 318 HG SER 42 HG SER 42 -7.996 -15.459 -7.842 319 H ASN 43 H ASN 43 -6.443 -16.126 -2.868 320 HA ASN 43 HA ASN 43 -6.022 -18.927 -3.806 321 HB2 ASN 43 HB2 ASN 43 -3.948 -16.851 -2.991 322 HB3 ASN 43 HB3 ASN 43 -3.625 -18.541 -3.395 323 HD21 ASN 43 HD22 ASN 43 -4.605 -19.240 -5.620 324 HD22 ASN 43 HD21 ASN 43 -4.328 -18.115 -6.934 325 H LYS 44 H LYS 44 -6.129 -16.624 -1.063 326 HA LYS 44 HA LYS 44 -5.539 -18.679 0.913 327 HB2 LYS 44 HB2 LYS 44 -5.320 -16.154 1.165 328 HB3 LYS 44 HB3 LYS 44 -7.060 -16.069 1.194 329 HG2 LYS 44 HG2 LYS 44 -7.101 -17.611 3.173 330 HG3 LYS 44 HG3 LYS 44 -5.324 -17.667 3.133 331 HD2 LYS 44 HD2 LYS 44 -5.239 -15.224 3.552 332 HD3 LYS 44 HD3 LYS 44 -7.019 -15.169 3.558 333 HE2 LYS 44 HE2 LYS 44 -7.040 -16.795 5.445 334 HE3 LYS 44 HE3 LYS 44 -5.264 -16.758 5.488 335 HZ1 LYS 44 HZ1 LYS 44 -5.398 -14.406 5.983 336 HZ2 LYS 44 HZ2 LYS 44 -7.046 -14.448 5.936 337 HZ3 LYS 44 HZ3 LYS 44 -6.233 -15.279 7.099 338 H ALA 45 H ALA 45 -8.446 -17.230 -0.506 339 HA ALA 45 HA ALA 45 -10.350 -18.746 1.012 340 HB1 ALA 45 HB1 ALA 45 -11.948 -17.974 -0.639 341 HB2 ALA 45 HB2 ALA 45 -10.835 -16.632 -0.274 342 HB3 ALA 45 HB3 ALA 45 -10.657 -17.581 -1.777 343 H MET 46 H MET 46 -8.025 -20.005 -0.954 344 HA MET 46 HA MET 46 -9.688 -22.350 -1.662 345 HB2 MET 46 HB2 MET 46 -9.080 -20.548 -3.572 346 HB3 MET 46 HB3 MET 46 -7.544 -21.422 -3.562 347 HG2 MET 46 HG2 MET 46 -9.036 -22.376 -5.243 348 HG3 MET 46 HG3 MET 46 -8.802 -23.552 -3.936 349 HE1 MET 46 HE1 MET 46 -11.134 -20.962 -5.644 350 HE2 MET 46 HE2 MET 46 -12.631 -21.055 -4.694 351 HE3 MET 46 HE3 MET 46 -11.179 -20.323 -3.985 352 H ALA 47 H ALA 47 -7.199 -21.215 0.123 353 HA ALA 47 HA ALA 47 -5.909 -23.905 0.085 354 HB1 ALA 47 HB1 ALA 47 -4.577 -21.238 0.681 355 HB2 ALA 47 HB2 ALA 47 -3.811 -22.836 0.787 356 HB3 ALA 47 HB3 ALA 47 -4.357 -22.218 -0.792 357 H LEU 48 H LEU 48 -7.350 -21.269 1.958 358 HA LEU 48 HA LEU 48 -6.676 -22.438 4.518 359 HB2 LEU 48 HB2 LEU 48 -7.177 -20.040 4.182 360 HB3 LEU 48 HB3 LEU 48 -8.821 -20.447 3.653 361 HG LEU 48 HG LEU 48 -9.359 -21.310 5.875 362 HD11 LEU 48 HD11 LEU 48 -7.180 -22.233 6.557 363 HD12 LEU 48 HD12 LEU 48 -6.475 -20.599 6.561 364 HD13 LEU 48 HD13 LEU 48 -7.723 -21.040 7.750 365 HD21 LEU 48 HD21 LEU 48 -9.097 -19.177 7.136 366 HD22 LEU 48 HD22 LEU 48 -7.933 -18.616 5.937 367 HD23 LEU 48 HD23 LEU 48 -9.626 -18.903 5.460 368 H ILE 49 H ILE 49 -9.229 -22.804 2.093 369 HA ILE 49 HA ILE 49 -11.041 -24.372 3.626 370 HB ILE 49 HB ILE 49 -11.720 -25.310 1.432 371 HG12 ILE 49 HG12 ILE 49 -9.712 -23.402 0.248 372 HG13 ILE 49 HG13 ILE 49 -9.292 -25.071 0.491 373 HG21 ILE 49 HG21 ILE 49 -12.597 -23.201 0.546 374 HG22 ILE 49 HG22 ILE 49 -12.681 -23.206 2.316 375 HG23 ILE 49 HG23 ILE 49 -11.406 -22.281 1.492 376 HD11 ILE 49 HD11 ILE 49 -10.035 -24.802 -1.773 377 HD12 ILE 49 HD12 ILE 49 -11.079 -25.897 -0.850 378 HD13 ILE 49 HD13 ILE 49 -11.622 -24.235 -1.208 379 H LYS 50 H LYS 50 -7.937 -24.992 2.173 380 HA LYS 50 HA LYS 50 -8.369 -27.755 1.650 381 HB2 LYS 50 HB2 LYS 50 -6.598 -25.826 0.821 382 HB3 LYS 50 HB3 LYS 50 -5.581 -26.794 1.880 383 HG2 LYS 50 HG2 LYS 50 -5.296 -27.804 -0.195 384 HG3 LYS 50 HG3 LYS 50 -6.541 -28.830 0.508 385 HD2 LYS 50 HD2 LYS 50 -6.969 -26.492 -1.413 386 HD3 LYS 50 HD3 LYS 50 -6.909 -28.184 -1.903 387 HE2 LYS 50 HE2 LYS 50 -8.918 -27.049 0.065 388 HE3 LYS 50 HE3 LYS 50 -9.211 -27.181 -1.670 389 HZ1 LYS 50 HZ1 LYS 50 -8.887 -29.546 -1.515 390 HZ2 LYS 50 HZ2 LYS 50 -8.606 -29.459 0.101 391 HZ3 LYS 50 HZ3 LYS 50 -10.088 -29.083 -0.503 392 H LEU 51 H LEU 51 -7.666 -26.092 4.565 393 HA LEU 51 HA LEU 51 -6.370 -28.450 5.821 394 HB2 LEU 51 HB2 LEU 51 -7.040 -25.670 6.895 395 HB3 LEU 51 HB3 LEU 51 -6.283 -26.968 7.813 396 HG LEU 51 HG LEU 51 -4.634 -25.392 7.239 397 HD11 LEU 51 HD11 LEU 51 -4.306 -27.900 5.565 398 HD12 LEU 51 HD12 LEU 51 -3.005 -26.875 6.218 399 HD13 LEU 51 HD13 LEU 51 -4.051 -27.793 7.318 400 HD21 LEU 51 HD21 LEU 51 -5.723 -24.468 5.202 401 HD22 LEU 51 HD22 LEU 51 -3.994 -24.810 5.002 402 HD23 LEU 51 HD23 LEU 51 -5.200 -25.909 4.307 403 H GLY 52 H GLY 52 -9.474 -26.950 5.387 404 HA2 GLY 52 HA2 GLY 52 -11.441 -28.235 5.987 405 HA3 GLY 52 HA3 GLY 52 -10.643 -28.692 7.502 406 H GLU 53 H GLU 53 -9.743 -25.546 7.118 407 HA GLU 53 HA GLU 53 -11.648 -24.589 9.086 408 HB2 GLU 53 HB2 GLU 53 -9.363 -23.185 7.624 409 HB3 GLU 53 HB3 GLU 53 -10.327 -22.496 8.938 410 HG2 GLU 53 HG2 GLU 53 -9.639 -24.446 10.384 411 HG3 GLU 53 HG3 GLU 53 -8.518 -24.938 9.101 412 H TYR 54 H TYR 54 -13.213 -25.252 6.950 413 HA TYR 54 HA TYR 54 -13.607 -23.323 4.949 414 HB2 TYR 54 HB2 TYR 54 -15.640 -25.052 6.400 415 HB3 TYR 54 HB3 TYR 54 -15.933 -24.212 4.877 416 HD1 TYR 54 HD1 TYR 54 -14.391 -24.772 2.877 417 HD2 TYR 54 HD2 TYR 54 -14.750 -27.241 6.382 418 HE1 TYR 54 HE1 TYR 54 -13.535 -26.717 1.598 419 HE2 TYR 54 HE2 TYR 54 -13.914 -29.196 5.097 420 HH TYR 54 HH TYR 54 -13.021 -28.956 1.634 421 H THR 55 H THR 55 -14.629 -23.331 8.365 422 HA THR 55 HA THR 55 -16.592 -21.288 8.202 423 HB THR 55 HB THR 55 -14.675 -22.052 10.427 424 HG1 THR 55 HG1 THR 55 -16.445 -23.280 11.125 425 HG21 THR 55 HG21 THR 55 -15.707 -19.831 10.836 426 HG22 THR 55 HG22 THR 55 -17.309 -20.496 10.466 427 HG23 THR 55 HG23 THR 55 -16.426 -21.047 11.916 428 H GLN 56 H GLN 56 -13.009 -21.117 8.433 429 HA GLN 56 HA GLN 56 -13.060 -18.202 8.778 430 HB2 GLN 56 HB2 GLN 56 -10.874 -20.271 8.458 431 HB3 GLN 56 HB3 GLN 56 -10.580 -18.523 8.482 432 HG2 GLN 56 HG2 GLN 56 -10.234 -19.306 10.665 433 HG3 GLN 56 HG3 GLN 56 -11.725 -18.363 10.683 434 HE21 GLN 56 HE22 GLN 56 -10.295 -21.626 10.915 435 HE22 GLN 56 HE21 GLN 56 -11.719 -22.391 11.588 436 H ALA 57 H ALA 57 -12.981 -20.545 6.146 437 HA ALA 57 HA ALA 57 -11.617 -18.887 4.228 438 HB1 ALA 57 HB1 ALA 57 -13.544 -21.215 3.845 439 HB2 ALA 57 HB2 ALA 57 -12.444 -20.549 2.623 440 HB3 ALA 57 HB3 ALA 57 -11.787 -21.347 4.069 441 H ILE 58 H ILE 58 -15.084 -19.454 4.992 442 HA ILE 58 HA ILE 58 -16.199 -17.920 2.825 443 HB ILE 58 HB ILE 58 -17.204 -18.422 5.692 444 HG12 ILE 58 HG12 ILE 58 -17.816 -20.052 3.216 445 HG13 ILE 58 HG13 ILE 58 -16.537 -20.499 4.339 446 HG21 ILE 58 HG21 ILE 58 -18.846 -18.054 3.164 447 HG22 ILE 58 HG22 ILE 58 -19.441 -18.148 4.827 448 HG23 ILE 58 HG23 ILE 58 -18.514 -16.725 4.317 449 HD11 ILE 58 HD11 ILE 58 -19.501 -20.254 5.005 450 HD12 ILE 58 HD12 ILE 58 -18.527 -21.736 4.952 451 HD13 ILE 58 HD13 ILE 58 -18.211 -20.520 6.201 452 H GLN 59 H GLN 59 -14.906 -17.059 6.046 453 HA GLN 59 HA GLN 59 -15.864 -14.330 5.950 454 HB2 GLN 59 HB2 GLN 59 -13.709 -15.697 7.639 455 HB3 GLN 59 HB3 GLN 59 -14.326 -14.050 7.899 456 HG2 GLN 59 HG2 GLN 59 -16.608 -14.944 8.239 457 HG3 GLN 59 HG3 GLN 59 -16.009 -16.586 7.968 458 HE21 GLN 59 HE22 GLN 59 -15.536 -17.738 9.758 459 HE22 GLN 59 HE21 GLN 59 -15.105 -17.042 11.316 460 H MET 60 H MET 60 -13.512 -15.921 4.158 461 HA MET 60 HA MET 60 -11.995 -13.401 3.718 462 HB2 MET 60 HB2 MET 60 -11.208 -16.299 3.215 463 HB3 MET 60 HB3 MET 60 -10.194 -14.902 2.839 464 HG2 MET 60 HG2 MET 60 -11.192 -15.291 5.660 465 HG3 MET 60 HG3 MET 60 -9.883 -16.298 5.053 466 HE1 MET 60 HE1 MET 60 -9.552 -11.686 5.255 467 HE2 MET 60 HE2 MET 60 -10.221 -12.521 3.844 468 HE3 MET 60 HE3 MET 60 -11.080 -12.627 5.410 469 H CYS 61 H CYS 61 -14.085 -15.864 2.298 470 HA CYS 61 HA CYS 61 -13.472 -15.217 -0.436 471 HB2 CYS 61 HB2 CYS 61 -16.055 -16.267 0.879 472 HB3 CYS 61 HB3 CYS 61 -15.736 -16.253 -0.863 473 HG CYS 61 HG CYS 61 -15.494 -18.676 0.009 474 H GLN 62 H GLN 62 -16.224 -14.157 1.707 475 HA GLN 62 HA GLN 62 -17.353 -12.344 -0.155 476 HB2 GLN 62 HB2 GLN 62 -17.262 -12.164 2.892 477 HB3 GLN 62 HB3 GLN 62 -18.435 -11.350 1.837 478 HG2 GLN 62 HG2 GLN 62 -19.348 -13.524 1.133 479 HG3 GLN 62 HG3 GLN 62 -18.094 -14.370 2.038 480 HE21 GLN 62 HE22 GLN 62 -19.681 -15.501 3.199 481 HE22 GLN 62 HE21 GLN 62 -20.655 -14.707 4.404 482 H GLN 63 H GLN 63 -14.631 -11.918 2.128 483 HA GLN 63 HA GLN 63 -14.541 -9.066 1.931 484 HB2 GLN 63 HB2 GLN 63 -12.381 -11.132 2.540 485 HB3 GLN 63 HB3 GLN 63 -12.183 -9.391 2.780 486 HG2 GLN 63 HG2 GLN 63 -14.379 -11.009 4.150 487 HG3 GLN 63 HG3 GLN 63 -12.767 -10.759 4.831 488 HE21 GLN 63 HE22 GLN 63 -13.899 -9.769 6.637 489 HE22 GLN 63 HE21 GLN 63 -14.345 -8.081 6.530 490 H GLY 64 H GLY 64 -13.620 -11.610 -0.293 491 HA2 GLY 64 HA2 GLY 64 -11.732 -9.864 -1.734 492 HA3 GLY 64 HA3 GLY 64 -12.152 -11.541 -2.104 493 H LEU 65 H LEU 65 -15.101 -11.093 -2.008 494 HA LEU 65 HA LEU 65 -15.395 -10.153 -4.713 495 HB2 LEU 65 HB2 LEU 65 -17.402 -10.952 -2.585 496 HB3 LEU 65 HB3 LEU 65 -17.874 -10.417 -4.178 497 HG LEU 65 HG LEU 65 -17.807 -12.774 -4.479 498 HD11 LEU 65 HD11 LEU 65 -14.991 -12.057 -5.209 499 HD12 LEU 65 HD12 LEU 65 -16.041 -13.321 -5.894 500 HD13 LEU 65 HD13 LEU 65 -16.430 -11.611 -6.162 501 HD21 LEU 65 HD21 LEU 65 -16.819 -12.990 -2.152 502 HD22 LEU 65 HD22 LEU 65 -16.515 -14.246 -3.346 503 HD23 LEU 65 HD23 LEU 65 -15.251 -13.028 -3.002 504 H ARG 66 H ARG 66 -14.935 -8.432 -1.874 505 HA ARG 66 HA ARG 66 -16.545 -6.085 -2.522 506 HB2 ARG 66 HB2 ARG 66 -14.074 -6.443 -0.759 507 HB3 ARG 66 HB3 ARG 66 -15.133 -5.025 -0.782 508 HG2 ARG 66 HG2 ARG 66 -17.014 -6.414 0.049 509 HG3 ARG 66 HG3 ARG 66 -15.974 -7.838 0.018 510 HD2 ARG 66 HD2 ARG 66 -16.087 -6.978 2.281 511 HD3 ARG 66 HD3 ARG 66 -14.443 -6.790 1.636 512 HE ARG 66 HE ARG 66 -15.993 -4.411 1.174 513 HH11 ARG 66 HH11 ARG 66 -14.312 -6.183 3.718 514 HH12 ARG 66 HH12 ARG 66 -13.964 -4.747 4.655 515 HH21 ARG 66 HH21 ARG 66 -15.545 -2.556 2.412 516 HH22 ARG 66 HH22 ARG 66 -14.684 -2.696 3.924 517 H TYR 67 H TYR 67 -13.993 -7.495 -4.118 518 HA TYR 67 HA TYR 67 -12.744 -4.923 -4.943 519 HB2 TYR 67 HB2 TYR 67 -11.343 -7.448 -4.052 520 HB3 TYR 67 HB3 TYR 67 -10.532 -6.028 -4.687 521 HD1 TYR 67 HD2 TYR 67 -11.344 -3.720 -3.421 522 HD2 TYR 67 HD1 TYR 67 -11.318 -7.690 -1.771 523 HE1 TYR 67 HE2 TYR 67 -11.340 -2.762 -1.141 524 HE2 TYR 67 HE1 TYR 67 -11.269 -6.743 0.516 525 HH TYR 67 HH TYR 67 -11.278 -4.839 1.794 526 H THR 68 H THR 68 -14.698 -7.100 -6.057 527 HA THR 68 HA THR 68 -13.212 -7.577 -8.599 528 HB THR 68 HB THR 68 -14.805 -9.448 -8.943 529 HG1 THR 68 HG1 THR 68 -16.457 -8.697 -7.567 530 HG21 THR 68 HG21 THR 68 -13.287 -9.576 -6.320 531 HG22 THR 68 HG22 THR 68 -13.785 -10.960 -7.313 532 HG23 THR 68 HG23 THR 68 -12.580 -9.810 -7.932 533 H SER 69 H SER 69 -14.670 -5.152 -7.697 534 HA SER 69 HA SER 69 -17.214 -4.958 -8.938 535 HB2 SER 69 HB2 SER 69 -16.908 -2.549 -8.523 536 HB3 SER 69 HB3 SER 69 -16.387 -3.513 -7.119 537 HG SER 69 HG SER 69 -14.877 -1.883 -7.678 538 H THR 70 H THR 70 -14.507 -5.643 -10.628 539 HA THR 70 HA THR 70 -15.357 -4.110 -12.995 540 HB THR 70 HB THR 70 -13.836 -2.562 -12.024 541 HG1 THR 70 HG1 THR 70 -12.201 -2.550 -13.561 542 HG21 THR 70 HG21 THR 70 -11.920 -4.896 -11.668 543 HG22 THR 70 HG22 THR 70 -11.509 -3.190 -11.390 544 HG23 THR 70 HG23 THR 70 -12.728 -3.974 -10.368 545 H ALA 71 H ALA 71 -14.138 -4.767 -14.937 546 HA ALA 71 HA ALA 71 -14.293 -7.576 -15.267 547 HB1 ALA 71 HB1 ALA 71 -14.771 -5.893 -17.003 548 HB2 ALA 71 HB2 ALA 71 -13.068 -5.402 -17.007 549 HB3 ALA 71 HB3 ALA 71 -13.521 -7.037 -17.552 550 H GLU 72 H GLU 72 -11.696 -5.660 -14.024 551 HA GLU 72 HA GLU 72 -9.470 -7.170 -14.992 552 HB2 GLU 72 HB2 GLU 72 -9.821 -5.622 -12.425 553 HB3 GLU 72 HB3 GLU 72 -8.280 -6.204 -13.060 554 HG2 GLU 72 HG2 GLU 72 -10.138 -4.209 -14.435 555 HG3 GLU 72 HG3 GLU 72 -8.647 -3.813 -13.574 556 H HIS 73 H HIS 73 -12.028 -8.122 -12.993 557 HA HIS 73 HA HIS 73 -10.505 -10.449 -11.973 558 HB2 HIS 73 HB2 HIS 73 -12.407 -8.895 -10.193 559 HB3 HIS 73 HB3 HIS 73 -11.251 -10.133 -9.729 560 HD2 HIS 73 HD2 HIS 73 -11.682 -6.441 -9.959 561 HE1 HIS 73 HE1 HIS 73 -7.496 -6.993 -9.444 562 HE2 HIS 73 HE2 HIS 73 -9.392 -5.282 -9.422 563 H VAL 74 H VAL 74 -12.477 -9.981 -14.138 564 HA VAL 74 HA VAL 74 -15.125 -10.446 -13.507 565 HB VAL 74 HB VAL 74 -14.141 -9.824 -15.698 566 HG11 VAL 74 HG11 VAL 74 -13.614 -12.805 -16.004 567 HG12 VAL 74 HG12 VAL 74 -13.410 -11.558 -17.252 568 HG13 VAL 74 HG13 VAL 74 -12.372 -11.545 -15.810 569 HG21 VAL 74 HG21 VAL 74 -16.515 -10.532 -15.479 570 HG22 VAL 74 HG22 VAL 74 -15.824 -10.941 -17.062 571 HG23 VAL 74 HG23 VAL 74 -16.034 -12.208 -15.830 572 H ALA 75 H ALA 75 -12.527 -12.824 -13.440 573 HA ALA 75 HA ALA 75 -14.503 -15.035 -13.212 574 HB1 ALA 75 HB1 ALA 75 -11.448 -15.036 -13.251 575 HB2 ALA 75 HB2 ALA 75 -12.499 -16.476 -13.279 576 HB3 ALA 75 HB3 ALA 75 -12.511 -15.348 -14.649 577 H ILE 76 H ILE 76 -11.971 -13.368 -11.224 578 HA ILE 76 HA ILE 76 -12.336 -15.057 -8.941 579 HB ILE 76 HB ILE 76 -11.414 -12.166 -9.184 580 HG12 ILE 76 HG12 ILE 76 -9.865 -14.747 -8.724 581 HG13 ILE 76 HG13 ILE 76 -10.042 -13.970 -10.288 582 HG21 ILE 76 HG21 ILE 76 -11.359 -14.086 -6.826 583 HG22 ILE 76 HG22 ILE 76 -10.440 -12.579 -6.907 584 HG23 ILE 76 HG23 ILE 76 -12.206 -12.520 -6.916 585 HD11 ILE 76 HD11 ILE 76 -7.907 -13.360 -9.365 586 HD12 ILE 76 HD12 ILE 76 -8.952 -11.925 -9.411 587 HD13 ILE 76 HD13 ILE 76 -8.656 -12.762 -7.875 588 H ARG 77 H ARG 77 -14.200 -12.430 -10.307 589 HA ARG 77 HA ARG 77 -15.845 -11.640 -8.179 590 HB2 ARG 77 HB2 ARG 77 -15.661 -10.644 -10.471 591 HB3 ARG 77 HB3 ARG 77 -16.506 -12.054 -11.122 592 HG2 ARG 77 HG2 ARG 77 -18.503 -11.491 -9.747 593 HG3 ARG 77 HG3 ARG 77 -17.633 -10.065 -9.113 594 HD2 ARG 77 HD2 ARG 77 -17.409 -9.186 -11.408 595 HD3 ARG 77 HD3 ARG 77 -18.170 -10.656 -12.048 596 HE ARG 77 HE ARG 77 -20.272 -9.901 -11.351 597 HH11 ARG 77 HH11 ARG 77 -17.752 -7.706 -10.160 598 HH12 ARG 77 HH12 ARG 77 -18.903 -6.477 -9.703 599 HH21 ARG 77 HH21 ARG 77 -21.729 -8.277 -10.720 600 HH22 ARG 77 HH22 ARG 77 -21.139 -6.792 -10.018 601 H SER 78 H SER 78 -15.685 -14.670 -9.852 602 HA SER 78 HA SER 78 -18.213 -15.596 -8.530 603 HB2 SER 78 HB2 SER 78 -17.069 -16.294 -11.265 604 HB3 SER 78 HB3 SER 78 -18.468 -17.103 -10.504 605 HG SER 78 HG SER 78 -19.081 -15.394 -11.925 606 H LYS 79 H LYS 79 -14.758 -16.100 -8.971 607 HA LYS 79 HA LYS 79 -14.930 -18.908 -8.215 608 HB2 LYS 79 HB2 LYS 79 -12.621 -16.964 -8.579 609 HB3 LYS 79 HB3 LYS 79 -12.400 -18.597 -7.979 610 HG2 LYS 79 HG2 LYS 79 -13.500 -17.834 -10.710 611 HG3 LYS 79 HG3 LYS 79 -11.945 -18.565 -10.345 612 HD2 LYS 79 HD2 LYS 79 -14.690 -19.832 -10.167 613 HD3 LYS 79 HD3 LYS 79 -13.299 -20.342 -11.131 614 HE2 LYS 79 HE2 LYS 79 -12.075 -20.783 -8.928 615 HE3 LYS 79 HE3 LYS 79 -13.630 -20.495 -8.113 616 HZ1 LYS 79 HZ1 LYS 79 -14.565 -22.305 -9.387 617 HZ2 LYS 79 HZ2 LYS 79 -13.139 -22.561 -10.164 618 HZ3 LYS 79 HZ3 LYS 79 -13.254 -22.829 -8.546 619 H LEU 80 H LEU 80 -15.194 -15.952 -6.360 620 HA LEU 80 HA LEU 80 -14.141 -17.416 -3.991 621 HB2 LEU 80 HB2 LEU 80 -14.917 -14.542 -4.603 622 HB3 LEU 80 HB3 LEU 80 -14.488 -15.124 -2.969 623 HG LEU 80 HG LEU 80 -12.640 -15.357 -5.379 624 HD11 LEU 80 HD11 LEU 80 -11.539 -13.340 -4.457 625 HD12 LEU 80 HD12 LEU 80 -13.213 -13.012 -4.967 626 HD13 LEU 80 HD13 LEU 80 -12.850 -13.200 -3.245 627 HD21 LEU 80 HD21 LEU 80 -12.118 -16.857 -3.510 628 HD22 LEU 80 HD22 LEU 80 -10.941 -15.527 -3.547 629 HD23 LEU 80 HD23 LEU 80 -12.249 -15.505 -2.355 630 H GLN 81 H GLN 81 -16.979 -16.297 -5.728 631 HA GLN 81 HA GLN 81 -18.884 -16.840 -3.618 632 HB2 GLN 81 HB2 GLN 81 -18.875 -16.310 -6.600 633 HB3 GLN 81 HB3 GLN 81 -20.315 -16.999 -5.892 634 HG2 GLN 81 HG2 GLN 81 -19.026 -14.374 -5.105 635 HG3 GLN 81 HG3 GLN 81 -20.579 -14.602 -5.923 636 HE21 GLN 81 HE22 GLN 81 -21.730 -16.677 -4.423 637 HE22 GLN 81 HE21 GLN 81 -21.963 -16.155 -2.766 638 H TYR 82 H TYR 82 -17.332 -18.672 -6.267 639 HA TYR 82 HA TYR 82 -19.086 -20.899 -6.334 640 HB2 TYR 82 HB2 TYR 82 -17.424 -20.585 -8.080 641 HB3 TYR 82 HB3 TYR 82 -16.136 -20.434 -6.899 642 HD1 TYR 82 HD1 TYR 82 -18.633 -22.918 -8.199 643 HD2 TYR 82 HD2 TYR 82 -14.809 -22.259 -6.340 644 HE1 TYR 82 HE1 TYR 82 -18.151 -25.347 -8.351 645 HE2 TYR 82 HE2 TYR 82 -14.307 -24.693 -6.516 646 HH TYR 82 HH TYR 82 -16.644 -27.020 -7.940 647 H ARG 83 H ARG 83 -16.162 -20.305 -4.254 648 HA ARG 83 HA ARG 83 -16.565 -22.977 -3.147 649 HB2 ARG 83 HB2 ARG 83 -14.301 -21.781 -3.539 650 HB3 ARG 83 HB3 ARG 83 -14.674 -20.870 -2.063 651 HG2 ARG 83 HG2 ARG 83 -13.295 -22.787 -1.500 652 HG3 ARG 83 HG3 ARG 83 -14.921 -23.070 -0.852 653 HD2 ARG 83 HD2 ARG 83 -15.441 -24.468 -2.866 654 HD3 ARG 83 HD3 ARG 83 -13.794 -24.186 -3.461 655 HE ARG 83 HE ARG 83 -13.655 -25.264 -0.833 656 HH11 ARG 83 HH11 ARG 83 -14.627 -26.201 -4.097 657 HH12 ARG 83 HH12 ARG 83 -14.272 -27.891 -3.845 658 HH21 ARG 83 HH21 ARG 83 -13.222 -27.503 -0.533 659 HH22 ARG 83 HH22 ARG 83 -13.487 -28.622 -1.845 660 H LEU 84 H LEU 84 -17.402 -19.663 -2.332 661 HA LEU 84 HA LEU 84 -18.205 -20.086 0.386 662 HB2 LEU 84 HB2 LEU 84 -17.844 -17.953 -1.036 663 HB3 LEU 84 HB3 LEU 84 -19.467 -18.218 -1.664 664 HG LEU 84 HG LEU 84 -18.639 -17.713 1.195 665 HD11 LEU 84 HD11 LEU 84 -20.167 -16.050 -0.825 666 HD12 LEU 84 HD12 LEU 84 -19.899 -15.614 0.870 667 HD13 LEU 84 HD13 LEU 84 -18.516 -15.753 -0.232 668 HD21 LEU 84 HD21 LEU 84 -20.594 -19.097 1.370 669 HD22 LEU 84 HD22 LEU 84 -21.105 -17.429 1.629 670 HD23 LEU 84 HD23 LEU 84 -21.410 -18.192 0.056 671 H GLU 85 H GLU 85 -19.704 -20.494 -2.774 672 HA GLU 85 HA GLU 85 -22.346 -21.189 -2.006 673 HB2 GLU 85 HB2 GLU 85 -20.624 -21.365 -4.447 674 HB3 GLU 85 HB3 GLU 85 -22.055 -22.375 -4.436 675 HG2 GLU 85 HG2 GLU 85 -23.488 -20.437 -3.938 676 HG3 GLU 85 HG3 GLU 85 -22.069 -19.394 -3.833 677 H LEU 86 H LEU 86 -19.501 -22.991 -1.435 678 HA LEU 86 HA LEU 86 -21.176 -25.438 -1.036 679 HB2 LEU 86 HB2 LEU 86 -18.355 -25.210 -2.166 680 HB3 LEU 86 HB3 LEU 86 -18.956 -26.678 -1.396 681 HG LEU 86 HG LEU 86 -19.145 -27.055 -3.680 682 HD11 LEU 86 HD11 LEU 86 -21.512 -27.432 -4.017 683 HD12 LEU 86 HD12 LEU 86 -21.121 -27.739 -2.317 684 HD13 LEU 86 HD13 LEU 86 -21.932 -26.223 -2.788 685 HD21 LEU 86 HD21 LEU 86 -20.653 -24.444 -4.022 686 HD22 LEU 86 HD22 LEU 86 -18.976 -24.768 -4.505 687 HD23 LEU 86 HD23 LEU 86 -20.316 -25.645 -5.278 688 H ALA 87 H ALA 87 -18.889 -23.137 0.260 689 HA ALA 87 HA ALA 87 -17.801 -24.767 2.339 690 HB1 ALA 87 HB1 ALA 87 -17.196 -22.598 3.354 691 HB2 ALA 87 HB2 ALA 87 -16.807 -22.628 1.622 692 HB3 ALA 87 HB3 ALA 87 -18.258 -21.766 2.187 693 H GLN 88 H GLN 88 -20.922 -23.222 1.939 694 HA GLN 88 HA GLN 88 -21.657 -23.076 4.706 695 HB2 GLN 88 HB2 GLN 88 -23.278 -23.141 2.132 696 HB3 GLN 88 HB3 GLN 88 -23.929 -22.760 3.734 697 HG2 GLN 88 HG2 GLN 88 -22.442 -20.805 3.919 698 HG3 GLN 88 HG3 GLN 88 -21.673 -21.231 2.394 699 HE21 GLN 88 HE22 GLN 88 -22.440 -20.301 0.567 700 HE22 GLN 88 HE21 GLN 88 -24.014 -19.539 0.417 701 H GLY 89 H GLY 89 -20.881 -25.771 2.989 702 HA2 GLY 89 HA2 GLY 89 -22.663 -27.470 4.651 703 HA3 GLY 89 HA3 GLY 89 -22.619 -27.717 2.893 704 H ALA 90 H ALA 90 -19.704 -27.080 2.658 705 HA ALA 90 HA ALA 90 -18.609 -29.656 3.239 706 HB1 ALA 90 HB1 ALA 90 -17.796 -28.183 1.429 707 HB2 ALA 90 HB2 ALA 90 -17.225 -27.008 2.644 708 HB3 ALA 90 HB3 ALA 90 -16.486 -28.621 2.546 709 H VAL 91 H VAL 91 -18.934 -26.702 5.094 710 HA VAL 91 HA VAL 91 -16.938 -27.167 7.074 711 HB VAL 91 HB VAL 91 -18.188 -25.058 6.562 712 HG11 VAL 91 HG11 VAL 91 -20.378 -24.666 7.566 713 HG12 VAL 91 HG12 VAL 91 -20.471 -26.009 6.412 714 HG13 VAL 91 HG13 VAL 91 -20.436 -26.337 8.160 715 HG21 VAL 91 HG21 VAL 91 -18.299 -24.257 8.867 716 HG22 VAL 91 HG22 VAL 91 -18.333 -25.923 9.473 717 HG23 VAL 91 HG23 VAL 91 -16.882 -25.302 8.646 718 H GLY 92 H GLY 92 -19.854 -28.786 6.378 719 HA2 GLY 92 HA2 GLY 92 -19.995 -29.981 9.116 720 HA3 GLY 92 HA3 GLY 92 -21.371 -29.811 8.015 721 H SER 93 H SER 93 -18.286 -30.713 6.626 722 HA SER 93 HA SER 93 -19.002 -33.596 6.628 723 HB2 SER 93 HB2 SER 93 -18.386 -31.959 4.136 724 HB3 SER 93 HB3 SER 93 -18.631 -33.723 4.216 725 HG SER 93 HG SER 93 -20.527 -31.690 4.820 726 H VAL 94 H VAL 94 -17.152 -34.768 5.294 727 HA VAL 94 HA VAL 94 -14.515 -33.650 5.964 728 HB VAL 94 HB VAL 94 -15.491 -36.325 6.979 729 HG11 VAL 94 HG11 VAL 94 -13.301 -36.361 8.150 730 HG12 VAL 94 HG12 VAL 94 -13.089 -36.291 6.391 731 HG13 VAL 94 HG13 VAL 94 -12.876 -34.821 7.367 732 HG21 VAL 94 HG21 VAL 94 -15.216 -35.323 9.235 733 HG22 VAL 94 HG22 VAL 94 -14.887 -33.741 8.476 734 HG23 VAL 94 HG23 VAL 94 -16.483 -34.517 8.294 735 H GLN 95 H GLN 95 -13.679 -33.695 3.974 736 HA GLN 95 HA GLN 95 -13.604 -36.272 2.529 737 HB2 GLN 95 HB2 GLN 95 -14.210 -35.171 0.423 738 HB3 GLN 95 HB3 GLN 95 -15.498 -35.032 1.648 739 HG2 GLN 95 HG2 GLN 95 -13.555 -32.776 1.333 740 HG3 GLN 95 HG3 GLN 95 -14.923 -32.949 0.222 741 HE21 GLN 95 HE22 GLN 95 -14.046 -31.387 3.003 742 HE22 GLN 95 HE21 GLN 95 -15.605 -31.348 3.801 743 H ILE 96 H ILE 96 -11.770 -34.096 4.002 744 HA ILE 96 HA ILE 96 -9.516 -34.539 2.154 745 HB ILE 96 HB ILE 96 -8.768 -32.179 2.493 746 HG12 ILE 96 HG12 ILE 96 -11.635 -31.695 3.431 747 HG13 ILE 96 HG13 ILE 96 -10.225 -31.751 4.511 748 HG21 ILE 96 HG21 ILE 96 -11.436 -32.431 1.069 749 HG22 ILE 96 HG22 ILE 96 -10.162 -31.252 0.738 750 HG23 ILE 96 HG23 ILE 96 -9.871 -32.968 0.420 751 HD11 ILE 96 HD11 ILE 96 -10.759 -29.438 3.956 752 HD12 ILE 96 HD12 ILE 96 -9.194 -29.886 3.244 753 HD13 ILE 96 HD13 ILE 96 -10.650 -29.788 2.220 754 HA PRO 97 HA PRO 97 -8.741 -34.579 6.882 755 HB2 PRO 97 HB2 PRO 97 -8.774 -37.245 7.509 756 HB3 PRO 97 HB3 PRO 97 -10.244 -36.223 7.529 757 HG2 PRO 97 HG2 PRO 97 -9.270 -38.038 5.302 758 HG3 PRO 97 HG3 PRO 97 -10.918 -37.950 6.015 759 HD2 PRO 97 HD2 PRO 97 -10.286 -36.640 3.715 760 HD3 PRO 97 HD3 PRO 97 -11.362 -35.895 4.941 761 H VAL 98 H VAL 98 -6.781 -35.215 7.887 762 HA VAL 98 HA VAL 98 -4.776 -36.609 6.237 763 HB VAL 98 HB VAL 98 -3.140 -34.761 6.543 764 HG11 VAL 98 HG11 VAL 98 -5.653 -33.856 5.098 765 HG12 VAL 98 HG12 VAL 98 -4.005 -33.269 4.822 766 HG13 VAL 98 HG13 VAL 98 -4.428 -34.951 4.427 767 HG21 VAL 98 HG21 VAL 98 -5.559 -33.157 7.485 768 HG22 VAL 98 HG22 VAL 98 -4.193 -33.665 8.506 769 HG23 VAL 98 HG23 VAL 98 -3.926 -32.515 7.178 770 H VAL 99 H VAL 99 -6.313 -36.701 8.983 771 HA VAL 99 HA VAL 99 -3.957 -37.465 10.574 772 HB VAL 99 HB VAL 99 -4.510 -35.048 10.991 773 HG11 VAL 99 HG11 VAL 99 -7.027 -36.176 12.291 774 HG12 VAL 99 HG12 VAL 99 -6.475 -34.490 12.338 775 HG13 VAL 99 HG13 VAL 99 -6.981 -35.220 10.795 776 HG21 VAL 99 HG21 VAL 99 -3.318 -36.439 12.662 777 HG22 VAL 99 HG22 VAL 99 -4.300 -35.159 13.403 778 HG23 VAL 99 HG23 VAL 99 -4.878 -36.830 13.427 779 H GLU 100 H GLU 100 -6.601 -38.547 9.194 780 HA GLU 100 HA GLU 100 -8.241 -39.623 11.234 781 HB2 GLU 100 HB2 GLU 100 -9.006 -41.175 9.502 782 HB3 GLU 100 HB3 GLU 100 -8.869 -39.527 8.857 783 HG2 GLU 100 HG2 GLU 100 -6.672 -40.101 7.859 784 HG3 GLU 100 HG3 GLU 100 -6.801 -41.745 8.500 785 H VAL 101 H VAL 101 -8.446 -41.968 11.791 786 HA VAL 101 HA VAL 101 -5.916 -43.459 11.844 787 HB VAL 101 HB VAL 101 -6.157 -41.874 13.802 788 HG11 VAL 101 HG11 VAL 101 -8.308 -43.841 14.677 789 HG12 VAL 101 HG12 VAL 101 -7.644 -42.508 15.643 790 HG13 VAL 101 HG13 VAL 101 -8.578 -42.152 14.177 791 HG21 VAL 101 HG21 VAL 101 -4.677 -43.874 13.851 792 HG22 VAL 101 HG22 VAL 101 -5.354 -43.501 15.453 793 HG23 VAL 101 HG23 VAL 101 -6.025 -44.842 14.505 794 H ASP 102 H ASP 102 -6.228 -45.698 12.614 795 HA ASP 102 HA ASP 102 -8.972 -46.739 12.641 796 HB2 ASP 102 HB2 ASP 102 -8.211 -46.589 10.247 797 HB3 ASP 102 HB3 ASP 102 -6.883 -47.683 10.659 798 H GLU 103 H GLU 103 -8.892 -49.179 13.092 799 HA GLU 103 HA GLU 103 -6.483 -49.936 14.656 800 HB2 GLU 103 HB2 GLU 103 -9.328 -50.106 15.650 801 HB3 GLU 103 HB3 GLU 103 -7.914 -50.702 16.487 802 HG2 GLU 103 HG2 GLU 103 -8.419 -47.778 15.805 803 HG3 GLU 103 HG3 GLU 103 -8.672 -48.532 17.378 804 H LEU 104 H LEU 104 -7.196 -52.272 15.641 805 HA LEU 104 HA LEU 104 -7.118 -54.003 13.366 806 HB2 LEU 104 HB2 LEU 104 -7.355 -55.746 15.313 807 HB3 LEU 104 HB3 LEU 104 -5.879 -54.819 15.095 808 HG LEU 104 HG LEU 104 -6.496 -53.303 16.909 809 HD11 LEU 104 HD11 LEU 104 -8.420 -53.854 18.387 810 HD12 LEU 104 HD12 LEU 104 -8.947 -53.317 16.783 811 HD13 LEU 104 HD13 LEU 104 -8.976 -55.049 17.198 812 HD21 LEU 104 HD21 LEU 104 -6.327 -54.935 18.748 813 HD22 LEU 104 HD22 LEU 104 -6.784 -56.239 17.637 814 HD23 LEU 104 HD23 LEU 104 -5.254 -55.364 17.399 815 HA PRO 105 HA PRO 105 -11.387 -55.092 12.952 816 HB2 PRO 105 HB2 PRO 105 -11.217 -57.516 11.729 817 HB3 PRO 105 HB3 PRO 105 -10.552 -56.045 10.948 818 HG2 PRO 105 HG2 PRO 105 -9.049 -58.082 12.632 819 HG3 PRO 105 HG3 PRO 105 -8.631 -57.501 10.985 820 HD2 PRO 105 HD2 PRO 105 -7.539 -56.397 13.244 821 HD3 PRO 105 HD3 PRO 105 -7.930 -55.409 11.811 822 H GLU 106 H GLU 106 -9.953 -55.733 15.536 823 HA GLU 106 HA GLU 106 -10.241 -56.861 17.436 824 HB2 GLU 106 HB2 GLU 106 -12.442 -56.793 18.280 825 HB3 GLU 106 HB3 GLU 106 -12.232 -55.430 17.160 826 HG2 GLU 106 HG2 GLU 106 -13.519 -56.528 15.454 827 HG3 GLU 106 HG3 GLU 106 -13.597 -58.035 16.395 828 H GLY 107 H GLY 107 -9.767 -58.644 15.053 829 HA2 GLY 107 HA2 GLY 107 -10.135 -61.154 16.496 830 HA3 GLY 107 HA3 GLY 107 -11.121 -61.025 15.020 831 H TYR 108 H TYR 108 -8.102 -59.292 14.970 832 HA TYR 108 HA TYR 108 -7.112 -60.762 12.761 833 HB2 TYR 108 HB2 TYR 108 -5.257 -59.330 12.827 834 HB3 TYR 108 HB3 TYR 108 -6.649 -58.369 13.301 835 HD1 TYR 108 HD2 TYR 108 -6.588 -59.534 16.315 836 HD2 TYR 108 HD1 TYR 108 -3.691 -57.767 13.667 837 HE1 TYR 108 HE2 TYR 108 -5.331 -58.687 18.254 838 HE2 TYR 108 HE1 TYR 108 -2.407 -56.945 15.616 839 HH TYR 108 HH TYR 108 -2.296 -56.801 17.907 840 H ASP 109 H ASP 109 -4.740 -61.557 12.756 841 HA ASP 109 HA ASP 109 -4.694 -63.879 14.485 842 HB2 ASP 109 HB2 ASP 109 -2.783 -62.916 12.345 843 HB3 ASP 109 HB3 ASP 109 -2.749 -64.521 13.088 844 H ARG 110 H ARG 110 -4.187 -61.136 15.629 845 HA ARG 110 HA ARG 110 -2.854 -60.021 17.053 846 HB2 ARG 110 HB2 ARG 110 -1.852 -62.783 17.775 847 HB3 ARG 110 HB3 ARG 110 -1.766 -61.311 18.753 848 HG2 ARG 110 HG2 ARG 110 -4.228 -61.150 18.778 849 HG3 ARG 110 HG3 ARG 110 -4.341 -62.657 17.843 850 HD2 ARG 110 HD2 ARG 110 -3.044 -62.358 20.585 851 HD3 ARG 110 HD3 ARG 110 -4.654 -63.021 20.286 852 HE ARG 110 HE ARG 110 -2.090 -64.353 19.861 853 HH11 ARG 110 HH11 ARG 110 -5.517 -64.318 19.005 854 HH12 ARG 110 HH12 ARG 110 -5.536 -65.994 18.513 855 HH21 ARG 110 HH21 ARG 110 -2.144 -66.532 19.216 856 HH22 ARG 110 HH22 ARG 110 -3.629 -67.245 18.638 857 H SER 111 H SER 111 -0.432 -59.958 17.999 858 HA SER 111 HA SER 111 1.193 -59.001 15.906 859 HB2 SER 111 HB2 SER 111 1.995 -59.955 18.677 860 HB3 SER 111 HB3 SER 111 2.947 -58.888 17.616 861 HG SER 111 HG SER 111 1.706 -57.709 19.144 Start of MODEL 14 1 H1 SER 2 H1 SER 2 5.283 -3.825 -7.448 2 H2 SER 2 H2 SER 2 4.414 -5.194 -7.191 3 H3 SER 2 H3 SER 2 5.982 -5.299 -7.668 4 HA SER 2 HA SER 2 6.732 -4.320 -5.621 5 HB2 SER 2 HB2 SER 2 5.128 -3.919 -3.816 6 HB3 SER 2 HB3 SER 2 4.696 -2.959 -5.248 7 HG SER 2 HG SER 2 2.880 -4.031 -4.374 8 H GLN 3 H GLN 3 6.410 -5.568 -3.331 9 HA GLN 3 HA GLN 3 7.030 -8.295 -3.874 10 HB2 GLN 3 HB2 GLN 3 6.254 -6.910 -1.279 11 HB3 GLN 3 HB3 GLN 3 6.960 -8.527 -1.395 12 HG2 GLN 3 HG2 GLN 3 8.279 -5.953 -2.355 13 HG3 GLN 3 HG3 GLN 3 8.660 -6.792 -0.851 14 HE21 GLN 3 HE22 GLN 3 10.393 -6.176 -3.210 15 HE22 GLN 3 HE21 GLN 3 11.016 -7.724 -3.745 16 H PHE 4 H PHE 4 3.969 -6.751 -3.710 17 HA PHE 4 HA PHE 4 2.318 -8.713 -2.538 18 HB2 PHE 4 HB2 PHE 4 1.735 -6.383 -3.252 19 HB3 PHE 4 HB3 PHE 4 1.767 -6.894 -4.918 20 HD1 PHE 4 HD2 PHE 4 0.173 -8.984 -5.504 21 HD2 PHE 4 HD1 PHE 4 -0.300 -6.367 -2.132 22 HE1 PHE 4 HE2 PHE 4 -2.165 -9.719 -5.270 23 HE2 PHE 4 HE1 PHE 4 -2.687 -7.024 -1.945 24 HZ PHE 4 HZ PHE 4 -3.623 -8.721 -3.505 25 H GLU 5 H GLU 5 3.912 -8.553 -5.670 26 HA GLU 5 HA GLU 5 2.454 -10.989 -6.581 27 HB2 GLU 5 HB2 GLU 5 3.987 -8.844 -8.097 28 HB3 GLU 5 HB3 GLU 5 3.261 -10.286 -8.828 29 HG2 GLU 5 HG2 GLU 5 1.031 -9.614 -7.989 30 HG3 GLU 5 HG3 GLU 5 1.737 -8.153 -7.282 31 H LYS 6 H LYS 6 5.057 -10.601 -4.769 32 HA LYS 6 HA LYS 6 6.690 -12.560 -6.283 33 HB2 LYS 6 HB2 LYS 6 7.664 -10.302 -6.074 34 HB3 LYS 6 HB3 LYS 6 7.523 -10.451 -4.322 35 HG2 LYS 6 HG2 LYS 6 9.777 -10.913 -5.072 36 HG3 LYS 6 HG3 LYS 6 9.079 -12.361 -4.337 37 HD2 LYS 6 HD2 LYS 6 8.601 -13.295 -6.564 38 HD3 LYS 6 HD3 LYS 6 9.190 -11.801 -7.333 39 HE2 LYS 6 HE2 LYS 6 11.432 -12.183 -6.345 40 HE3 LYS 6 HE3 LYS 6 10.840 -13.670 -5.576 41 HZ1 LYS 6 HZ1 LYS 6 10.410 -14.555 -7.775 42 HZ2 LYS 6 HZ2 LYS 6 10.950 -13.169 -8.477 43 HZ3 LYS 6 HZ3 LYS 6 11.987 -14.121 -7.627 44 H GLN 7 H GLN 7 5.555 -11.490 -3.013 45 HA GLN 7 HA GLN 7 6.549 -13.900 -1.750 46 HB2 GLN 7 HB2 GLN 7 5.571 -11.386 -0.954 47 HB3 GLN 7 HB3 GLN 7 4.298 -12.495 -0.449 48 HG2 GLN 7 HG2 GLN 7 7.257 -12.716 0.199 49 HG3 GLN 7 HG3 GLN 7 5.976 -12.214 1.320 50 HE21 GLN 7 HE22 GLN 7 4.004 -13.944 1.247 51 HE22 GLN 7 HE21 GLN 7 4.518 -15.600 1.453 52 H LYS 8 H LYS 8 3.540 -12.822 -3.238 53 HA LYS 8 HA LYS 8 1.769 -14.830 -2.183 54 HB2 LYS 8 HB2 LYS 8 1.200 -12.544 -3.001 55 HB3 LYS 8 HB3 LYS 8 1.669 -13.043 -4.599 56 HG2 LYS 8 HG2 LYS 8 -0.168 -14.905 -4.286 57 HG3 LYS 8 HG3 LYS 8 -0.756 -13.884 -2.999 58 HD2 LYS 8 HD2 LYS 8 -1.937 -13.329 -5.046 59 HD3 LYS 8 HD3 LYS 8 -0.851 -11.978 -4.667 60 HE2 LYS 8 HE2 LYS 8 0.784 -12.729 -6.276 61 HE3 LYS 8 HE3 LYS 8 -0.039 -14.271 -6.499 62 HZ1 LYS 8 HZ1 LYS 8 -1.880 -13.054 -7.487 63 HZ2 LYS 8 HZ2 LYS 8 -1.102 -11.617 -7.263 64 HZ3 LYS 8 HZ3 LYS 8 -0.484 -12.738 -8.297 65 H GLU 9 H GLU 9 3.815 -14.658 -5.134 66 HA GLU 9 HA GLU 9 2.400 -16.910 -6.358 67 HB2 GLU 9 HB2 GLU 9 3.132 -14.825 -7.542 68 HB3 GLU 9 HB3 GLU 9 4.816 -15.246 -7.187 69 HG2 GLU 9 HG2 GLU 9 4.287 -15.905 -9.430 70 HG3 GLU 9 HG3 GLU 9 4.550 -17.349 -8.433 71 H GLN 10 H GLN 10 5.463 -16.261 -4.626 72 HA GLN 10 HA GLN 10 6.715 -18.732 -5.441 73 HB2 GLN 10 HB2 GLN 10 7.259 -16.757 -3.201 74 HB3 GLN 10 HB3 GLN 10 8.257 -18.197 -3.493 75 HG2 GLN 10 HG2 GLN 10 8.659 -17.433 -5.830 76 HG3 GLN 10 HG3 GLN 10 7.757 -15.951 -5.491 77 HE21 GLN 10 HE22 GLN 10 8.565 -14.612 -3.611 78 HE22 GLN 10 HE21 GLN 10 10.297 -14.560 -3.330 79 H GLY 11 H GLY 11 3.958 -18.382 -3.686 80 HA2 GLY 11 HA2 GLY 11 4.532 -20.836 -2.076 81 HA3 GLY 11 HA3 GLY 11 3.429 -19.568 -1.557 82 H ASN 12 H ASN 12 2.907 -19.610 -4.828 83 HA ASN 12 HA ASN 12 0.389 -20.915 -4.585 84 HB2 ASN 12 HB2 ASN 12 0.054 -20.241 -6.713 85 HB3 ASN 12 HB3 ASN 12 1.466 -19.245 -6.412 86 HD21 ASN 12 HD22 ASN 12 3.544 -20.060 -7.211 87 HD22 ASN 12 HD21 ASN 12 3.550 -21.112 -8.608 88 H SER 13 H SER 13 3.604 -22.099 -5.341 89 HA SER 13 HA SER 13 2.591 -24.691 -6.281 90 HB2 SER 13 HB2 SER 13 5.025 -25.247 -6.383 91 HB3 SER 13 HB3 SER 13 4.618 -23.776 -7.287 92 HG SER 13 HG SER 13 6.472 -23.501 -5.944 93 H LEU 14 H LEU 14 3.985 -23.269 -3.306 94 HA LEU 14 HA LEU 14 4.406 -25.691 -1.894 95 HB2 LEU 14 HB2 LEU 14 3.955 -22.789 -1.211 96 HB3 LEU 14 HB3 LEU 14 3.911 -23.976 0.072 97 HG LEU 14 HG LEU 14 6.159 -24.754 -0.446 98 HD11 LEU 14 HD11 LEU 14 6.258 -24.368 -2.863 99 HD12 LEU 14 HD12 LEU 14 6.125 -22.609 -2.614 100 HD13 LEU 14 HD13 LEU 14 7.571 -23.489 -2.055 101 HD21 LEU 14 HD21 LEU 14 5.977 -21.721 -0.247 102 HD22 LEU 14 HD22 LEU 14 5.848 -22.862 1.117 103 HD23 LEU 14 HD23 LEU 14 7.370 -22.714 0.217 104 H PHE 15 H PHE 15 1.526 -23.669 -2.429 105 HA PHE 15 HA PHE 15 -0.235 -24.973 -0.600 106 HB2 PHE 15 HB2 PHE 15 -0.837 -22.868 -1.549 107 HB3 PHE 15 HB3 PHE 15 -0.554 -23.444 -3.187 108 HD1 PHE 15 HD1 PHE 15 -2.584 -24.788 -0.327 109 HD2 PHE 15 HD2 PHE 15 -2.487 -23.465 -4.410 110 HE1 PHE 15 HE1 PHE 15 -4.981 -25.404 -0.569 111 HE2 PHE 15 HE2 PHE 15 -4.934 -23.972 -4.629 112 HZ PHE 15 HZ PHE 15 -6.140 -24.993 -2.751 113 H LYS 16 H LYS 16 1.093 -25.929 -3.670 114 HA LYS 16 HA LYS 16 -0.943 -28.048 -4.022 115 HB2 LYS 16 HB2 LYS 16 1.243 -27.016 -5.873 116 HB3 LYS 16 HB3 LYS 16 -0.011 -28.208 -6.297 117 HG2 LYS 16 HG2 LYS 16 -1.769 -26.560 -5.916 118 HG3 LYS 16 HG3 LYS 16 -0.602 -25.387 -5.289 119 HD2 LYS 16 HD2 LYS 16 0.549 -25.390 -7.519 120 HD3 LYS 16 HD3 LYS 16 -0.802 -26.378 -8.150 121 HE2 LYS 16 HE2 LYS 16 -2.380 -24.601 -7.316 122 HE3 LYS 16 HE3 LYS 16 -0.975 -23.620 -6.850 123 HZ1 LYS 16 HZ1 LYS 16 -1.566 -24.517 -9.590 124 HZ2 LYS 16 HZ2 LYS 16 -1.811 -22.999 -9.006 125 HZ3 LYS 16 HZ3 LYS 16 -0.287 -23.589 -9.131 126 H GLN 17 H GLN 17 2.089 -27.640 -2.561 127 HA GLN 17 HA GLN 17 3.156 -30.288 -3.168 128 HB2 GLN 17 HB2 GLN 17 3.952 -28.225 -1.120 129 HB3 GLN 17 HB3 GLN 17 4.757 -29.781 -1.376 130 HG2 GLN 17 HG2 GLN 17 4.951 -29.088 -3.866 131 HG3 GLN 17 HG3 GLN 17 4.574 -27.457 -3.300 132 HE21 GLN 17 HE22 GLN 17 5.852 -27.175 -0.941 133 HE22 GLN 17 HE21 GLN 17 7.570 -27.399 -1.138 134 H GLY 18 H GLY 18 0.872 -28.991 -0.819 135 HA2 GLY 18 HA2 GLY 18 -0.561 -30.478 0.371 136 HA3 GLY 18 HA3 GLY 18 0.686 -31.723 0.338 137 H LEU 19 H LEU 19 1.384 -28.364 1.274 138 HA LEU 19 HA LEU 19 1.492 -29.154 4.128 139 HB2 LEU 19 HB2 LEU 19 3.713 -27.903 4.245 140 HB3 LEU 19 HB3 LEU 19 3.691 -29.535 3.568 141 HG LEU 19 HG LEU 19 3.785 -28.658 1.288 142 HD11 LEU 19 HD11 LEU 19 4.281 -26.261 0.895 143 HD12 LEU 19 HD12 LEU 19 2.667 -26.487 1.589 144 HD13 LEU 19 HD13 LEU 19 3.999 -25.930 2.617 145 HD21 LEU 19 HD21 LEU 19 6.099 -27.804 1.411 146 HD22 LEU 19 HD22 LEU 19 5.886 -27.472 3.144 147 HD23 LEU 19 HD23 LEU 19 5.851 -29.151 2.545 148 H TYR 20 H TYR 20 -0.619 -27.922 3.345 149 HA TYR 20 HA TYR 20 -0.745 -25.294 2.669 150 HB2 TYR 20 HB2 TYR 20 -2.649 -26.527 4.641 151 HB3 TYR 20 HB3 TYR 20 -3.012 -25.378 3.359 152 HD1 TYR 20 HD1 TYR 20 -1.727 -26.613 0.984 153 HD2 TYR 20 HD2 TYR 20 -3.869 -28.426 4.244 154 HE1 TYR 20 HE1 TYR 20 -2.298 -28.552 -0.458 155 HE2 TYR 20 HE2 TYR 20 -4.467 -30.341 2.801 156 HH TYR 20 HH TYR 20 -3.335 -30.578 -0.603 157 H ARG 21 H ARG 21 0.203 -26.395 5.901 158 HA ARG 21 HA ARG 21 -0.663 -24.032 7.267 159 HB2 ARG 21 HB2 ARG 21 0.317 -26.562 7.939 160 HB3 ARG 21 HB3 ARG 21 1.648 -25.499 8.420 161 HG2 ARG 21 HG2 ARG 21 -1.274 -25.250 9.248 162 HG3 ARG 21 HG3 ARG 21 0.055 -25.863 10.265 163 HD2 ARG 21 HD2 ARG 21 1.188 -23.647 10.036 164 HD3 ARG 21 HD3 ARG 21 -0.228 -23.050 9.135 165 HE ARG 21 HE ARG 21 -1.259 -24.058 11.518 166 HH11 ARG 21 HH11 ARG 21 1.077 -21.593 10.594 167 HH12 ARG 21 HH12 ARG 21 0.794 -20.614 12.015 168 HH21 ARG 21 HH21 ARG 21 -1.627 -22.776 13.355 169 HH22 ARG 21 HH22 ARG 21 -0.756 -21.284 13.582 170 H GLU 22 H GLU 22 1.709 -24.291 4.970 171 HA GLU 22 HA GLU 22 2.730 -21.667 5.823 172 HB2 GLU 22 HB2 GLU 22 5.026 -22.206 5.108 173 HB3 GLU 22 HB3 GLU 22 4.486 -23.130 6.519 174 HG2 GLU 22 HG2 GLU 22 3.851 -24.980 5.023 175 HG3 GLU 22 HG3 GLU 22 4.536 -24.113 3.632 176 H ALA 23 H ALA 23 0.742 -22.898 3.924 177 HA ALA 23 HA ALA 23 1.572 -21.375 1.522 178 HB1 ALA 23 HB1 ALA 23 0.741 -23.087 0.081 179 HB2 ALA 23 HB2 ALA 23 1.967 -23.803 1.148 180 HB3 ALA 23 HB3 ALA 23 0.238 -24.097 1.452 181 H VAL 24 H VAL 24 -0.227 -21.088 3.970 182 HA VAL 24 HA VAL 24 -2.707 -20.160 2.549 183 HB VAL 24 HB VAL 24 -2.008 -20.864 5.446 184 HG11 VAL 24 HG11 VAL 24 -4.586 -19.615 4.367 185 HG12 VAL 24 HG12 VAL 24 -4.345 -20.219 6.023 186 HG13 VAL 24 HG13 VAL 24 -3.407 -18.833 5.445 187 HG21 VAL 24 HG21 VAL 24 -2.749 -22.739 3.834 188 HG22 VAL 24 HG22 VAL 24 -3.831 -22.523 5.231 189 HG23 VAL 24 HG23 VAL 24 -4.276 -21.875 3.643 190 H HIS 25 H HIS 25 -0.388 -19.725 5.148 191 HA HIS 25 HA HIS 25 -0.532 -16.995 5.690 192 HB2 HIS 25 HB2 HIS 25 1.542 -19.216 5.874 193 HB3 HIS 25 HB3 HIS 25 1.645 -17.698 6.678 194 HD2 HIS 25 HD2 HIS 25 0.181 -17.272 8.866 195 HE1 HIS 25 HE1 HIS 25 -1.613 -21.128 9.039 196 HE2 HIS 25 HE2 HIS 25 -1.272 -18.930 10.293 197 H CYS 26 H CYS 26 0.783 -18.707 2.982 198 HA CYS 26 HA CYS 26 2.746 -16.727 2.170 199 HB2 CYS 26 HB2 CYS 26 2.939 -18.075 0.219 200 HB3 CYS 26 HB3 CYS 26 2.750 -19.190 1.590 201 HG CYS 26 HG CYS 26 0.113 -19.405 1.272 202 H TYR 27 H TYR 27 -0.555 -16.803 2.176 203 HA TYR 27 HA TYR 27 -0.739 -14.794 -0.026 204 HB2 TYR 27 HB2 TYR 27 -2.991 -16.463 1.069 205 HB3 TYR 27 HB3 TYR 27 -3.051 -15.417 -0.355 206 HD1 TYR 27 HD2 TYR 27 -0.758 -16.194 -1.967 207 HD2 TYR 27 HD1 TYR 27 -3.329 -18.594 0.497 208 HE1 TYR 27 HE2 TYR 27 -0.277 -18.171 -3.399 209 HE2 TYR 27 HE1 TYR 27 -2.845 -20.582 -0.919 210 HH TYR 27 HH TYR 27 -1.748 -21.383 -2.736 211 H ASP 28 H ASP 28 -0.622 -14.906 3.293 212 HA ASP 28 HA ASP 28 -2.980 -13.351 3.935 213 HB2 ASP 28 HB2 ASP 28 -1.661 -14.951 5.422 214 HB3 ASP 28 HB3 ASP 28 -0.431 -13.689 5.571 215 H GLN 29 H GLN 29 0.291 -12.556 2.925 216 HA GLN 29 HA GLN 29 0.578 -9.961 3.980 217 HB2 GLN 29 HB2 GLN 29 1.438 -10.306 1.179 218 HB3 GLN 29 HB3 GLN 29 2.257 -9.611 2.568 219 HG2 GLN 29 HG2 GLN 29 3.388 -11.505 2.083 220 HG3 GLN 29 HG3 GLN 29 2.437 -12.019 3.463 221 HE21 GLN 29 HE22 GLN 29 2.296 -11.924 -0.200 222 HE22 GLN 29 HE21 GLN 29 1.496 -13.463 -0.358 223 H LEU 30 H LEU 30 -1.078 -11.186 1.150 224 HA LEU 30 HA LEU 30 -1.600 -8.694 -0.164 225 HB2 LEU 30 HB2 LEU 30 -3.022 -11.366 -0.488 226 HB3 LEU 30 HB3 LEU 30 -3.026 -10.028 -1.631 227 HG LEU 30 HG LEU 30 -1.465 -11.369 -2.605 228 HD11 LEU 30 HD11 LEU 30 0.850 -10.719 -2.107 229 HD12 LEU 30 HD12 LEU 30 -0.212 -9.306 -2.010 230 HD13 LEU 30 HD13 LEU 30 0.372 -10.078 -0.546 231 HD21 LEU 30 HD21 LEU 30 -0.645 -12.322 0.163 232 HD22 LEU 30 HD22 LEU 30 -1.712 -13.150 -0.996 233 HD23 LEU 30 HD23 LEU 30 0.005 -12.920 -1.356 234 H ILE 31 H ILE 31 -2.848 -9.717 2.706 235 HA ILE 31 HA ILE 31 -5.467 -8.400 2.237 236 HB ILE 31 HB ILE 31 -4.647 -10.607 4.148 237 HG12 ILE 31 HG12 ILE 31 -6.836 -10.879 2.097 238 HG13 ILE 31 HG13 ILE 31 -5.182 -10.998 1.547 239 HG21 ILE 31 HG21 ILE 31 -6.293 -9.241 5.268 240 HG22 ILE 31 HG22 ILE 31 -7.317 -9.193 3.809 241 HG23 ILE 31 HG23 ILE 31 -7.099 -10.716 4.715 242 HD11 ILE 31 HD11 ILE 31 -6.037 -13.201 2.103 243 HD12 ILE 31 HD12 ILE 31 -4.697 -12.704 3.187 244 HD13 ILE 31 HD13 ILE 31 -6.375 -12.657 3.772 245 H THR 32 H THR 32 -2.436 -8.254 3.657 246 HA THR 32 HA THR 32 -3.332 -6.226 5.676 247 HB THR 32 HB THR 32 -0.852 -7.994 5.679 248 HG1 THR 32 HG1 THR 32 -2.720 -9.148 6.149 249 HG21 THR 32 HG21 THR 32 -0.383 -5.913 6.842 250 HG22 THR 32 HG22 THR 32 -1.937 -6.003 7.710 251 HG23 THR 32 HG23 THR 32 -0.654 -7.188 8.039 252 H ALA 33 H ALA 33 -1.399 -6.732 2.791 253 HA ALA 33 HA ALA 33 0.170 -4.260 3.241 254 HB1 ALA 33 HB1 ALA 33 0.131 -6.279 0.953 255 HB2 ALA 33 HB2 ALA 33 1.304 -4.951 1.159 256 HB3 ALA 33 HB3 ALA 33 1.261 -6.292 2.326 257 H GLN 34 H GLN 34 -2.671 -5.379 1.581 258 HA GLN 34 HA GLN 34 -3.739 -2.935 0.887 259 HB2 GLN 34 HB2 GLN 34 -3.404 -2.915 -1.621 260 HB3 GLN 34 HB3 GLN 34 -2.054 -2.371 -0.629 261 HG2 GLN 34 HG2 GLN 34 -1.312 -4.938 -0.873 262 HG3 GLN 34 HG3 GLN 34 -2.327 -4.824 -2.327 263 HE21 GLN 34 HE22 GLN 34 0.252 -3.073 -0.527 264 HE22 GLN 34 HE21 GLN 34 1.146 -2.565 -1.944 265 HA PRO 35 HA PRO 35 -6.210 -6.795 0.663 266 HB2 PRO 35 HB2 PRO 35 -8.335 -5.828 2.138 267 HB3 PRO 35 HB3 PRO 35 -6.858 -6.560 2.843 268 HG2 PRO 35 HG2 PRO 35 -7.495 -3.632 2.444 269 HG3 PRO 35 HG3 PRO 35 -6.846 -4.435 3.909 270 HD2 PRO 35 HD2 PRO 35 -5.228 -3.147 2.166 271 HD3 PRO 35 HD3 PRO 35 -4.705 -4.678 2.926 272 H GLN 36 H GLN 36 -6.437 -3.709 -0.664 273 HA GLN 36 HA GLN 36 -9.099 -3.657 -1.642 274 HB2 GLN 36 HB2 GLN 36 -8.300 -1.831 -3.042 275 HB3 GLN 36 HB3 GLN 36 -7.617 -1.696 -1.408 276 HG2 GLN 36 HG2 GLN 36 -5.535 -2.805 -2.236 277 HG3 GLN 36 HG3 GLN 36 -6.220 -2.835 -3.865 278 HE21 GLN 36 HE22 GLN 36 -3.809 -1.580 -3.550 279 HE22 GLN 36 HE21 GLN 36 -4.015 0.152 -3.658 280 H ASN 37 H ASN 37 -7.343 -6.184 -2.240 281 HA ASN 37 HA ASN 37 -8.067 -6.355 -5.114 282 HB2 ASN 37 HB2 ASN 37 -5.403 -7.010 -3.806 283 HB3 ASN 37 HB3 ASN 37 -5.861 -7.582 -5.426 284 HD21 ASN 37 HD22 ASN 37 -4.158 -5.237 -3.828 285 HD22 ASN 37 HD21 ASN 37 -4.216 -3.968 -5.038 286 HA PRO 38 HA PRO 38 -9.975 -10.017 -3.424 287 HB2 PRO 38 HB2 PRO 38 -10.990 -11.070 -5.691 288 HB3 PRO 38 HB3 PRO 38 -11.555 -9.501 -5.052 289 HG2 PRO 38 HG2 PRO 38 -9.439 -9.920 -7.182 290 HG3 PRO 38 HG3 PRO 38 -10.930 -8.928 -7.294 291 HD2 PRO 38 HD2 PRO 38 -8.622 -7.732 -6.556 292 HD3 PRO 38 HD3 PRO 38 -10.119 -7.377 -5.722 293 H VAL 39 H VAL 39 -7.271 -10.090 -5.685 294 HA VAL 39 HA VAL 39 -7.154 -12.933 -6.027 295 HB VAL 39 HB VAL 39 -6.012 -11.212 -7.414 296 HG11 VAL 39 HG11 VAL 39 -3.989 -11.138 -5.149 297 HG12 VAL 39 HG12 VAL 39 -3.844 -10.342 -6.736 298 HG13 VAL 39 HG13 VAL 39 -5.091 -9.807 -5.590 299 HG21 VAL 39 HG21 VAL 39 -5.428 -13.620 -7.514 300 HG22 VAL 39 HG22 VAL 39 -4.040 -12.572 -7.862 301 HG23 VAL 39 HG23 VAL 39 -4.180 -13.355 -6.273 302 H GLY 40 H GLY 40 -6.085 -10.768 -3.475 303 HA2 GLY 40 HA2 GLY 40 -4.472 -12.564 -1.949 304 HA3 GLY 40 HA3 GLY 40 -5.366 -11.156 -1.336 305 H TYR 41 H TYR 41 -7.862 -12.509 -2.614 306 HA TYR 41 HA TYR 41 -8.371 -14.499 -0.466 307 HB2 TYR 41 HB2 TYR 41 -10.553 -12.908 -1.789 308 HB3 TYR 41 HB3 TYR 41 -10.590 -13.729 -0.298 309 HD1 TYR 41 HD1 TYR 41 -8.994 -10.742 -1.869 310 HD2 TYR 41 HD2 TYR 41 -10.269 -12.659 1.748 311 HE1 TYR 41 HE1 TYR 41 -8.635 -8.623 -0.635 312 HE2 TYR 41 HE2 TYR 41 -9.896 -10.540 3.007 313 HH TYR 41 HH TYR 41 -8.752 -7.564 1.379 314 H SER 42 H SER 42 -7.327 -14.771 -3.326 315 HA SER 42 HA SER 42 -9.508 -16.551 -4.334 316 HB2 SER 42 HB2 SER 42 -9.134 -14.476 -5.714 317 HB3 SER 42 HB3 SER 42 -7.482 -15.041 -6.021 318 HG SER 42 HG SER 42 -8.418 -16.964 -6.893 319 H ASN 43 H ASN 43 -6.638 -16.539 -2.786 320 HA ASN 43 HA ASN 43 -5.920 -19.220 -3.846 321 HB2 ASN 43 HB2 ASN 43 -4.029 -16.946 -3.097 322 HB3 ASN 43 HB3 ASN 43 -3.564 -18.603 -3.476 323 HD21 ASN 43 HD22 ASN 43 -4.578 -15.521 -4.785 324 HD22 ASN 43 HD21 ASN 43 -4.382 -15.957 -6.469 325 H LYS 44 H LYS 44 -5.777 -16.833 -1.119 326 HA LYS 44 HA LYS 44 -5.259 -18.843 0.892 327 HB2 LYS 44 HB2 LYS 44 -5.043 -16.305 1.051 328 HB3 LYS 44 HB3 LYS 44 -6.774 -16.227 1.156 329 HG2 LYS 44 HG2 LYS 44 -6.731 -17.699 3.168 330 HG3 LYS 44 HG3 LYS 44 -4.958 -17.775 3.062 331 HD2 LYS 44 HD2 LYS 44 -4.812 -15.343 3.405 332 HD3 LYS 44 HD3 LYS 44 -6.593 -15.232 3.423 333 HE2 LYS 44 HE2 LYS 44 -6.645 -16.781 5.380 334 HE3 LYS 44 HE3 LYS 44 -4.868 -16.785 5.398 335 HZ1 LYS 44 HZ1 LYS 44 -4.915 -14.425 5.832 336 HZ2 LYS 44 HZ2 LYS 44 -6.565 -14.386 5.746 337 HZ3 LYS 44 HZ3 LYS 44 -5.816 -15.207 6.958 338 H ALA 45 H ALA 45 -8.094 -17.488 -0.677 339 HA ALA 45 HA ALA 45 -10.098 -18.812 0.856 340 HB1 ALA 45 HB1 ALA 45 -10.180 -17.806 -2.010 341 HB2 ALA 45 HB2 ALA 45 -11.583 -18.156 -0.981 342 HB3 ALA 45 HB3 ALA 45 -10.487 -16.815 -0.560 343 H MET 46 H MET 46 -7.731 -20.292 -0.953 344 HA MET 46 HA MET 46 -9.469 -22.671 -1.474 345 HB2 MET 46 HB2 MET 46 -7.025 -21.731 -3.039 346 HB3 MET 46 HB3 MET 46 -7.879 -23.256 -3.292 347 HG2 MET 46 HG2 MET 46 -8.997 -20.468 -3.710 348 HG3 MET 46 HG3 MET 46 -8.516 -21.625 -4.954 349 HE1 MET 46 HE1 MET 46 -9.786 -23.844 -5.523 350 HE2 MET 46 HE2 MET 46 -9.659 -24.377 -3.834 351 HE3 MET 46 HE3 MET 46 -11.230 -24.426 -4.655 352 H ALA 47 H ALA 47 -6.800 -21.351 0.243 353 HA ALA 47 HA ALA 47 -5.694 -24.080 0.682 354 HB1 ALA 47 HB1 ALA 47 -4.127 -22.365 -0.179 355 HB2 ALA 47 HB2 ALA 47 -4.477 -21.350 1.239 356 HB3 ALA 47 HB3 ALA 47 -3.673 -22.922 1.446 357 H LEU 48 H LEU 48 -7.317 -21.350 2.238 358 HA LEU 48 HA LEU 48 -6.783 -22.271 4.917 359 HB2 LEU 48 HB2 LEU 48 -7.273 -19.918 4.254 360 HB3 LEU 48 HB3 LEU 48 -8.915 -20.403 3.791 361 HG LEU 48 HG LEU 48 -9.414 -21.002 6.110 362 HD11 LEU 48 HD11 LEU 48 -6.559 -20.106 6.684 363 HD12 LEU 48 HD12 LEU 48 -7.787 -20.449 7.921 364 HD13 LEU 48 HD13 LEU 48 -7.199 -21.757 6.888 365 HD21 LEU 48 HD21 LEU 48 -8.065 -18.288 5.771 366 HD22 LEU 48 HD22 LEU 48 -9.759 -18.686 5.402 367 HD23 LEU 48 HD23 LEU 48 -9.186 -18.705 7.080 368 H ILE 49 H ILE 49 -9.235 -22.855 2.423 369 HA ILE 49 HA ILE 49 -11.059 -24.353 4.066 370 HB ILE 49 HB ILE 49 -11.766 -25.369 1.907 371 HG12 ILE 49 HG12 ILE 49 -9.793 -23.457 0.660 372 HG13 ILE 49 HG13 ILE 49 -9.361 -25.127 0.934 373 HG21 ILE 49 HG21 ILE 49 -11.472 -22.331 1.838 374 HG22 ILE 49 HG22 ILE 49 -12.679 -23.293 0.959 375 HG23 ILE 49 HG23 ILE 49 -12.732 -23.226 2.726 376 HD11 ILE 49 HD11 ILE 49 -10.143 -24.909 -1.328 377 HD12 ILE 49 HD12 ILE 49 -11.163 -25.984 -0.353 378 HD13 ILE 49 HD13 ILE 49 -11.715 -24.324 -0.756 379 H LYS 50 H LYS 50 -7.965 -24.973 2.603 380 HA LYS 50 HA LYS 50 -8.330 -27.744 2.118 381 HB2 LYS 50 HB2 LYS 50 -6.634 -25.836 1.212 382 HB3 LYS 50 HB3 LYS 50 -5.586 -26.581 2.418 383 HG2 LYS 50 HG2 LYS 50 -5.094 -27.817 0.542 384 HG3 LYS 50 HG3 LYS 50 -6.386 -28.831 1.206 385 HD2 LYS 50 HD2 LYS 50 -6.603 -26.723 -0.986 386 HD3 LYS 50 HD3 LYS 50 -6.608 -28.480 -1.223 387 HE2 LYS 50 HE2 LYS 50 -8.712 -28.565 0.181 388 HE3 LYS 50 HE3 LYS 50 -8.722 -26.785 0.145 389 HZ1 LYS 50 HZ1 LYS 50 -8.808 -28.554 -2.215 390 HZ2 LYS 50 HZ2 LYS 50 -10.088 -27.735 -1.590 391 HZ3 LYS 50 HZ3 LYS 50 -8.825 -26.904 -2.249 392 H LEU 51 H LEU 51 -8.076 -26.154 4.996 393 HA LEU 51 HA LEU 51 -6.571 -28.329 6.376 394 HB2 LEU 51 HB2 LEU 51 -6.639 -25.335 6.833 395 HB3 LEU 51 HB3 LEU 51 -6.037 -26.469 8.053 396 HG LEU 51 HG LEU 51 -4.920 -26.378 5.233 397 HD11 LEU 51 HD11 LEU 51 -3.925 -25.022 7.775 398 HD12 LEU 51 HD12 LEU 51 -3.071 -25.065 6.209 399 HD13 LEU 51 HD13 LEU 51 -4.613 -24.207 6.350 400 HD21 LEU 51 HD21 LEU 51 -4.505 -28.469 6.474 401 HD22 LEU 51 HD22 LEU 51 -3.001 -27.527 6.399 402 HD23 LEU 51 HD23 LEU 51 -3.959 -27.548 7.893 403 H GLY 52 H GLY 52 -9.617 -26.903 5.926 404 HA2 GLY 52 HA2 GLY 52 -11.505 -27.942 6.984 405 HA3 GLY 52 HA3 GLY 52 -10.561 -28.122 8.472 406 H GLU 53 H GLU 53 -9.722 -25.085 7.564 407 HA GLU 53 HA GLU 53 -11.581 -23.893 9.465 408 HB2 GLU 53 HB2 GLU 53 -9.289 -22.697 7.861 409 HB3 GLU 53 HB3 GLU 53 -10.212 -21.862 9.103 410 HG2 GLU 53 HG2 GLU 53 -9.578 -23.697 10.719 411 HG3 GLU 53 HG3 GLU 53 -8.452 -24.303 9.487 412 H TYR 54 H TYR 54 -13.107 -24.791 7.339 413 HA TYR 54 HA TYR 54 -13.502 -22.967 5.211 414 HB2 TYR 54 HB2 TYR 54 -15.315 -24.906 6.658 415 HB3 TYR 54 HB3 TYR 54 -15.904 -23.903 5.332 416 HD1 TYR 54 HD1 TYR 54 -13.467 -26.582 6.200 417 HD2 TYR 54 HD2 TYR 54 -15.451 -24.397 3.076 418 HE1 TYR 54 HE1 TYR 54 -12.599 -28.194 4.526 419 HE2 TYR 54 HE2 TYR 54 -14.621 -26.030 1.400 420 HH TYR 54 HH TYR 54 -12.534 -28.797 2.314 421 H THR 55 H THR 55 -14.529 -22.834 8.603 422 HA THR 55 HA THR 55 -16.585 -20.893 8.326 423 HB THR 55 HB THR 55 -14.640 -21.413 10.610 424 HG1 THR 55 HG1 THR 55 -16.325 -22.715 11.360 425 HG21 THR 55 HG21 THR 55 -15.809 -19.241 10.862 426 HG22 THR 55 HG22 THR 55 -17.366 -20.029 10.528 427 HG23 THR 55 HG23 THR 55 -16.458 -20.419 12.018 428 H GLN 56 H GLN 56 -13.032 -20.599 8.463 429 HA GLN 56 HA GLN 56 -13.155 -17.666 8.604 430 HB2 GLN 56 HB2 GLN 56 -10.916 -19.695 8.429 431 HB3 GLN 56 HB3 GLN 56 -10.675 -17.941 8.321 432 HG2 GLN 56 HG2 GLN 56 -10.289 -18.571 10.551 433 HG3 GLN 56 HG3 GLN 56 -11.780 -17.638 10.514 434 HE21 GLN 56 HE22 GLN 56 -10.343 -20.868 10.922 435 HE22 GLN 56 HE21 GLN 56 -11.748 -21.596 11.682 436 H ALA 57 H ALA 57 -12.976 -20.231 6.170 437 HA ALA 57 HA ALA 57 -11.649 -18.631 4.164 438 HB1 ALA 57 HB1 ALA 57 -13.335 -21.147 3.923 439 HB2 ALA 57 HB2 ALA 57 -12.277 -20.468 2.669 440 HB3 ALA 57 HB3 ALA 57 -11.577 -21.091 4.182 441 H ILE 58 H ILE 58 -15.083 -19.455 4.866 442 HA ILE 58 HA ILE 58 -16.243 -18.142 2.607 443 HB ILE 58 HB ILE 58 -17.206 -18.495 5.505 444 HG12 ILE 58 HG12 ILE 58 -17.862 -20.198 3.090 445 HG13 ILE 58 HG13 ILE 58 -16.552 -20.600 4.199 446 HG21 ILE 58 HG21 ILE 58 -19.481 -18.275 4.628 447 HG22 ILE 58 HG22 ILE 58 -18.549 -16.827 4.224 448 HG23 ILE 58 HG23 ILE 58 -18.857 -18.078 2.985 449 HD11 ILE 58 HD11 ILE 58 -18.510 -21.833 4.897 450 HD12 ILE 58 HD12 ILE 58 -18.178 -20.567 6.096 451 HD13 ILE 58 HD13 ILE 58 -19.498 -20.367 4.922 452 H GLN 59 H GLN 59 -15.107 -16.897 5.787 453 HA GLN 59 HA GLN 59 -16.242 -14.280 5.398 454 HB2 GLN 59 HB2 GLN 59 -13.818 -15.164 7.027 455 HB3 GLN 59 HB3 GLN 59 -14.619 -13.587 7.144 456 HG2 GLN 59 HG2 GLN 59 -16.726 -14.690 7.829 457 HG3 GLN 59 HG3 GLN 59 -15.950 -16.276 7.678 458 HE21 GLN 59 HE22 GLN 59 -15.544 -17.105 9.656 459 HE22 GLN 59 HE21 GLN 59 -14.938 -16.200 11.032 460 H MET 60 H MET 60 -13.145 -15.820 4.437 461 HA MET 60 HA MET 60 -11.999 -13.388 3.411 462 HB2 MET 60 HB2 MET 60 -11.474 -16.311 2.710 463 HB3 MET 60 HB3 MET 60 -10.441 -14.964 2.232 464 HG2 MET 60 HG2 MET 60 -11.039 -15.408 5.156 465 HG3 MET 60 HG3 MET 60 -9.895 -16.456 4.325 466 HE1 MET 60 HE1 MET 60 -10.384 -12.454 3.876 467 HE2 MET 60 HE2 MET 60 -10.707 -12.889 5.570 468 HE3 MET 60 HE3 MET 60 -9.243 -11.949 5.126 469 H CYS 61 H CYS 61 -14.160 -15.902 2.077 470 HA CYS 61 HA CYS 61 -13.856 -15.074 -0.645 471 HB2 CYS 61 HB2 CYS 61 -16.166 -16.500 0.772 472 HB3 CYS 61 HB3 CYS 61 -15.992 -16.336 -0.972 473 HG CYS 61 HG CYS 61 -13.636 -17.437 -1.146 474 H GLN 62 H GLN 62 -16.277 -14.164 1.922 475 HA GLN 62 HA GLN 62 -17.677 -12.367 0.155 476 HB2 GLN 62 HB2 GLN 62 -17.528 -12.489 3.191 477 HB3 GLN 62 HB3 GLN 62 -18.735 -11.592 2.239 478 HG2 GLN 62 HG2 GLN 62 -19.632 -13.644 1.304 479 HG3 GLN 62 HG3 GLN 62 -18.324 -14.589 2.004 480 HE21 GLN 62 HE22 GLN 62 -20.047 -15.875 2.863 481 HE22 GLN 62 HE21 GLN 62 -20.842 -15.356 4.325 482 H GLN 63 H GLN 63 -14.834 -12.030 2.271 483 HA GLN 63 HA GLN 63 -14.828 -9.135 2.248 484 HB2 GLN 63 HB2 GLN 63 -12.791 -11.298 2.867 485 HB3 GLN 63 HB3 GLN 63 -12.348 -9.585 2.898 486 HG2 GLN 63 HG2 GLN 63 -14.734 -10.559 4.488 487 HG3 GLN 63 HG3 GLN 63 -13.087 -10.748 5.099 488 HE21 GLN 63 HE22 GLN 63 -12.936 -9.274 6.717 489 HE22 GLN 63 HE21 GLN 63 -13.222 -7.560 6.520 490 H GLY 64 H GLY 64 -13.676 -11.651 0.010 491 HA2 GLY 64 HA2 GLY 64 -11.881 -9.786 -1.363 492 HA3 GLY 64 HA3 GLY 64 -12.249 -11.459 -1.803 493 H LEU 65 H LEU 65 -15.204 -11.030 -1.721 494 HA LEU 65 HA LEU 65 -15.586 -10.113 -4.418 495 HB2 LEU 65 HB2 LEU 65 -17.391 -10.884 -2.111 496 HB3 LEU 65 HB3 LEU 65 -18.070 -10.258 -3.620 497 HG LEU 65 HG LEU 65 -16.155 -12.640 -3.578 498 HD11 LEU 65 HD11 LEU 65 -18.154 -14.034 -3.772 499 HD12 LEU 65 HD12 LEU 65 -18.178 -13.144 -2.239 500 HD13 LEU 65 HD13 LEU 65 -19.201 -12.612 -3.590 501 HD21 LEU 65 HD21 LEU 65 -17.182 -13.069 -5.771 502 HD22 LEU 65 HD22 LEU 65 -18.150 -11.586 -5.617 503 HD23 LEU 65 HD23 LEU 65 -16.380 -11.484 -5.741 504 H ARG 66 H ARG 66 -14.980 -8.326 -1.627 505 HA ARG 66 HA ARG 66 -16.610 -5.990 -2.299 506 HB2 ARG 66 HB2 ARG 66 -14.172 -6.300 -0.488 507 HB3 ARG 66 HB3 ARG 66 -15.302 -4.939 -0.503 508 HG2 ARG 66 HG2 ARG 66 -17.124 -6.452 0.250 509 HG3 ARG 66 HG3 ARG 66 -15.986 -7.805 0.245 510 HD2 ARG 66 HD2 ARG 66 -16.208 -6.976 2.513 511 HD3 ARG 66 HD3 ARG 66 -14.575 -6.620 1.912 512 HE ARG 66 HE ARG 66 -16.378 -4.414 1.429 513 HH11 ARG 66 HH11 ARG 66 -14.483 -6.012 3.957 514 HH12 ARG 66 HH12 ARG 66 -14.292 -4.546 4.897 515 HH21 ARG 66 HH21 ARG 66 -16.129 -2.524 2.697 516 HH22 ARG 66 HH22 ARG 66 -15.225 -2.581 4.187 517 H TYR 67 H TYR 67 -14.112 -7.423 -3.886 518 HA TYR 67 HA TYR 67 -12.728 -4.887 -4.632 519 HB2 TYR 67 HB2 TYR 67 -11.480 -7.527 -3.803 520 HB3 TYR 67 HB3 TYR 67 -10.573 -6.141 -4.375 521 HD1 TYR 67 HD1 TYR 67 -11.540 -3.827 -3.064 522 HD2 TYR 67 HD2 TYR 67 -11.294 -7.824 -1.515 523 HE1 TYR 67 HE1 TYR 67 -11.531 -2.929 -0.751 524 HE2 TYR 67 HE2 TYR 67 -11.302 -6.938 0.803 525 HH TYR 67 HH TYR 67 -11.471 -3.424 1.480 526 H THR 68 H THR 68 -14.716 -7.088 -5.780 527 HA THR 68 HA THR 68 -13.243 -7.604 -8.313 528 HB THR 68 HB THR 68 -15.198 -9.251 -8.658 529 HG1 THR 68 HG1 THR 68 -16.570 -8.392 -7.071 530 HG21 THR 68 HG21 THR 68 -14.102 -10.921 -7.194 531 HG22 THR 68 HG22 THR 68 -12.873 -9.870 -7.929 532 HG23 THR 68 HG23 THR 68 -13.365 -9.622 -6.236 533 H SER 69 H SER 69 -14.684 -5.081 -7.302 534 HA SER 69 HA SER 69 -17.070 -4.680 -8.764 535 HB2 SER 69 HB2 SER 69 -15.008 -2.708 -7.712 536 HB3 SER 69 HB3 SER 69 -16.656 -2.296 -8.226 537 HG SER 69 HG SER 69 -16.493 -2.635 -5.947 538 H THR 70 H THR 70 -14.256 -5.392 -10.269 539 HA THR 70 HA THR 70 -14.957 -3.745 -12.612 540 HB THR 70 HB THR 70 -13.347 -2.338 -11.563 541 HG1 THR 70 HG1 THR 70 -11.713 -2.385 -13.108 542 HG21 THR 70 HG21 THR 70 -12.333 -3.901 -9.985 543 HG22 THR 70 HG22 THR 70 -11.591 -4.809 -11.324 544 HG23 THR 70 HG23 THR 70 -11.069 -3.140 -10.970 545 H ALA 71 H ALA 71 -13.758 -4.426 -14.552 546 HA ALA 71 HA ALA 71 -14.127 -7.210 -14.975 547 HB1 ALA 71 HB1 ALA 71 -14.468 -5.441 -16.658 548 HB2 ALA 71 HB2 ALA 71 -12.728 -5.075 -16.642 549 HB3 ALA 71 HB3 ALA 71 -13.294 -6.652 -17.239 550 H GLU 72 H GLU 72 -11.401 -5.537 -13.662 551 HA GLU 72 HA GLU 72 -9.289 -7.168 -14.694 552 HB2 GLU 72 HB2 GLU 72 -9.526 -5.692 -12.063 553 HB3 GLU 72 HB3 GLU 72 -8.024 -6.340 -12.726 554 HG2 GLU 72 HG2 GLU 72 -9.750 -4.183 -14.005 555 HG3 GLU 72 HG3 GLU 72 -8.220 -3.930 -13.150 556 H HIS 73 H HIS 73 -11.913 -8.077 -12.777 557 HA HIS 73 HA HIS 73 -10.467 -10.443 -11.736 558 HB2 HIS 73 HB2 HIS 73 -12.445 -8.853 -10.079 559 HB3 HIS 73 HB3 HIS 73 -11.387 -10.163 -9.546 560 HD2 HIS 73 HD2 HIS 73 -11.611 -6.467 -9.661 561 HE1 HIS 73 HE1 HIS 73 -7.482 -7.238 -9.011 562 HE2 HIS 73 HE2 HIS 73 -9.289 -5.440 -9.000 563 H VAL 74 H VAL 74 -12.453 -9.821 -13.973 564 HA VAL 74 HA VAL 74 -15.078 -10.454 -13.331 565 HB VAL 74 HB VAL 74 -14.187 -9.571 -15.472 566 HG11 VAL 74 HG11 VAL 74 -13.515 -12.477 -16.081 567 HG12 VAL 74 HG12 VAL 74 -13.425 -11.115 -17.208 568 HG13 VAL 74 HG13 VAL 74 -12.331 -11.172 -15.808 569 HG21 VAL 74 HG21 VAL 74 -16.509 -10.419 -15.256 570 HG22 VAL 74 HG22 VAL 74 -15.852 -10.648 -16.898 571 HG23 VAL 74 HG23 VAL 74 -15.954 -12.027 -15.784 572 H ALA 75 H ALA 75 -12.352 -12.687 -13.576 573 HA ALA 75 HA ALA 75 -14.181 -15.018 -13.523 574 HB1 ALA 75 HB1 ALA 75 -12.086 -16.318 -13.662 575 HB2 ALA 75 HB2 ALA 75 -12.150 -15.078 -14.937 576 HB3 ALA 75 HB3 ALA 75 -11.136 -14.825 -13.494 577 H ILE 76 H ILE 76 -11.793 -13.360 -11.385 578 HA ILE 76 HA ILE 76 -11.953 -15.236 -9.235 579 HB ILE 76 HB ILE 76 -11.310 -12.262 -9.369 580 HG12 ILE 76 HG12 ILE 76 -9.551 -14.735 -9.075 581 HG13 ILE 76 HG13 ILE 76 -9.774 -13.799 -10.560 582 HG21 ILE 76 HG21 ILE 76 -10.325 -12.523 -7.105 583 HG22 ILE 76 HG22 ILE 76 -12.073 -12.792 -7.091 584 HG23 ILE 76 HG23 ILE 76 -10.957 -14.180 -7.032 585 HD11 ILE 76 HD11 ILE 76 -7.702 -13.114 -9.558 586 HD12 ILE 76 HD12 ILE 76 -8.859 -11.781 -9.405 587 HD13 ILE 76 HD13 ILE 76 -8.477 -12.807 -7.997 588 H ARG 77 H ARG 77 -14.019 -12.562 -10.280 589 HA ARG 77 HA ARG 77 -15.574 -12.178 -7.946 590 HB2 ARG 77 HB2 ARG 77 -15.484 -10.832 -10.109 591 HB3 ARG 77 HB3 ARG 77 -16.505 -12.087 -10.841 592 HG2 ARG 77 HG2 ARG 77 -18.205 -11.666 -9.008 593 HG3 ARG 77 HG3 ARG 77 -17.206 -10.296 -8.469 594 HD2 ARG 77 HD2 ARG 77 -18.389 -10.704 -11.233 595 HD3 ARG 77 HD3 ARG 77 -19.021 -9.605 -9.987 596 HE ARG 77 HE ARG 77 -16.535 -8.640 -10.231 597 HH11 ARG 77 HH11 ARG 77 -18.876 -9.548 -12.717 598 HH12 ARG 77 HH12 ARG 77 -18.244 -8.425 -13.893 599 HH21 ARG 77 HH21 ARG 77 -15.723 -7.198 -11.773 600 HH22 ARG 77 HH22 ARG 77 -16.464 -7.083 -13.355 601 H SER 78 H SER 78 -15.509 -14.821 -10.226 602 HA SER 78 HA SER 78 -18.038 -15.928 -9.104 603 HB2 SER 78 HB2 SER 78 -16.315 -16.757 -11.485 604 HB3 SER 78 HB3 SER 78 -17.826 -17.548 -10.974 605 HG SER 78 HG SER 78 -18.157 -15.973 -12.623 606 H LYS 79 H LYS 79 -14.577 -16.207 -8.663 607 HA LYS 79 HA LYS 79 -14.767 -19.024 -7.874 608 HB2 LYS 79 HB2 LYS 79 -12.501 -16.994 -7.654 609 HB3 LYS 79 HB3 LYS 79 -12.390 -18.700 -7.256 610 HG2 LYS 79 HG2 LYS 79 -12.825 -17.471 -9.985 611 HG3 LYS 79 HG3 LYS 79 -11.463 -18.440 -9.434 612 HD2 LYS 79 HD2 LYS 79 -14.295 -19.373 -10.022 613 HD3 LYS 79 HD3 LYS 79 -12.790 -19.816 -10.854 614 HE2 LYS 79 HE2 LYS 79 -11.988 -20.840 -8.674 615 HE3 LYS 79 HE3 LYS 79 -13.624 -20.557 -8.023 616 HZ1 LYS 79 HZ1 LYS 79 -14.498 -21.946 -9.789 617 HZ2 LYS 79 HZ2 LYS 79 -12.991 -22.194 -10.396 618 HZ3 LYS 79 HZ3 LYS 79 -13.381 -22.783 -8.916 619 H LEU 80 H LEU 80 -14.758 -15.789 -6.272 620 HA LEU 80 HA LEU 80 -14.609 -17.006 -3.626 621 HB2 LEU 80 HB2 LEU 80 -15.108 -14.243 -4.771 622 HB3 LEU 80 HB3 LEU 80 -15.336 -14.591 -3.044 623 HG LEU 80 HG LEU 80 -13.026 -15.199 -2.761 624 HD11 LEU 80 HD11 LEU 80 -12.729 -14.807 -5.760 625 HD12 LEU 80 HD12 LEU 80 -11.381 -14.936 -4.626 626 HD13 LEU 80 HD13 LEU 80 -12.475 -16.314 -4.841 627 HD21 LEU 80 HD21 LEU 80 -13.605 -12.828 -2.695 628 HD22 LEU 80 HD22 LEU 80 -11.978 -13.027 -3.379 629 HD23 LEU 80 HD23 LEU 80 -13.353 -12.686 -4.451 630 H GLN 81 H GLN 81 -16.881 -17.059 -6.027 631 HA GLN 81 HA GLN 81 -19.169 -17.113 -4.127 632 HB2 GLN 81 HB2 GLN 81 -18.773 -16.452 -6.995 633 HB3 GLN 81 HB3 GLN 81 -20.142 -17.522 -6.701 634 HG2 GLN 81 HG2 GLN 81 -19.706 -14.919 -5.204 635 HG3 GLN 81 HG3 GLN 81 -20.813 -15.116 -6.553 636 HE21 GLN 81 HE22 GLN 81 -20.527 -15.355 -3.178 637 HE22 GLN 81 HE21 GLN 81 -22.011 -16.236 -2.903 638 H TYR 82 H TYR 82 -17.416 -18.966 -6.670 639 HA TYR 82 HA TYR 82 -19.053 -21.270 -6.639 640 HB2 TYR 82 HB2 TYR 82 -17.377 -20.939 -8.367 641 HB3 TYR 82 HB3 TYR 82 -16.120 -20.693 -7.177 642 HD1 TYR 82 HD1 TYR 82 -18.516 -23.299 -8.422 643 HD2 TYR 82 HD2 TYR 82 -14.727 -22.481 -6.555 644 HE1 TYR 82 HE1 TYR 82 -17.943 -25.716 -8.534 645 HE2 TYR 82 HE2 TYR 82 -14.148 -24.894 -6.675 646 HH TYR 82 HH TYR 82 -16.378 -27.331 -8.067 647 H ARG 83 H ARG 83 -16.102 -20.562 -4.583 648 HA ARG 83 HA ARG 83 -16.494 -23.191 -3.378 649 HB2 ARG 83 HB2 ARG 83 -14.237 -22.072 -3.751 650 HB3 ARG 83 HB3 ARG 83 -14.639 -20.981 -2.414 651 HG2 ARG 83 HG2 ARG 83 -13.273 -22.850 -1.605 652 HG3 ARG 83 HG3 ARG 83 -14.899 -23.004 -0.926 653 HD2 ARG 83 HD2 ARG 83 -15.468 -24.639 -2.723 654 HD3 ARG 83 HD3 ARG 83 -13.827 -24.489 -3.362 655 HE ARG 83 HE ARG 83 -13.718 -25.205 -0.602 656 HH11 ARG 83 HH11 ARG 83 -14.602 -26.547 -3.747 657 HH12 ARG 83 HH12 ARG 83 -14.272 -28.193 -3.284 658 HH21 ARG 83 HH21 ARG 83 -13.296 -27.389 -0.003 659 HH22 ARG 83 HH22 ARG 83 -13.537 -28.664 -1.168 660 H LEU 84 H LEU 84 -17.410 -19.877 -2.664 661 HA LEU 84 HA LEU 84 -18.190 -20.275 0.067 662 HB2 LEU 84 HB2 LEU 84 -17.839 -18.144 -1.361 663 HB3 LEU 84 HB3 LEU 84 -19.488 -18.392 -1.944 664 HG LEU 84 HG LEU 84 -18.600 -17.954 0.916 665 HD11 LEU 84 HD11 LEU 84 -19.783 -15.777 0.647 666 HD12 LEU 84 HD12 LEU 84 -18.447 -15.954 -0.511 667 HD13 LEU 84 HD13 LEU 84 -20.125 -16.195 -1.042 668 HD21 LEU 84 HD21 LEU 84 -20.585 -19.287 1.058 669 HD22 LEU 84 HD22 LEU 84 -21.066 -17.615 1.356 670 HD23 LEU 84 HD23 LEU 84 -21.387 -18.344 -0.234 671 H GLU 85 H GLU 85 -19.724 -20.669 -3.087 672 HA GLU 85 HA GLU 85 -22.358 -21.329 -2.320 673 HB2 GLU 85 HB2 GLU 85 -20.642 -21.623 -4.751 674 HB3 GLU 85 HB3 GLU 85 -22.072 -22.617 -4.702 675 HG2 GLU 85 HG2 GLU 85 -23.472 -20.616 -4.206 676 HG3 GLU 85 HG3 GLU 85 -22.032 -19.596 -4.332 677 H LEU 86 H LEU 86 -19.504 -23.181 -1.769 678 HA LEU 86 HA LEU 86 -21.201 -25.604 -1.323 679 HB2 LEU 86 HB2 LEU 86 -18.354 -25.390 -2.376 680 HB3 LEU 86 HB3 LEU 86 -18.968 -26.844 -1.597 681 HG LEU 86 HG LEU 86 -19.115 -27.261 -3.881 682 HD11 LEU 86 HD11 LEU 86 -21.134 -27.899 -2.569 683 HD12 LEU 86 HD12 LEU 86 -21.928 -26.403 -3.109 684 HD13 LEU 86 HD13 LEU 86 -21.469 -27.631 -4.300 685 HD21 LEU 86 HD21 LEU 86 -20.575 -24.629 -4.302 686 HD22 LEU 86 HD22 LEU 86 -18.884 -24.988 -4.732 687 HD23 LEU 86 HD23 LEU 86 -20.205 -25.855 -5.534 688 H ALA 87 H ALA 87 -18.978 -23.257 -0.005 689 HA ALA 87 HA ALA 87 -18.041 -24.832 2.196 690 HB1 ALA 87 HB1 ALA 87 -17.470 -22.646 3.175 691 HB2 ALA 87 HB2 ALA 87 -17.009 -22.696 1.475 692 HB3 ALA 87 HB3 ALA 87 -18.483 -21.822 1.962 693 H GLN 88 H GLN 88 -21.050 -23.050 1.543 694 HA GLN 88 HA GLN 88 -22.033 -23.080 4.240 695 HB2 GLN 88 HB2 GLN 88 -23.378 -22.783 1.522 696 HB3 GLN 88 HB3 GLN 88 -24.188 -22.537 3.078 697 HG2 GLN 88 HG2 GLN 88 -22.573 -20.760 3.664 698 HG3 GLN 88 HG3 GLN 88 -21.756 -20.968 2.117 699 HE21 GLN 88 HE22 GLN 88 -23.073 -18.555 3.187 700 HE22 GLN 88 HE21 GLN 88 -24.320 -18.136 2.027 701 H GLY 89 H GLY 89 -21.224 -25.676 2.479 702 HA2 GLY 89 HA2 GLY 89 -23.361 -27.360 3.652 703 HA3 GLY 89 HA3 GLY 89 -22.958 -27.521 1.929 704 H ALA 90 H ALA 90 -20.310 -26.651 3.994 705 HA ALA 90 HA ALA 90 -19.517 -29.441 4.511 706 HB1 ALA 90 HB1 ALA 90 -17.843 -27.528 2.831 707 HB2 ALA 90 HB2 ALA 90 -17.360 -29.156 3.357 708 HB3 ALA 90 HB3 ALA 90 -18.705 -28.961 2.216 709 H VAL 91 H VAL 91 -19.673 -26.182 5.441 710 HA VAL 91 HA VAL 91 -17.214 -25.926 6.890 711 HB VAL 91 HB VAL 91 -18.660 -24.093 6.114 712 HG11 VAL 91 HG11 VAL 91 -20.506 -24.873 8.398 713 HG12 VAL 91 HG12 VAL 91 -20.655 -23.438 7.378 714 HG13 VAL 91 HG13 VAL 91 -20.872 -25.044 6.663 715 HG21 VAL 91 HG21 VAL 91 -18.282 -24.044 9.121 716 HG22 VAL 91 HG22 VAL 91 -16.996 -23.757 7.929 717 HG23 VAL 91 HG23 VAL 91 -18.377 -22.641 8.027 718 H GLY 92 H GLY 92 -20.172 -27.600 7.586 719 HA2 GLY 92 HA2 GLY 92 -19.076 -28.595 10.090 720 HA3 GLY 92 HA3 GLY 92 -20.441 -27.490 10.329 721 H SER 93 H SER 93 -20.588 -29.353 7.398 722 HA SER 93 HA SER 93 -22.980 -30.699 8.150 723 HB2 SER 93 HB2 SER 93 -21.001 -31.306 5.921 724 HB3 SER 93 HB3 SER 93 -22.676 -31.905 6.038 725 HG SER 93 HG SER 93 -22.466 -30.004 4.730 726 H VAL 94 H VAL 94 -23.195 -33.155 7.878 727 HA VAL 94 HA VAL 94 -21.018 -34.610 9.236 728 HB VAL 94 HB VAL 94 -23.866 -34.809 10.217 729 HG11 VAL 94 HG11 VAL 94 -22.717 -35.763 12.207 730 HG12 VAL 94 HG12 VAL 94 -22.310 -36.680 10.744 731 HG13 VAL 94 HG13 VAL 94 -21.146 -35.510 11.406 732 HG21 VAL 94 HG21 VAL 94 -23.146 -33.389 12.137 733 HG22 VAL 94 HG22 VAL 94 -21.618 -33.054 11.284 734 HG23 VAL 94 HG23 VAL 94 -23.160 -32.495 10.605 735 H GLN 95 H GLN 95 -21.587 -34.678 6.615 736 HA GLN 95 HA GLN 95 -23.419 -36.658 5.742 737 HB2 GLN 95 HB2 GLN 95 -22.107 -36.677 3.668 738 HB3 GLN 95 HB3 GLN 95 -22.410 -35.018 4.244 739 HG2 GLN 95 HG2 GLN 95 -19.824 -36.377 4.983 740 HG3 GLN 95 HG3 GLN 95 -20.025 -35.681 3.370 741 HE21 GLN 95 HE22 GLN 95 -19.192 -34.984 6.606 742 HE22 GLN 95 HE21 GLN 95 -19.337 -33.243 6.510 743 H ILE 96 H ILE 96 -20.649 -37.104 7.653 744 HA ILE 96 HA ILE 96 -20.785 -40.021 7.242 745 HB ILE 96 HB ILE 96 -18.293 -40.157 7.277 746 HG12 ILE 96 HG12 ILE 96 -18.415 -37.155 6.766 747 HG13 ILE 96 HG13 ILE 96 -17.842 -37.929 8.243 748 HG21 ILE 96 HG21 ILE 96 -19.346 -38.592 4.895 749 HG22 ILE 96 HG22 ILE 96 -17.981 -39.728 4.920 750 HG23 ILE 96 HG23 ILE 96 -19.628 -40.325 5.169 751 HD11 ILE 96 HD11 ILE 96 -15.934 -37.312 6.876 752 HD12 ILE 96 HD12 ILE 96 -16.062 -39.083 6.934 753 HD13 ILE 96 HD13 ILE 96 -16.580 -38.188 5.485 754 HA PRO 97 HA PRO 97 -20.504 -40.217 11.648 755 HB2 PRO 97 HB2 PRO 97 -18.191 -42.101 11.232 756 HB3 PRO 97 HB3 PRO 97 -19.626 -42.302 12.295 757 HG2 PRO 97 HG2 PRO 97 -19.499 -43.600 9.922 758 HG3 PRO 97 HG3 PRO 97 -21.027 -42.790 10.416 759 HD2 PRO 97 HD2 PRO 97 -18.893 -41.794 8.519 760 HD3 PRO 97 HD3 PRO 97 -20.672 -41.744 8.341 761 H VAL 98 H VAL 98 -19.154 -39.705 13.500 762 HA VAL 98 HA VAL 98 -16.547 -38.458 12.888 763 HB VAL 98 HB VAL 98 -17.191 -36.404 14.132 764 HG11 VAL 98 HG11 VAL 98 -18.983 -36.935 11.738 765 HG12 VAL 98 HG12 VAL 98 -18.451 -35.357 12.343 766 HG13 VAL 98 HG13 VAL 98 -17.269 -36.488 11.646 767 HG21 VAL 98 HG21 VAL 98 -19.577 -35.892 14.478 768 HG22 VAL 98 HG22 VAL 98 -20.022 -37.519 13.928 769 HG23 VAL 98 HG23 VAL 98 -19.087 -37.303 15.430 770 H VAL 99 H VAL 99 -17.781 -40.824 14.502 771 HA VAL 99 HA VAL 99 -16.212 -40.283 16.963 772 HB VAL 99 HB VAL 99 -17.959 -41.386 18.324 773 HG11 VAL 99 HG11 VAL 99 -19.032 -38.989 16.801 774 HG12 VAL 99 HG12 VAL 99 -19.513 -39.517 18.427 775 HG13 VAL 99 HG13 VAL 99 -17.863 -38.911 18.139 776 HG21 VAL 99 HG21 VAL 99 -19.682 -41.176 15.816 777 HG22 VAL 99 HG22 VAL 99 -19.072 -42.689 16.533 778 HG23 VAL 99 HG23 VAL 99 -20.227 -41.680 17.432 779 H GLU 100 H GLU 100 -16.390 -42.156 14.258 780 HA GLU 100 HA GLU 100 -16.296 -44.803 15.250 781 HB2 GLU 100 HB2 GLU 100 -15.457 -43.286 12.752 782 HB3 GLU 100 HB3 GLU 100 -15.256 -45.014 12.919 783 HG2 GLU 100 HG2 GLU 100 -17.900 -43.562 13.187 784 HG3 GLU 100 HG3 GLU 100 -17.358 -44.434 11.739 785 H VAL 101 H VAL 101 -14.337 -46.184 14.846 786 HA VAL 101 HA VAL 101 -11.757 -44.892 15.437 787 HB VAL 101 HB VAL 101 -13.017 -47.124 17.094 788 HG11 VAL 101 HG11 VAL 101 -10.971 -46.882 18.500 789 HG12 VAL 101 HG12 VAL 101 -10.624 -47.504 16.886 790 HG13 VAL 101 HG13 VAL 101 -10.282 -45.794 17.269 791 HG21 VAL 101 HG21 VAL 101 -13.913 -44.912 17.701 792 HG22 VAL 101 HG22 VAL 101 -12.824 -45.510 18.966 793 HG23 VAL 101 HG23 VAL 101 -12.256 -44.266 17.835 794 H ASP 102 H ASP 102 -9.944 -46.283 14.906 795 HA ASP 102 HA ASP 102 -10.541 -48.755 13.454 796 HB2 ASP 102 HB2 ASP 102 -10.805 -46.802 11.887 797 HB3 ASP 102 HB3 ASP 102 -9.092 -46.448 12.130 798 H GLU 103 H GLU 103 -9.230 -48.013 15.865 799 HA GLU 103 HA GLU 103 -6.382 -48.676 15.294 800 HB2 GLU 103 HB2 GLU 103 -7.573 -47.633 17.869 801 HB3 GLU 103 HB3 GLU 103 -5.864 -47.817 17.485 802 HG2 GLU 103 HG2 GLU 103 -7.802 -45.907 16.113 803 HG3 GLU 103 HG3 GLU 103 -6.525 -45.479 17.260 804 H LEU 104 H LEU 104 -5.503 -49.781 17.524 805 HA LEU 104 HA LEU 104 -6.483 -52.479 17.328 806 HB2 LEU 104 HB2 LEU 104 -4.626 -51.417 19.462 807 HB3 LEU 104 HB3 LEU 104 -4.677 -53.038 18.787 808 HG LEU 104 HG LEU 104 -3.781 -50.550 17.307 809 HD11 LEU 104 HD11 LEU 104 -2.192 -51.339 19.007 810 HD12 LEU 104 HD12 LEU 104 -2.256 -52.980 18.321 811 HD13 LEU 104 HD13 LEU 104 -1.572 -51.642 17.371 812 HD21 LEU 104 HD21 LEU 104 -4.870 -52.174 15.780 813 HD22 LEU 104 HD22 LEU 104 -3.117 -52.142 15.520 814 HD23 LEU 104 HD23 LEU 104 -3.851 -53.473 16.442 815 HA PRO 105 HA PRO 105 -9.394 -52.468 20.596 816 HB2 PRO 105 HB2 PRO 105 -9.381 -55.014 21.522 817 HB3 PRO 105 HB3 PRO 105 -9.770 -54.648 19.816 818 HG2 PRO 105 HG2 PRO 105 -7.127 -55.564 20.961 819 HG3 PRO 105 HG3 PRO 105 -7.982 -56.181 19.509 820 HD2 PRO 105 HD2 PRO 105 -5.964 -54.301 19.465 821 HD3 PRO 105 HD3 PRO 105 -7.224 -54.366 18.213 822 H GLU 106 H GLU 106 -6.338 -51.951 21.363 823 HA GLU 106 HA GLU 106 -5.072 -51.660 23.204 824 HB2 GLU 106 HB2 GLU 106 -7.097 -50.131 23.535 825 HB3 GLU 106 HB3 GLU 106 -7.668 -51.292 24.739 826 HG2 GLU 106 HG2 GLU 106 -5.550 -50.975 26.015 827 HG3 GLU 106 HG3 GLU 106 -4.968 -49.873 24.763 828 H GLY 107 H GLY 107 -5.975 -54.390 22.569 829 HA2 GLY 107 HA2 GLY 107 -5.055 -55.701 25.027 830 HA3 GLY 107 HA3 GLY 107 -6.696 -56.135 24.494 831 H TYR 108 H TYR 108 -4.318 -55.211 22.108 832 HA TYR 108 HA TYR 108 -4.581 -57.600 20.610 833 HB2 TYR 108 HB2 TYR 108 -2.795 -56.627 19.224 834 HB3 TYR 108 HB3 TYR 108 -4.128 -55.522 19.548 835 HD1 TYR 108 HD1 TYR 108 -3.861 -53.623 21.095 836 HD2 TYR 108 HD2 TYR 108 -0.577 -56.174 20.033 837 HE1 TYR 108 HE1 TYR 108 -2.274 -51.920 21.971 838 HE2 TYR 108 HE2 TYR 108 1.025 -54.491 20.929 839 HH TYR 108 HH TYR 108 -0.086 -51.367 22.330 840 H ASP 109 H ASP 109 -2.475 -58.719 19.775 841 HA ASP 109 HA ASP 109 -1.667 -60.302 22.036 842 HB2 ASP 109 HB2 ASP 109 -0.976 -60.492 19.098 843 HB3 ASP 109 HB3 ASP 109 -0.664 -61.759 20.300 844 H ARG 110 H ARG 110 -0.499 -57.516 21.743 845 HA ARG 110 HA ARG 110 2.273 -58.298 22.311 846 HB2 ARG 110 HB2 ARG 110 2.045 -57.970 19.821 847 HB3 ARG 110 HB3 ARG 110 1.770 -56.262 20.154 848 HG2 ARG 110 HG2 ARG 110 3.990 -56.099 21.214 849 HG3 ARG 110 HG3 ARG 110 4.222 -57.848 21.007 850 HD2 ARG 110 HD2 ARG 110 4.068 -57.565 18.553 851 HD3 ARG 110 HD3 ARG 110 3.842 -55.816 18.776 852 HE ARG 110 HE ARG 110 6.221 -56.566 20.112 853 HH11 ARG 110 HH11 ARG 110 4.959 -56.369 16.809 854 HH12 ARG 110 HH12 ARG 110 6.527 -56.083 16.103 855 HH21 ARG 110 HH21 ARG 110 8.255 -56.195 19.160 856 HH22 ARG 110 HH22 ARG 110 8.395 -55.994 17.426 857 H SER 111 H SER 111 -0.331 -56.773 23.375 858 HA SER 111 HA SER 111 0.398 -54.155 24.073 859 HB2 SER 111 HB2 SER 111 -1.217 -56.198 25.642 860 HB3 SER 111 HB3 SER 111 -1.193 -54.447 25.948 861 HG SER 111 HG SER 111 -2.948 -55.064 24.614 Start of MODEL 15 1 H1 SER 2 H1 SER 2 7.382 -0.761 -4.789 2 H2 SER 2 H2 SER 2 8.560 -1.219 -3.732 3 H3 SER 2 H3 SER 2 7.613 0.090 -3.402 4 HA SER 2 HA SER 2 6.930 -1.760 -2.064 5 HB2 SER 2 HB2 SER 2 4.553 -1.772 -2.705 6 HB3 SER 2 HB3 SER 2 5.231 -0.131 -2.758 7 HG SER 2 HG SER 2 3.984 -0.641 -4.615 8 H GLN 3 H GLN 3 5.481 -3.808 -2.218 9 HA GLN 3 HA GLN 3 5.994 -5.469 -4.584 10 HB2 GLN 3 HB2 GLN 3 8.046 -5.631 -3.148 11 HB3 GLN 3 HB3 GLN 3 7.032 -6.232 -1.820 12 HG2 GLN 3 HG2 GLN 3 6.406 -8.197 -3.199 13 HG3 GLN 3 HG3 GLN 3 7.347 -7.541 -4.554 14 HE21 GLN 3 HE22 GLN 3 9.304 -8.523 -4.780 15 HE22 GLN 3 HE21 GLN 3 10.278 -9.146 -3.467 16 H PHE 4 H PHE 4 4.629 -7.357 -4.611 17 HA PHE 4 HA PHE 4 2.763 -7.828 -2.389 18 HB2 PHE 4 HB2 PHE 4 1.773 -5.887 -3.539 19 HB3 PHE 4 HB3 PHE 4 1.886 -6.713 -5.077 20 HD1 PHE 4 HD2 PHE 4 0.483 -8.859 -5.427 21 HD2 PHE 4 HD1 PHE 4 -0.126 -6.109 -2.189 22 HE1 PHE 4 HE2 PHE 4 -1.790 -9.777 -5.087 23 HE2 PHE 4 HE1 PHE 4 -2.440 -6.966 -1.884 24 HZ PHE 4 HZ PHE 4 -3.277 -8.807 -3.335 25 H GLU 5 H GLU 5 3.475 -8.365 -5.892 26 HA GLU 5 HA GLU 5 1.957 -10.831 -5.914 27 HB2 GLU 5 HB2 GLU 5 3.888 -9.607 -7.929 28 HB3 GLU 5 HB3 GLU 5 2.855 -11.025 -8.229 29 HG2 GLU 5 HG2 GLU 5 0.842 -9.663 -7.717 30 HG3 GLU 5 HG3 GLU 5 1.871 -8.238 -7.501 31 H LYS 6 H LYS 6 5.478 -10.124 -5.527 32 HA LYS 6 HA LYS 6 6.283 -12.741 -6.316 33 HB2 LYS 6 HB2 LYS 6 7.635 -10.587 -4.663 34 HB3 LYS 6 HB3 LYS 6 8.414 -12.106 -5.116 35 HG2 LYS 6 HG2 LYS 6 7.373 -9.990 -7.038 36 HG3 LYS 6 HG3 LYS 6 9.069 -10.399 -6.683 37 HD2 LYS 6 HD2 LYS 6 8.691 -12.679 -7.595 38 HD3 LYS 6 HD3 LYS 6 7.032 -12.215 -8.030 39 HE2 LYS 6 HE2 LYS 6 7.871 -10.430 -9.478 40 HE3 LYS 6 HE3 LYS 6 9.549 -10.866 -9.071 41 HZ1 LYS 6 HZ1 LYS 6 7.598 -12.683 -10.337 42 HZ2 LYS 6 HZ2 LYS 6 8.774 -11.853 -11.145 43 HZ3 LYS 6 HZ3 LYS 6 9.182 -13.003 -10.045 44 H GLN 7 H GLN 7 5.397 -11.460 -3.073 45 HA GLN 7 HA GLN 7 6.293 -13.829 -1.742 46 HB2 GLN 7 HB2 GLN 7 5.305 -11.340 -1.028 47 HB3 GLN 7 HB3 GLN 7 3.979 -12.412 -0.567 48 HG2 GLN 7 HG2 GLN 7 6.896 -12.624 0.257 49 HG3 GLN 7 HG3 GLN 7 5.545 -12.127 1.291 50 HE21 GLN 7 HE22 GLN 7 3.617 -13.893 1.173 51 HE22 GLN 7 HE21 GLN 7 4.155 -15.535 1.398 52 H LYS 8 H LYS 8 3.503 -13.057 -3.665 53 HA LYS 8 HA LYS 8 1.790 -15.187 -2.572 54 HB2 LYS 8 HB2 LYS 8 1.022 -12.887 -3.047 55 HB3 LYS 8 HB3 LYS 8 1.463 -13.091 -4.717 56 HG2 LYS 8 HG2 LYS 8 -0.238 -15.156 -4.600 57 HG3 LYS 8 HG3 LYS 8 -0.856 -14.277 -3.211 58 HD2 LYS 8 HD2 LYS 8 -2.077 -13.581 -5.176 59 HD3 LYS 8 HD3 LYS 8 -1.021 -12.224 -4.740 60 HE2 LYS 8 HE2 LYS 8 0.612 -12.810 -6.410 61 HE3 LYS 8 HE3 LYS 8 -0.169 -14.360 -6.721 62 HZ1 LYS 8 HZ1 LYS 8 -2.047 -13.163 -7.616 63 HZ2 LYS 8 HZ2 LYS 8 -1.339 -11.704 -7.299 64 HZ3 LYS 8 HZ3 LYS 8 -0.672 -12.724 -8.407 65 H GLU 9 H GLU 9 3.979 -14.685 -5.292 66 HA GLU 9 HA GLU 9 2.917 -17.166 -6.554 67 HB2 GLU 9 HB2 GLU 9 3.845 -16.462 -8.622 68 HB3 GLU 9 HB3 GLU 9 2.918 -15.113 -7.945 69 HG2 GLU 9 HG2 GLU 9 5.045 -14.097 -7.136 70 HG3 GLU 9 HG3 GLU 9 5.954 -15.435 -7.831 71 H GLN 10 H GLN 10 4.898 -16.657 -4.210 72 HA GLN 10 HA GLN 10 6.909 -18.632 -5.183 73 HB2 GLN 10 HB2 GLN 10 7.172 -16.408 -3.135 74 HB3 GLN 10 HB3 GLN 10 8.349 -17.718 -3.306 75 HG2 GLN 10 HG2 GLN 10 8.762 -17.097 -5.660 76 HG3 GLN 10 HG3 GLN 10 7.587 -15.794 -5.554 77 HE21 GLN 10 HE22 GLN 10 9.989 -15.009 -6.373 78 HE22 GLN 10 HE21 GLN 10 10.872 -14.197 -5.100 79 H GLY 11 H GLY 11 4.093 -18.429 -3.674 80 HA2 GLY 11 HA2 GLY 11 4.683 -20.755 -1.909 81 HA3 GLY 11 HA3 GLY 11 3.527 -19.509 -1.438 82 H ASN 12 H ASN 12 3.287 -19.661 -4.734 83 HA ASN 12 HA ASN 12 0.769 -20.990 -4.798 84 HB2 ASN 12 HB2 ASN 12 0.969 -20.724 -7.199 85 HB3 ASN 12 HB3 ASN 12 1.568 -19.279 -6.401 86 HD21 ASN 12 HD22 ASN 12 2.124 -20.551 -9.109 87 HD22 ASN 12 HD21 ASN 12 3.873 -20.645 -9.186 88 H SER 13 H SER 13 4.083 -22.132 -5.045 89 HA SER 13 HA SER 13 3.182 -24.735 -6.062 90 HB2 SER 13 HB2 SER 13 5.623 -25.277 -6.008 91 HB3 SER 13 HB3 SER 13 5.282 -23.786 -6.921 92 HG SER 13 HG SER 13 7.032 -23.551 -5.442 93 H LEU 14 H LEU 14 4.217 -23.169 -3.034 94 HA LEU 14 HA LEU 14 4.562 -25.495 -1.450 95 HB2 LEU 14 HB2 LEU 14 3.577 -22.686 -0.782 96 HB3 LEU 14 HB3 LEU 14 4.087 -23.872 0.392 97 HG LEU 14 HG LEU 14 5.844 -22.633 -1.749 98 HD11 LEU 14 HD11 LEU 14 5.849 -22.419 1.288 99 HD12 LEU 14 HD12 LEU 14 7.000 -21.640 0.189 100 HD13 LEU 14 HD13 LEU 14 5.285 -21.159 0.165 101 HD21 LEU 14 HD21 LEU 14 6.566 -24.932 -1.354 102 HD22 LEU 14 HD22 LEU 14 7.693 -23.819 -0.566 103 HD23 LEU 14 HD23 LEU 14 6.492 -24.680 0.411 104 H PHE 15 H PHE 15 1.695 -23.643 -2.472 105 HA PHE 15 HA PHE 15 -0.229 -24.949 -0.816 106 HB2 PHE 15 HB2 PHE 15 -0.733 -22.879 -1.959 107 HB3 PHE 15 HB3 PHE 15 -0.302 -23.576 -3.518 108 HD1 PHE 15 HD1 PHE 15 -2.614 -24.565 -0.705 109 HD2 PHE 15 HD2 PHE 15 -2.063 -23.924 -4.912 110 HE1 PHE 15 HE1 PHE 15 -4.995 -25.180 -1.102 111 HE2 PHE 15 HE2 PHE 15 -4.464 -24.484 -5.309 112 HZ PHE 15 HZ PHE 15 -5.905 -25.125 -3.406 113 H LYS 16 H LYS 16 1.545 -26.000 -3.622 114 HA LYS 16 HA LYS 16 -0.371 -28.219 -4.088 115 HB2 LYS 16 HB2 LYS 16 1.901 -27.112 -5.778 116 HB3 LYS 16 HB3 LYS 16 0.824 -28.450 -6.250 117 HG2 LYS 16 HG2 LYS 16 -1.130 -26.991 -6.150 118 HG3 LYS 16 HG3 LYS 16 -0.163 -25.667 -5.478 119 HD2 LYS 16 HD2 LYS 16 1.164 -25.539 -7.548 120 HD3 LYS 16 HD3 LYS 16 0.172 -26.849 -8.257 121 HE2 LYS 16 HE2 LYS 16 -1.864 -25.464 -7.897 122 HE3 LYS 16 HE3 LYS 16 -0.865 -24.183 -7.196 123 HZ1 LYS 16 HZ1 LYS 16 -1.356 -23.757 -9.501 124 HZ2 LYS 16 HZ2 LYS 16 0.263 -23.980 -9.307 125 HZ3 LYS 16 HZ3 LYS 16 -0.660 -25.176 -9.962 126 H GLN 17 H GLN 17 2.463 -27.613 -2.350 127 HA GLN 17 HA GLN 17 3.684 -30.244 -2.737 128 HB2 GLN 17 HB2 GLN 17 4.117 -28.093 -0.640 129 HB3 GLN 17 HB3 GLN 17 5.011 -29.626 -0.755 130 HG2 GLN 17 HG2 GLN 17 5.467 -28.913 -3.234 131 HG3 GLN 17 HG3 GLN 17 5.050 -27.293 -2.659 132 HE21 GLN 17 HE22 GLN 17 6.063 -27.171 -0.134 133 HE22 GLN 17 HE21 GLN 17 7.793 -27.397 -0.160 134 H GLY 18 H GLY 18 0.952 -29.068 -0.924 135 HA2 GLY 18 HA2 GLY 18 -0.564 -30.516 0.137 136 HA3 GLY 18 HA3 GLY 18 0.696 -31.741 0.313 137 H LEU 19 H LEU 19 1.338 -28.400 1.217 138 HA LEU 19 HA LEU 19 0.962 -29.032 4.086 139 HB2 LEU 19 HB2 LEU 19 3.144 -27.816 4.510 140 HB3 LEU 19 HB3 LEU 19 3.213 -29.460 3.857 141 HG LEU 19 HG LEU 19 3.654 -28.580 1.596 142 HD11 LEU 19 HD11 LEU 19 3.785 -25.882 3.009 143 HD12 LEU 19 HD12 LEU 19 4.295 -26.199 1.324 144 HD13 LEU 19 HD13 LEU 19 2.588 -26.366 1.785 145 HD21 LEU 19 HD21 LEU 19 5.482 -29.181 3.134 146 HD22 LEU 19 HD22 LEU 19 5.956 -27.831 2.078 147 HD23 LEU 19 HD23 LEU 19 5.505 -27.524 3.770 148 H TYR 20 H TYR 20 -0.954 -27.898 2.853 149 HA TYR 20 HA TYR 20 -1.038 -25.375 1.893 150 HB2 TYR 20 HB2 TYR 20 -3.104 -26.544 3.761 151 HB3 TYR 20 HB3 TYR 20 -3.403 -25.428 2.437 152 HD1 TYR 20 HD1 TYR 20 -2.017 -26.578 0.152 153 HD2 TYR 20 HD2 TYR 20 -4.107 -28.571 3.337 154 HE1 TYR 20 HE1 TYR 20 -2.475 -28.493 -1.336 155 HE2 TYR 20 HE2 TYR 20 -4.566 -30.492 1.848 156 HH TYR 20 HH TYR 20 -3.403 -30.581 -1.543 157 H ARG 21 H ARG 21 -0.812 -26.174 5.357 158 HA ARG 21 HA ARG 21 -1.803 -23.705 6.390 159 HB2 ARG 21 HB2 ARG 21 -1.578 -25.838 7.602 160 HB3 ARG 21 HB3 ARG 21 0.179 -25.721 7.530 161 HG2 ARG 21 HG2 ARG 21 -1.376 -23.450 8.767 162 HG3 ARG 21 HG3 ARG 21 -1.160 -24.964 9.684 163 HD2 ARG 21 HD2 ARG 21 1.261 -24.832 9.416 164 HD3 ARG 21 HD3 ARG 21 1.114 -23.355 8.458 165 HE ARG 21 HE ARG 21 -0.153 -23.095 11.044 166 HH11 ARG 21 HH11 ARG 21 2.971 -22.997 9.369 167 HH12 ARG 21 HH12 ARG 21 3.695 -21.948 10.566 168 HH21 ARG 21 HH21 ARG 21 0.840 -21.735 12.582 169 HH22 ARG 21 HH22 ARG 21 2.497 -21.236 12.370 170 H GLU 22 H GLU 22 1.314 -24.441 4.943 171 HA GLU 22 HA GLU 22 2.422 -21.920 5.963 172 HB2 GLU 22 HB2 GLU 22 3.356 -23.676 3.647 173 HB3 GLU 22 HB3 GLU 22 4.339 -22.500 4.529 174 HG2 GLU 22 HG2 GLU 22 3.135 -25.037 5.738 175 HG3 GLU 22 HG3 GLU 22 4.746 -24.886 5.066 176 H ALA 23 H ALA 23 1.057 -23.302 3.006 177 HA ALA 23 HA ALA 23 1.389 -21.058 1.308 178 HB1 ALA 23 HB1 ALA 23 -0.742 -23.214 1.285 179 HB2 ALA 23 HB2 ALA 23 -0.240 -22.183 -0.082 180 HB3 ALA 23 HB3 ALA 23 0.909 -23.366 0.614 181 H VAL 24 H VAL 24 -0.613 -21.439 4.086 182 HA VAL 24 HA VAL 24 -2.814 -19.720 3.348 183 HB VAL 24 HB VAL 24 -1.455 -20.596 5.956 184 HG11 VAL 24 HG11 VAL 24 -4.014 -18.917 5.623 185 HG12 VAL 24 HG12 VAL 24 -3.475 -19.662 7.143 186 HG13 VAL 24 HG13 VAL 24 -2.497 -18.393 6.398 187 HG21 VAL 24 HG21 VAL 24 -3.577 -21.863 6.279 188 HG22 VAL 24 HG22 VAL 24 -4.221 -21.227 4.748 189 HG23 VAL 24 HG23 VAL 24 -2.824 -22.315 4.737 190 H HIS 25 H HIS 25 0.124 -19.299 5.314 191 HA HIS 25 HA HIS 25 -0.282 -16.445 5.552 192 HB2 HIS 25 HB2 HIS 25 1.650 -16.520 6.943 193 HB3 HIS 25 HB3 HIS 25 0.727 -18.050 7.151 194 HD2 HIS 25 HD2 HIS 25 3.891 -17.039 5.073 195 HE1 HIS 25 HE1 HIS 25 4.151 -21.068 6.426 196 HE2 HIS 25 HE2 HIS 25 5.388 -19.196 5.147 197 H CYS 26 H CYS 26 1.035 -18.418 3.138 198 HA CYS 26 HA CYS 26 2.858 -16.497 1.966 199 HB2 CYS 26 HB2 CYS 26 1.461 -18.964 0.872 200 HB3 CYS 26 HB3 CYS 26 2.519 -17.935 -0.092 201 HG CYS 26 HG CYS 26 3.803 -20.096 0.741 202 H TYR 27 H TYR 27 -0.544 -16.534 2.171 203 HA TYR 27 HA TYR 27 -0.671 -14.536 -0.066 204 HB2 TYR 27 HB2 TYR 27 -2.925 -16.270 0.916 205 HB3 TYR 27 HB3 TYR 27 -2.931 -15.248 -0.518 206 HD1 TYR 27 HD2 TYR 27 -0.436 -16.026 -1.895 207 HD2 TYR 27 HD1 TYR 27 -3.263 -18.413 0.290 208 HE1 TYR 27 HE2 TYR 27 0.227 -18.015 -3.225 209 HE2 TYR 27 HE1 TYR 27 -2.599 -20.416 -1.030 210 HH TYR 27 HH TYR 27 -1.299 -21.221 -2.726 211 H ASP 28 H ASP 28 -0.924 -15.018 3.295 212 HA ASP 28 HA ASP 28 -3.154 -13.301 3.883 213 HB2 ASP 28 HB2 ASP 28 -2.138 -15.103 5.319 214 HB3 ASP 28 HB3 ASP 28 -0.746 -14.054 5.595 215 H GLN 29 H GLN 29 0.236 -12.717 3.125 216 HA GLN 29 HA GLN 29 0.445 -10.225 4.520 217 HB2 GLN 29 HB2 GLN 29 2.509 -9.954 3.464 218 HB3 GLN 29 HB3 GLN 29 2.365 -11.688 3.777 219 HG2 GLN 29 HG2 GLN 29 1.690 -10.329 1.156 220 HG3 GLN 29 HG3 GLN 29 3.266 -11.049 1.487 221 HE21 GLN 29 HE22 GLN 29 1.596 -11.755 -0.682 222 HE22 GLN 29 HE21 GLN 29 1.122 -13.426 -0.512 223 H LEU 30 H LEU 30 -1.342 -11.081 1.761 224 HA LEU 30 HA LEU 30 -1.118 -8.498 0.390 225 HB2 LEU 30 HB2 LEU 30 -3.060 -10.817 0.043 226 HB3 LEU 30 HB3 LEU 30 -2.737 -9.517 -1.127 227 HG LEU 30 HG LEU 30 -0.842 -11.703 -0.186 228 HD11 LEU 30 HD11 LEU 30 -2.164 -11.071 -2.840 229 HD12 LEU 30 HD12 LEU 30 -0.897 -12.280 -2.590 230 HD13 LEU 30 HD13 LEU 30 -2.457 -12.480 -1.789 231 HD21 LEU 30 HD21 LEU 30 0.464 -9.646 -0.510 232 HD22 LEU 30 HD22 LEU 30 0.754 -10.765 -1.850 233 HD23 LEU 30 HD23 LEU 30 -0.313 -9.387 -2.074 234 H ILE 31 H ILE 31 -3.321 -10.172 2.584 235 HA ILE 31 HA ILE 31 -5.441 -8.242 2.329 236 HB ILE 31 HB ILE 31 -4.778 -10.393 4.380 237 HG12 ILE 31 HG12 ILE 31 -6.907 -10.628 2.241 238 HG13 ILE 31 HG13 ILE 31 -5.243 -10.910 1.810 239 HG21 ILE 31 HG21 ILE 31 -6.372 -8.865 5.393 240 HG22 ILE 31 HG22 ILE 31 -7.381 -8.879 3.937 241 HG23 ILE 31 HG23 ILE 31 -7.220 -10.348 4.929 242 HD11 ILE 31 HD11 ILE 31 -6.248 -13.003 2.397 243 HD12 ILE 31 HD12 ILE 31 -5.007 -12.546 3.596 244 HD13 ILE 31 HD13 ILE 31 -6.733 -12.361 3.991 245 H THR 32 H THR 32 -2.422 -8.312 3.853 246 HA THR 32 HA THR 32 -3.179 -6.108 5.727 247 HB THR 32 HB THR 32 -0.688 -7.852 5.714 248 HG1 THR 32 HG1 THR 32 -2.560 -9.014 6.216 249 HG21 THR 32 HG21 THR 32 -0.443 -6.973 8.037 250 HG22 THR 32 HG22 THR 32 -0.298 -5.705 6.814 251 HG23 THR 32 HG23 THR 32 -1.806 -5.868 7.749 252 H ALA 33 H ALA 33 -1.181 -6.857 2.862 253 HA ALA 33 HA ALA 33 0.358 -4.386 3.119 254 HB1 ALA 33 HB1 ALA 33 1.201 -5.023 0.887 255 HB2 ALA 33 HB2 ALA 33 1.325 -6.373 2.039 256 HB3 ALA 33 HB3 ALA 33 0.027 -6.347 0.815 257 H GLN 34 H GLN 34 -2.541 -5.493 1.402 258 HA GLN 34 HA GLN 34 -3.614 -2.924 0.991 259 HB2 GLN 34 HB2 GLN 34 -3.377 -2.805 -1.529 260 HB3 GLN 34 HB3 GLN 34 -1.977 -2.354 -0.563 261 HG2 GLN 34 HG2 GLN 34 -1.317 -4.912 -0.945 262 HG3 GLN 34 HG3 GLN 34 -2.391 -4.730 -2.344 263 HE21 GLN 34 HE22 GLN 34 0.430 -3.300 -0.654 264 HE22 GLN 34 HE21 GLN 34 1.197 -2.661 -2.084 265 HA PRO 35 HA PRO 35 -6.248 -6.663 0.726 266 HB2 PRO 35 HB2 PRO 35 -8.348 -5.602 2.188 267 HB3 PRO 35 HB3 PRO 35 -6.910 -6.390 2.902 268 HG2 PRO 35 HG2 PRO 35 -7.439 -3.441 2.501 269 HG3 PRO 35 HG3 PRO 35 -6.801 -4.274 3.964 270 HD2 PRO 35 HD2 PRO 35 -5.171 -3.027 2.188 271 HD3 PRO 35 HD3 PRO 35 -4.668 -4.557 2.966 272 H GLN 36 H GLN 36 -6.413 -3.580 -0.632 273 HA GLN 36 HA GLN 36 -9.059 -3.567 -1.679 274 HB2 GLN 36 HB2 GLN 36 -8.240 -1.764 -3.107 275 HB3 GLN 36 HB3 GLN 36 -7.666 -1.561 -1.444 276 HG2 GLN 36 HG2 GLN 36 -5.492 -2.612 -2.089 277 HG3 GLN 36 HG3 GLN 36 -6.070 -2.735 -3.758 278 HE21 GLN 36 HE22 GLN 36 -3.740 -1.414 -3.376 279 HE22 GLN 36 HE21 GLN 36 -3.962 0.316 -3.540 280 H ASN 37 H ASN 37 -7.272 -6.082 -2.175 281 HA ASN 37 HA ASN 37 -7.850 -6.287 -5.081 282 HB2 ASN 37 HB2 ASN 37 -5.289 -6.990 -3.609 283 HB3 ASN 37 HB3 ASN 37 -5.657 -7.549 -5.248 284 HD21 ASN 37 HD22 ASN 37 -4.078 -5.190 -3.508 285 HD22 ASN 37 HD21 ASN 37 -3.999 -3.944 -4.732 286 HA PRO 38 HA PRO 38 -9.932 -9.877 -3.408 287 HB2 PRO 38 HB2 PRO 38 -10.841 -10.957 -5.703 288 HB3 PRO 38 HB3 PRO 38 -11.400 -9.350 -5.144 289 HG2 PRO 38 HG2 PRO 38 -9.171 -9.890 -7.130 290 HG3 PRO 38 HG3 PRO 38 -10.641 -8.870 -7.362 291 HD2 PRO 38 HD2 PRO 38 -8.368 -7.689 -6.525 292 HD3 PRO 38 HD3 PRO 38 -9.895 -7.290 -5.794 293 H VAL 39 H VAL 39 -7.110 -10.071 -5.539 294 HA VAL 39 HA VAL 39 -7.081 -12.919 -5.817 295 HB VAL 39 HB VAL 39 -5.864 -11.249 -7.227 296 HG11 VAL 39 HG11 VAL 39 -3.686 -10.426 -6.516 297 HG12 VAL 39 HG12 VAL 39 -4.932 -9.853 -5.389 298 HG13 VAL 39 HG13 VAL 39 -3.868 -11.210 -4.927 299 HG21 VAL 39 HG21 VAL 39 -3.941 -12.675 -7.623 300 HG22 VAL 39 HG22 VAL 39 -4.125 -13.432 -6.028 301 HG23 VAL 39 HG23 VAL 39 -5.373 -13.672 -7.278 302 H GLY 40 H GLY 40 -5.963 -10.716 -3.315 303 HA2 GLY 40 HA2 GLY 40 -4.482 -12.531 -1.690 304 HA3 GLY 40 HA3 GLY 40 -5.311 -11.053 -1.154 305 H TYR 41 H TYR 41 -7.841 -12.384 -2.436 306 HA TYR 41 HA TYR 41 -8.466 -14.276 -0.231 307 HB2 TYR 41 HB2 TYR 41 -10.591 -12.712 -1.669 308 HB3 TYR 41 HB3 TYR 41 -10.672 -13.472 -0.161 309 HD1 TYR 41 HD1 TYR 41 -9.065 -10.531 -1.783 310 HD2 TYR 41 HD2 TYR 41 -10.288 -12.407 1.874 311 HE1 TYR 41 HE1 TYR 41 -8.700 -8.395 -0.582 312 HE2 TYR 41 HE2 TYR 41 -9.887 -10.277 3.105 313 HH TYR 41 HH TYR 41 -8.814 -7.307 1.419 314 H SER 42 H SER 42 -7.321 -14.729 -3.008 315 HA SER 42 HA SER 42 -9.478 -16.559 -3.959 316 HB2 SER 42 HB2 SER 42 -9.225 -14.528 -5.414 317 HB3 SER 42 HB3 SER 42 -7.546 -15.029 -5.728 318 HG SER 42 HG SER 42 -8.938 -15.811 -7.337 319 H ASN 43 H ASN 43 -6.597 -16.406 -2.450 320 HA ASN 43 HA ASN 43 -5.821 -19.081 -3.487 321 HB2 ASN 43 HB2 ASN 43 -3.989 -16.740 -2.806 322 HB3 ASN 43 HB3 ASN 43 -3.455 -18.388 -3.127 323 HD21 ASN 43 HD22 ASN 43 -4.599 -15.397 -4.558 324 HD22 ASN 43 HD21 ASN 43 -4.396 -15.899 -6.221 325 H LYS 44 H LYS 44 -5.712 -16.680 -0.750 326 HA LYS 44 HA LYS 44 -5.153 -18.719 1.240 327 HB2 LYS 44 HB2 LYS 44 -4.829 -16.274 1.566 328 HB3 LYS 44 HB3 LYS 44 -6.530 -15.999 1.372 329 HG2 LYS 44 HG2 LYS 44 -6.990 -17.400 3.386 330 HG3 LYS 44 HG3 LYS 44 -5.246 -17.688 3.576 331 HD2 LYS 44 HD2 LYS 44 -4.874 -15.271 3.903 332 HD3 LYS 44 HD3 LYS 44 -6.605 -14.966 3.621 333 HE2 LYS 44 HE2 LYS 44 -7.165 -16.400 5.575 334 HE3 LYS 44 HE3 LYS 44 -5.436 -16.628 5.890 335 HZ1 LYS 44 HZ1 LYS 44 -6.360 -14.888 7.245 336 HZ2 LYS 44 HZ2 LYS 44 -5.258 -14.247 6.208 337 HZ3 LYS 44 HZ3 LYS 44 -6.865 -14.057 5.918 338 H ALA 45 H ALA 45 -8.026 -17.147 -0.084 339 HA ALA 45 HA ALA 45 -10.002 -18.628 1.364 340 HB1 ALA 45 HB1 ALA 45 -10.345 -16.426 0.139 341 HB2 ALA 45 HB2 ALA 45 -10.240 -17.344 -1.379 342 HB3 ALA 45 HB3 ALA 45 -11.555 -17.678 -0.245 343 H MET 46 H MET 46 -7.751 -19.896 -0.692 344 HA MET 46 HA MET 46 -9.547 -22.111 -1.546 345 HB2 MET 46 HB2 MET 46 -8.754 -20.303 -3.352 346 HB3 MET 46 HB3 MET 46 -7.240 -21.206 -3.276 347 HG2 MET 46 HG2 MET 46 -8.664 -22.041 -5.085 348 HG3 MET 46 HG3 MET 46 -8.457 -23.285 -3.849 349 HE1 MET 46 HE1 MET 46 -10.870 -20.099 -3.808 350 HE2 MET 46 HE2 MET 46 -10.804 -20.645 -5.503 351 HE3 MET 46 HE3 MET 46 -12.311 -20.802 -4.571 352 H ALA 47 H ALA 47 -7.167 -21.242 0.466 353 HA ALA 47 HA ALA 47 -5.925 -23.943 0.320 354 HB1 ALA 47 HB1 ALA 47 -4.641 -21.353 1.252 355 HB2 ALA 47 HB2 ALA 47 -3.888 -22.964 1.266 356 HB3 ALA 47 HB3 ALA 47 -4.301 -22.192 -0.281 357 H LEU 48 H LEU 48 -7.584 -21.500 2.251 358 HA LEU 48 HA LEU 48 -7.253 -22.867 4.787 359 HB2 LEU 48 HB2 LEU 48 -9.255 -20.885 3.630 360 HB3 LEU 48 HB3 LEU 48 -9.436 -21.553 5.264 361 HG LEU 48 HG LEU 48 -6.925 -20.105 4.322 362 HD11 LEU 48 HD11 LEU 48 -8.848 -18.587 4.279 363 HD12 LEU 48 HD12 LEU 48 -9.323 -19.111 5.908 364 HD13 LEU 48 HD13 LEU 48 -7.807 -18.215 5.671 365 HD21 LEU 48 HD21 LEU 48 -6.533 -19.940 6.796 366 HD22 LEU 48 HD22 LEU 48 -7.977 -20.955 7.061 367 HD23 LEU 48 HD23 LEU 48 -6.560 -21.619 6.233 368 H ILE 49 H ILE 49 -9.522 -23.083 2.028 369 HA ILE 49 HA ILE 49 -11.352 -24.893 3.211 370 HB ILE 49 HB ILE 49 -11.843 -25.574 0.871 371 HG12 ILE 49 HG12 ILE 49 -9.833 -23.479 0.080 372 HG13 ILE 49 HG13 ILE 49 -9.330 -25.142 0.210 373 HG21 ILE 49 HG21 ILE 49 -12.695 -23.380 0.153 374 HG22 ILE 49 HG22 ILE 49 -12.922 -23.589 1.907 375 HG23 ILE 49 HG23 ILE 49 -11.604 -22.563 1.294 376 HD11 ILE 49 HD11 ILE 49 -11.573 -24.281 -1.586 377 HD12 ILE 49 HD12 ILE 49 -9.911 -24.710 -2.085 378 HD13 ILE 49 HD13 ILE 49 -10.947 -25.939 -1.327 379 H LYS 50 H LYS 50 -8.117 -25.214 1.980 380 HA LYS 50 HA LYS 50 -8.343 -27.960 1.206 381 HB2 LYS 50 HB2 LYS 50 -6.664 -25.843 0.622 382 HB3 LYS 50 HB3 LYS 50 -5.639 -26.837 1.656 383 HG2 LYS 50 HG2 LYS 50 -5.185 -27.672 -0.450 384 HG3 LYS 50 HG3 LYS 50 -6.452 -28.800 0.051 385 HD2 LYS 50 HD2 LYS 50 -6.795 -26.295 -1.654 386 HD3 LYS 50 HD3 LYS 50 -6.707 -27.937 -2.296 387 HE2 LYS 50 HE2 LYS 50 -8.811 -26.988 -0.333 388 HE3 LYS 50 HE3 LYS 50 -9.020 -26.947 -2.091 389 HZ1 LYS 50 HZ1 LYS 50 -9.956 -28.951 -1.136 390 HZ2 LYS 50 HZ2 LYS 50 -8.716 -29.329 -2.145 391 HZ3 LYS 50 HZ3 LYS 50 -8.505 -29.389 -0.515 392 H LEU 51 H LEU 51 -8.143 -26.450 4.180 393 HA LEU 51 HA LEU 51 -6.691 -28.685 5.518 394 HB2 LEU 51 HB2 LEU 51 -6.970 -25.730 6.190 395 HB3 LEU 51 HB3 LEU 51 -6.315 -26.919 7.323 396 HG LEU 51 HG LEU 51 -5.145 -26.434 4.569 397 HD11 LEU 51 HD11 LEU 51 -3.436 -25.110 5.727 398 HD12 LEU 51 HD12 LEU 51 -5.035 -24.391 5.957 399 HD13 LEU 51 HD13 LEU 51 -4.284 -25.327 7.268 400 HD21 LEU 51 HD21 LEU 51 -3.162 -27.561 5.629 401 HD22 LEU 51 HD22 LEU 51 -4.119 -27.822 7.093 402 HD23 LEU 51 HD23 LEU 51 -4.580 -28.629 5.576 403 H GLY 52 H GLY 52 -9.732 -27.367 4.915 404 HA2 GLY 52 HA2 GLY 52 -11.727 -28.222 5.797 405 HA3 GLY 52 HA3 GLY 52 -10.876 -28.751 7.257 406 H GLU 53 H GLU 53 -9.802 -25.620 6.683 407 HA GLU 53 HA GLU 53 -11.530 -24.607 8.804 408 HB2 GLU 53 HB2 GLU 53 -9.370 -23.001 7.400 409 HB3 GLU 53 HB3 GLU 53 -10.059 -22.793 8.989 410 HG2 GLU 53 HG2 GLU 53 -9.129 -24.993 9.702 411 HG3 GLU 53 HG3 GLU 53 -8.335 -25.143 8.125 412 H TYR 54 H TYR 54 -13.156 -25.140 6.683 413 HA TYR 54 HA TYR 54 -13.561 -23.109 4.787 414 HB2 TYR 54 HB2 TYR 54 -15.548 -24.883 6.257 415 HB3 TYR 54 HB3 TYR 54 -15.958 -23.873 4.867 416 HD1 TYR 54 HD2 TYR 54 -15.062 -24.352 2.630 417 HD2 TYR 54 HD1 TYR 54 -14.347 -26.976 5.959 418 HE1 TYR 54 HE2 TYR 54 -14.382 -26.151 1.063 419 HE2 TYR 54 HE1 TYR 54 -13.684 -28.782 4.402 420 HH TYR 54 HH TYR 54 -13.349 -29.397 2.221 421 H THR 55 H THR 55 -14.280 -23.199 8.247 422 HA THR 55 HA THR 55 -16.100 -21.061 8.454 423 HB THR 55 HB THR 55 -13.814 -21.876 10.310 424 HG1 THR 55 HG1 THR 55 -15.405 -23.201 11.234 425 HG21 THR 55 HG21 THR 55 -15.345 -21.004 12.100 426 HG22 THR 55 HG22 THR 55 -14.800 -19.737 10.988 427 HG23 THR 55 HG23 THR 55 -16.440 -20.395 10.828 428 H GLN 56 H GLN 56 -12.676 -21.075 7.713 429 HA GLN 56 HA GLN 56 -12.439 -18.162 8.217 430 HB2 GLN 56 HB2 GLN 56 -10.356 -20.289 7.557 431 HB3 GLN 56 HB3 GLN 56 -10.033 -18.614 8.059 432 HG2 GLN 56 HG2 GLN 56 -11.028 -19.046 10.242 433 HG3 GLN 56 HG3 GLN 56 -11.567 -20.646 9.745 434 HE21 GLN 56 HE22 GLN 56 -10.497 -21.692 11.414 435 HE22 GLN 56 HE21 GLN 56 -8.767 -21.927 11.359 436 H ALA 57 H ALA 57 -12.819 -20.529 5.669 437 HA ALA 57 HA ALA 57 -11.635 -18.927 3.561 438 HB1 ALA 57 HB1 ALA 57 -11.873 -21.402 3.457 439 HB2 ALA 57 HB2 ALA 57 -13.638 -21.230 3.488 440 HB3 ALA 57 HB3 ALA 57 -12.715 -20.595 2.108 441 H ILE 58 H ILE 58 -14.948 -19.496 4.824 442 HA ILE 58 HA ILE 58 -16.385 -17.909 2.886 443 HB ILE 58 HB ILE 58 -16.837 -18.558 5.865 444 HG12 ILE 58 HG12 ILE 58 -17.965 -19.984 3.443 445 HG13 ILE 58 HG13 ILE 58 -16.554 -20.560 4.336 446 HG21 ILE 58 HG21 ILE 58 -18.353 -16.727 4.834 447 HG22 ILE 58 HG22 ILE 58 -19.047 -18.086 3.892 448 HG23 ILE 58 HG23 ILE 58 -19.133 -18.096 5.651 449 HD11 ILE 58 HD11 ILE 58 -18.527 -21.738 5.149 450 HD12 ILE 58 HD12 ILE 58 -17.945 -20.649 6.419 451 HD13 ILE 58 HD13 ILE 58 -19.374 -20.223 5.452 452 H GLN 59 H GLN 59 -14.731 -17.153 6.005 453 HA GLN 59 HA GLN 59 -15.676 -14.428 6.088 454 HB2 GLN 59 HB2 GLN 59 -13.399 -15.876 7.504 455 HB3 GLN 59 HB3 GLN 59 -13.914 -14.225 7.875 456 HG2 GLN 59 HG2 GLN 59 -15.701 -16.679 8.033 457 HG3 GLN 59 HG3 GLN 59 -14.919 -15.913 9.414 458 HE21 GLN 59 HE22 GLN 59 -17.820 -16.317 8.807 459 HE22 GLN 59 HE21 GLN 59 -18.522 -14.712 8.845 460 H MET 60 H MET 60 -13.496 -15.894 3.988 461 HA MET 60 HA MET 60 -12.127 -13.310 3.503 462 HB2 MET 60 HB2 MET 60 -11.360 -16.147 2.719 463 HB3 MET 60 HB3 MET 60 -10.442 -14.706 2.281 464 HG2 MET 60 HG2 MET 60 -11.008 -15.304 5.193 465 HG3 MET 60 HG3 MET 60 -9.768 -16.211 4.325 466 HE1 MET 60 HE1 MET 60 -10.943 -12.737 5.554 467 HE2 MET 60 HE2 MET 60 -9.549 -11.668 5.170 468 HE3 MET 60 HE3 MET 60 -10.584 -12.276 3.879 469 H CYS 61 H CYS 61 -14.215 -15.854 2.151 470 HA CYS 61 HA CYS 61 -13.893 -15.041 -0.561 471 HB2 CYS 61 HB2 CYS 61 -16.136 -16.519 0.900 472 HB3 CYS 61 HB3 CYS 61 -16.130 -16.253 -0.841 473 HG CYS 61 HG CYS 61 -13.759 -17.664 0.961 474 H GLN 62 H GLN 62 -16.247 -14.058 2.013 475 HA GLN 62 HA GLN 62 -17.618 -12.201 0.255 476 HB2 GLN 62 HB2 GLN 62 -17.515 -12.356 3.303 477 HB3 GLN 62 HB3 GLN 62 -18.717 -11.481 2.326 478 HG2 GLN 62 HG2 GLN 62 -19.461 -13.641 1.329 479 HG3 GLN 62 HG3 GLN 62 -18.234 -14.489 2.257 480 HE21 GLN 62 HE22 GLN 62 -19.509 -15.742 3.447 481 HE22 GLN 62 HE21 GLN 62 -20.771 -15.171 4.487 482 H GLN 63 H GLN 63 -14.496 -12.098 1.513 483 HA GLN 63 HA GLN 63 -14.549 -9.139 1.840 484 HB2 GLN 63 HB2 GLN 63 -12.464 -11.223 2.611 485 HB3 GLN 63 HB3 GLN 63 -12.330 -9.486 2.908 486 HG2 GLN 63 HG2 GLN 63 -14.552 -11.240 4.031 487 HG3 GLN 63 HG3 GLN 63 -13.052 -10.825 4.884 488 HE21 GLN 63 HE22 GLN 63 -12.608 -8.558 5.355 489 HE22 GLN 63 HE21 GLN 63 -13.942 -7.448 5.562 490 H GLY 64 H GLY 64 -13.849 -11.594 -0.434 491 HA2 GLY 64 HA2 GLY 64 -11.833 -9.905 -1.825 492 HA3 GLY 64 HA3 GLY 64 -12.259 -11.593 -2.191 493 H LEU 65 H LEU 65 -15.142 -11.229 -2.043 494 HA LEU 65 HA LEU 65 -15.721 -10.332 -4.685 495 HB2 LEU 65 HB2 LEU 65 -17.374 -10.953 -2.221 496 HB3 LEU 65 HB3 LEU 65 -18.134 -10.465 -3.737 497 HG LEU 65 HG LEU 65 -16.191 -12.824 -3.559 498 HD11 LEU 65 HD11 LEU 65 -18.206 -14.241 -3.562 499 HD12 LEU 65 HD12 LEU 65 -18.174 -13.209 -2.124 500 HD13 LEU 65 HD13 LEU 65 -19.244 -12.806 -3.485 501 HD21 LEU 65 HD21 LEU 65 -18.237 -11.967 -5.644 502 HD22 LEU 65 HD22 LEU 65 -16.471 -11.871 -5.809 503 HD23 LEU 65 HD23 LEU 65 -17.264 -13.448 -5.697 504 H ARG 66 H ARG 66 -14.966 -8.513 -1.934 505 HA ARG 66 HA ARG 66 -16.591 -6.163 -2.564 506 HB2 ARG 66 HB2 ARG 66 -14.180 -6.545 -0.740 507 HB3 ARG 66 HB3 ARG 66 -15.276 -5.157 -0.744 508 HG2 ARG 66 HG2 ARG 66 -17.147 -6.643 -0.063 509 HG3 ARG 66 HG3 ARG 66 -16.035 -8.028 -0.043 510 HD2 ARG 66 HD2 ARG 66 -14.660 -6.958 1.677 511 HD3 ARG 66 HD3 ARG 66 -15.655 -5.504 1.602 512 HE ARG 66 HE ARG 66 -16.275 -8.016 2.960 513 HH11 ARG 66 HH11 ARG 66 -17.633 -5.023 1.643 514 HH12 ARG 66 HH12 ARG 66 -19.062 -5.098 2.650 515 HH21 ARG 66 HH21 ARG 66 -18.139 -8.086 4.238 516 HH22 ARG 66 HH22 ARG 66 -19.347 -6.825 4.115 517 H TYR 67 H TYR 67 -14.005 -7.594 -4.097 518 HA TYR 67 HA TYR 67 -12.753 -5.025 -4.906 519 HB2 TYR 67 HB2 TYR 67 -11.327 -7.500 -3.913 520 HB3 TYR 67 HB3 TYR 67 -10.527 -6.075 -4.558 521 HD1 TYR 67 HD2 TYR 67 -11.447 -3.765 -3.399 522 HD2 TYR 67 HD1 TYR 67 -11.361 -7.673 -1.614 523 HE1 TYR 67 HE2 TYR 67 -11.517 -2.727 -1.143 524 HE2 TYR 67 HE1 TYR 67 -11.418 -6.649 0.646 525 HH TYR 67 HH TYR 67 -11.492 -4.699 1.852 526 H THR 68 H THR 68 -14.487 -7.533 -5.961 527 HA THR 68 HA THR 68 -12.944 -7.933 -8.467 528 HB THR 68 HB THR 68 -14.669 -9.710 -8.880 529 HG1 THR 68 HG1 THR 68 -16.304 -8.907 -7.534 530 HG21 THR 68 HG21 THR 68 -13.731 -11.279 -7.280 531 HG22 THR 68 HG22 THR 68 -12.453 -10.166 -7.830 532 HG23 THR 68 HG23 THR 68 -13.197 -9.941 -6.240 533 H SER 69 H SER 69 -14.403 -5.442 -7.622 534 HA SER 69 HA SER 69 -16.845 -5.144 -9.028 535 HB2 SER 69 HB2 SER 69 -14.762 -3.096 -8.186 536 HB3 SER 69 HB3 SER 69 -16.450 -2.742 -8.625 537 HG SER 69 HG SER 69 -17.101 -4.042 -6.872 538 H THR 70 H THR 70 -14.100 -5.946 -10.592 539 HA THR 70 HA THR 70 -14.852 -4.419 -13.001 540 HB THR 70 HB THR 70 -13.262 -2.927 -12.030 541 HG1 THR 70 HG1 THR 70 -11.670 -2.971 -13.598 542 HG21 THR 70 HG21 THR 70 -10.951 -3.645 -11.446 543 HG22 THR 70 HG22 THR 70 -12.174 -4.398 -10.410 544 HG23 THR 70 HG23 THR 70 -11.433 -5.335 -11.720 545 H ALA 71 H ALA 71 -13.637 -5.164 -14.910 546 HA ALA 71 HA ALA 71 -13.922 -7.962 -15.198 547 HB1 ALA 71 HB1 ALA 71 -12.530 -5.894 -16.954 548 HB2 ALA 71 HB2 ALA 71 -13.066 -7.513 -17.478 549 HB3 ALA 71 HB3 ALA 71 -14.258 -6.291 -16.984 550 H GLU 72 H GLU 72 -11.239 -6.156 -13.944 551 HA GLU 72 HA GLU 72 -9.097 -7.804 -14.862 552 HB2 GLU 72 HB2 GLU 72 -9.380 -6.209 -12.315 553 HB3 GLU 72 HB3 GLU 72 -7.858 -6.840 -12.947 554 HG2 GLU 72 HG2 GLU 72 -9.651 -4.791 -14.315 555 HG3 GLU 72 HG3 GLU 72 -8.131 -4.452 -13.481 556 H HIS 73 H HIS 73 -11.718 -8.576 -12.843 557 HA HIS 73 HA HIS 73 -10.291 -10.938 -11.765 558 HB2 HIS 73 HB2 HIS 73 -12.172 -9.318 -10.041 559 HB3 HIS 73 HB3 HIS 73 -11.039 -10.565 -9.556 560 HD2 HIS 73 HD2 HIS 73 -11.373 -6.861 -9.860 561 HE1 HIS 73 HE1 HIS 73 -7.225 -7.532 -9.227 562 HE2 HIS 73 HE2 HIS 73 -9.064 -5.761 -9.292 563 H VAL 74 H VAL 74 -12.253 -10.437 -13.972 564 HA VAL 74 HA VAL 74 -14.909 -10.875 -13.282 565 HB VAL 74 HB VAL 74 -13.974 -10.244 -15.492 566 HG11 VAL 74 HG11 VAL 74 -13.463 -13.221 -15.840 567 HG12 VAL 74 HG12 VAL 74 -13.272 -11.969 -17.074 568 HG13 VAL 74 HG13 VAL 74 -12.204 -11.977 -15.655 569 HG21 VAL 74 HG21 VAL 74 -16.341 -10.938 -15.230 570 HG22 VAL 74 HG22 VAL 74 -15.690 -11.364 -16.826 571 HG23 VAL 74 HG23 VAL 74 -15.874 -12.615 -15.581 572 H ALA 75 H ALA 75 -12.299 -13.262 -13.322 573 HA ALA 75 HA ALA 75 -14.197 -15.510 -13.134 574 HB1 ALA 75 HB1 ALA 75 -11.167 -15.373 -12.794 575 HB2 ALA 75 HB2 ALA 75 -12.139 -16.859 -12.896 576 HB3 ALA 75 HB3 ALA 75 -12.031 -15.772 -14.297 577 H ILE 76 H ILE 76 -11.956 -13.716 -10.928 578 HA ILE 76 HA ILE 76 -12.494 -15.362 -8.645 579 HB ILE 76 HB ILE 76 -11.660 -12.439 -8.818 580 HG12 ILE 76 HG12 ILE 76 -10.009 -14.986 -8.568 581 HG13 ILE 76 HG13 ILE 76 -10.144 -13.995 -10.013 582 HG21 ILE 76 HG21 ILE 76 -10.759 -12.815 -6.536 583 HG22 ILE 76 HG22 ILE 76 -12.507 -13.011 -6.588 584 HG23 ILE 76 HG23 ILE 76 -11.453 -14.443 -6.545 585 HD11 ILE 76 HD11 ILE 76 -8.073 -13.442 -8.918 586 HD12 ILE 76 HD12 ILE 76 -9.172 -12.060 -8.778 587 HD13 ILE 76 HD13 ILE 76 -8.895 -13.134 -7.384 588 H ARG 77 H ARG 77 -14.199 -12.697 -10.181 589 HA ARG 77 HA ARG 77 -15.996 -11.912 -8.165 590 HB2 ARG 77 HB2 ARG 77 -15.569 -10.861 -10.421 591 HB3 ARG 77 HB3 ARG 77 -16.455 -12.205 -11.164 592 HG2 ARG 77 HG2 ARG 77 -18.489 -11.546 -9.868 593 HG3 ARG 77 HG3 ARG 77 -17.575 -10.172 -9.193 594 HD2 ARG 77 HD2 ARG 77 -17.168 -9.344 -11.491 595 HD3 ARG 77 HD3 ARG 77 -18.022 -10.751 -12.149 596 HE ARG 77 HE ARG 77 -20.082 -9.831 -11.526 597 HH11 ARG 77 HH11 ARG 77 -17.425 -7.810 -10.318 598 HH12 ARG 77 HH12 ARG 77 -18.482 -6.487 -9.911 599 HH21 ARG 77 HH21 ARG 77 -21.413 -8.066 -10.988 600 HH22 ARG 77 HH22 ARG 77 -20.720 -6.625 -10.293 601 H SER 78 H SER 78 -15.748 -14.905 -9.880 602 HA SER 78 HA SER 78 -18.430 -15.753 -8.865 603 HB2 SER 78 HB2 SER 78 -16.969 -16.552 -11.409 604 HB3 SER 78 HB3 SER 78 -18.478 -17.295 -10.813 605 HG SER 78 HG SER 78 -18.831 -15.599 -12.339 606 H LYS 79 H LYS 79 -14.974 -16.339 -8.789 607 HA LYS 79 HA LYS 79 -15.316 -19.155 -8.068 608 HB2 LYS 79 HB2 LYS 79 -12.955 -17.243 -8.135 609 HB3 LYS 79 HB3 LYS 79 -12.831 -18.839 -7.435 610 HG2 LYS 79 HG2 LYS 79 -13.557 -18.218 -10.323 611 HG3 LYS 79 HG3 LYS 79 -12.041 -18.901 -9.723 612 HD2 LYS 79 HD2 LYS 79 -14.777 -20.193 -9.868 613 HD3 LYS 79 HD3 LYS 79 -13.251 -20.735 -10.584 614 HE2 LYS 79 HE2 LYS 79 -12.380 -21.061 -8.206 615 HE3 LYS 79 HE3 LYS 79 -14.033 -20.724 -7.634 616 HZ1 LYS 79 HZ1 LYS 79 -13.648 -23.079 -7.879 617 HZ2 LYS 79 HZ2 LYS 79 -14.787 -22.591 -8.956 618 HZ3 LYS 79 HZ3 LYS 79 -13.259 -22.912 -9.465 619 H LEU 80 H LEU 80 -15.105 -16.024 -6.274 620 HA LEU 80 HA LEU 80 -14.713 -17.480 -3.771 621 HB2 LEU 80 HB2 LEU 80 -15.532 -14.601 -4.298 622 HB3 LEU 80 HB3 LEU 80 -14.903 -15.272 -2.776 623 HG LEU 80 HG LEU 80 -13.436 -14.909 -5.410 624 HD11 LEU 80 HD11 LEU 80 -11.951 -13.501 -4.051 625 HD12 LEU 80 HD12 LEU 80 -13.629 -12.916 -3.990 626 HD13 LEU 80 HD13 LEU 80 -12.946 -13.825 -2.612 627 HD21 LEU 80 HD21 LEU 80 -11.466 -15.875 -4.311 628 HD22 LEU 80 HD22 LEU 80 -12.464 -16.316 -2.901 629 HD23 LEU 80 HD23 LEU 80 -12.744 -17.073 -4.488 630 H GLN 81 H GLN 81 -17.339 -16.293 -5.827 631 HA GLN 81 HA GLN 81 -19.456 -16.733 -3.929 632 HB2 GLN 81 HB2 GLN 81 -19.130 -16.345 -6.890 633 HB3 GLN 81 HB3 GLN 81 -20.587 -17.160 -6.368 634 HG2 GLN 81 HG2 GLN 81 -19.663 -14.430 -5.418 635 HG3 GLN 81 HG3 GLN 81 -20.987 -14.758 -6.544 636 HE21 GLN 81 HE22 GLN 81 -22.295 -16.939 -5.300 637 HE22 GLN 81 HE21 GLN 81 -22.942 -16.387 -3.776 638 H TYR 82 H TYR 82 -17.784 -18.748 -6.383 639 HA TYR 82 HA TYR 82 -19.463 -21.029 -6.233 640 HB2 TYR 82 HB2 TYR 82 -17.813 -20.791 -8.009 641 HB3 TYR 82 HB3 TYR 82 -16.529 -20.529 -6.850 642 HD1 TYR 82 HD2 TYR 82 -15.467 -22.312 -5.662 643 HD2 TYR 82 HD1 TYR 82 -18.641 -23.099 -8.458 644 HE1 TYR 82 HE2 TYR 82 -14.853 -24.730 -5.683 645 HE2 TYR 82 HE1 TYR 82 -18.032 -25.503 -8.483 646 HH TYR 82 HH TYR 82 -16.622 -27.133 -7.674 647 H ARG 83 H ARG 83 -16.495 -20.209 -4.287 648 HA ARG 83 HA ARG 83 -16.818 -22.713 -2.818 649 HB2 ARG 83 HB2 ARG 83 -14.910 -20.406 -2.816 650 HB3 ARG 83 HB3 ARG 83 -15.050 -21.343 -1.310 651 HG2 ARG 83 HG2 ARG 83 -14.282 -22.414 -4.048 652 HG3 ARG 83 HG3 ARG 83 -13.220 -22.175 -2.665 653 HD2 ARG 83 HD2 ARG 83 -14.494 -23.863 -1.376 654 HD3 ARG 83 HD3 ARG 83 -15.574 -24.110 -2.764 655 HE ARG 83 HE ARG 83 -12.879 -24.493 -3.600 656 HH11 ARG 83 HH11 ARG 83 -15.400 -26.023 -1.646 657 HH12 ARG 83 HH12 ARG 83 -14.796 -27.641 -1.933 658 HH21 ARG 83 HH21 ARG 83 -12.144 -26.615 -3.978 659 HH22 ARG 83 HH22 ARG 83 -12.968 -27.973 -3.250 660 H LEU 84 H LEU 84 -17.893 -19.351 -2.397 661 HA LEU 84 HA LEU 84 -18.663 -19.712 0.348 662 HB2 LEU 84 HB2 LEU 84 -18.290 -17.532 -0.850 663 HB3 LEU 84 HB3 LEU 84 -19.748 -17.840 -1.800 664 HG LEU 84 HG LEU 84 -20.970 -17.979 0.475 665 HD11 LEU 84 HD11 LEU 84 -18.403 -16.660 1.397 666 HD12 LEU 84 HD12 LEU 84 -19.896 -16.929 2.339 667 HD13 LEU 84 HD13 LEU 84 -18.914 -18.307 1.808 668 HD21 LEU 84 HD21 LEU 84 -19.618 -15.373 -0.329 669 HD22 LEU 84 HD22 LEU 84 -21.116 -16.015 -1.028 670 HD23 LEU 84 HD23 LEU 84 -21.082 -15.514 0.671 671 H GLU 85 H GLU 85 -20.001 -20.511 -2.791 672 HA GLU 85 HA GLU 85 -22.698 -21.109 -1.909 673 HB2 GLU 85 HB2 GLU 85 -21.077 -21.282 -4.439 674 HB3 GLU 85 HB3 GLU 85 -22.557 -22.198 -4.355 675 HG2 GLU 85 HG2 GLU 85 -23.856 -20.201 -3.817 676 HG3 GLU 85 HG3 GLU 85 -22.391 -19.223 -3.724 677 H LEU 86 H LEU 86 -19.835 -22.691 -1.290 678 HA LEU 86 HA LEU 86 -21.246 -25.316 -1.124 679 HB2 LEU 86 HB2 LEU 86 -18.411 -24.785 -2.103 680 HB3 LEU 86 HB3 LEU 86 -19.046 -26.387 -1.730 681 HG LEU 86 HG LEU 86 -20.205 -24.535 -3.852 682 HD11 LEU 86 HD11 LEU 86 -18.415 -26.988 -4.100 683 HD12 LEU 86 HD12 LEU 86 -19.151 -26.089 -5.446 684 HD13 LEU 86 HD13 LEU 86 -17.933 -25.305 -4.414 685 HD21 LEU 86 HD21 LEU 86 -21.377 -26.597 -4.601 686 HD22 LEU 86 HD22 LEU 86 -20.707 -27.476 -3.208 687 HD23 LEU 86 HD23 LEU 86 -21.864 -26.147 -2.954 688 H ALA 87 H ALA 87 -19.051 -22.948 0.299 689 HA ALA 87 HA ALA 87 -18.016 -24.631 2.381 690 HB1 ALA 87 HB1 ALA 87 -18.508 -21.620 2.316 691 HB2 ALA 87 HB2 ALA 87 -17.448 -22.499 3.453 692 HB3 ALA 87 HB3 ALA 87 -17.038 -22.445 1.735 693 H GLN 88 H GLN 88 -21.035 -22.824 1.927 694 HA GLN 88 HA GLN 88 -21.942 -22.995 4.648 695 HB2 GLN 88 HB2 GLN 88 -23.335 -22.486 1.987 696 HB3 GLN 88 HB3 GLN 88 -24.105 -22.313 3.570 697 HG2 GLN 88 HG2 GLN 88 -22.413 -20.624 4.222 698 HG3 GLN 88 HG3 GLN 88 -21.638 -20.783 2.643 699 HE21 GLN 88 HE22 GLN 88 -22.541 -18.300 3.567 700 HE22 GLN 88 HE21 GLN 88 -23.902 -17.794 2.587 701 H GLY 89 H GLY 89 -21.223 -25.487 2.732 702 HA2 GLY 89 HA2 GLY 89 -23.383 -27.199 3.837 703 HA3 GLY 89 HA3 GLY 89 -22.963 -27.288 2.109 704 H ALA 90 H ALA 90 -20.306 -26.530 4.169 705 HA ALA 90 HA ALA 90 -19.531 -29.364 4.538 706 HB1 ALA 90 HB1 ALA 90 -17.839 -27.291 3.069 707 HB2 ALA 90 HB2 ALA 90 -17.330 -28.933 3.499 708 HB3 ALA 90 HB3 ALA 90 -18.646 -28.698 2.329 709 H VAL 91 H VAL 91 -19.537 -26.052 5.561 710 HA VAL 91 HA VAL 91 -17.330 -26.194 7.400 711 HB VAL 91 HB VAL 91 -18.385 -24.159 6.378 712 HG11 VAL 91 HG11 VAL 91 -20.516 -24.563 8.510 713 HG12 VAL 91 HG12 VAL 91 -20.348 -23.169 7.436 714 HG13 VAL 91 HG13 VAL 91 -20.764 -24.761 6.754 715 HG21 VAL 91 HG21 VAL 91 -16.839 -24.027 8.305 716 HG22 VAL 91 HG22 VAL 91 -18.055 -22.736 8.328 717 HG23 VAL 91 HG23 VAL 91 -18.228 -24.129 9.412 718 H GLY 92 H GLY 92 -20.401 -27.589 7.366 719 HA2 GLY 92 HA2 GLY 92 -20.319 -28.147 10.296 720 HA3 GLY 92 HA3 GLY 92 -21.827 -27.681 9.483 721 H SER 93 H SER 93 -19.376 -29.681 7.914 722 HA SER 93 HA SER 93 -20.980 -32.148 8.345 723 HB2 SER 93 HB2 SER 93 -20.144 -31.066 5.633 724 HB3 SER 93 HB3 SER 93 -20.956 -32.615 5.941 725 HG SER 93 HG SER 93 -22.411 -30.939 5.324 726 H VAL 94 H VAL 94 -19.684 -33.923 6.826 727 HA VAL 94 HA VAL 94 -16.813 -33.665 7.472 728 HB VAL 94 HB VAL 94 -18.550 -36.005 8.289 729 HG11 VAL 94 HG11 VAL 94 -15.585 -35.412 8.714 730 HG12 VAL 94 HG12 VAL 94 -16.475 -36.802 9.391 731 HG13 VAL 94 HG13 VAL 94 -16.261 -36.667 7.640 732 HG21 VAL 94 HG21 VAL 94 -17.171 -33.876 9.968 733 HG22 VAL 94 HG22 VAL 94 -18.927 -34.082 9.768 734 HG23 VAL 94 HG23 VAL 94 -17.987 -35.328 10.602 735 H GLN 95 H GLN 95 -16.018 -33.724 5.527 736 HA GLN 95 HA GLN 95 -16.548 -36.068 3.809 737 HB2 GLN 95 HB2 GLN 95 -16.724 -34.640 1.829 738 HB3 GLN 95 HB3 GLN 95 -17.984 -34.248 3.030 739 HG2 GLN 95 HG2 GLN 95 -15.443 -32.649 2.963 740 HG3 GLN 95 HG3 GLN 95 -16.770 -32.299 1.849 741 HE21 GLN 95 HE22 GLN 95 -15.549 -31.481 4.862 742 HE22 GLN 95 HE21 GLN 95 -17.044 -30.992 5.623 743 H ILE 96 H ILE 96 -14.354 -34.825 5.647 744 HA ILE 96 HA ILE 96 -12.108 -35.424 3.834 745 HB ILE 96 HB ILE 96 -10.847 -33.483 4.824 746 HG12 ILE 96 HG12 ILE 96 -13.631 -32.538 5.642 747 HG13 ILE 96 HG13 ILE 96 -12.377 -33.093 6.765 748 HG21 ILE 96 HG21 ILE 96 -13.277 -32.706 3.181 749 HG22 ILE 96 HG22 ILE 96 -11.709 -31.880 3.232 750 HG23 ILE 96 HG23 ILE 96 -11.826 -33.504 2.536 751 HD11 ILE 96 HD11 ILE 96 -10.874 -31.278 5.952 752 HD12 ILE 96 HD12 ILE 96 -12.198 -30.678 4.928 753 HD13 ILE 96 HD13 ILE 96 -12.366 -30.666 6.691 754 HA PRO 97 HA PRO 97 -11.979 -37.088 8.293 755 HB2 PRO 97 HB2 PRO 97 -12.417 -39.752 7.852 756 HB3 PRO 97 HB3 PRO 97 -13.752 -38.573 8.066 757 HG2 PRO 97 HG2 PRO 97 -12.583 -39.599 5.463 758 HG3 PRO 97 HG3 PRO 97 -14.315 -39.523 5.947 759 HD2 PRO 97 HD2 PRO 97 -13.186 -37.584 4.416 760 HD3 PRO 97 HD3 PRO 97 -14.367 -37.174 5.700 761 H VAL 98 H VAL 98 -10.437 -38.764 9.118 762 HA VAL 98 HA VAL 98 -8.204 -39.334 7.266 763 HB VAL 98 HB VAL 98 -6.567 -38.360 8.848 764 HG11 VAL 98 HG11 VAL 98 -8.635 -36.322 7.942 765 HG12 VAL 98 HG12 VAL 98 -6.914 -36.028 8.275 766 HG13 VAL 98 HG13 VAL 98 -7.383 -37.049 6.903 767 HG21 VAL 98 HG21 VAL 98 -7.939 -38.441 10.908 768 HG22 VAL 98 HG22 VAL 98 -7.316 -36.807 10.602 769 HG23 VAL 98 HG23 VAL 98 -9.012 -37.189 10.242 770 H VAL 99 H VAL 99 -10.243 -40.252 9.754 771 HA VAL 99 HA VAL 99 -10.252 -41.858 11.343 772 HB VAL 99 HB VAL 99 -10.007 -44.095 10.357 773 HG11 VAL 99 HG11 VAL 99 -11.235 -42.008 8.510 774 HG12 VAL 99 HG12 VAL 99 -11.634 -43.745 8.545 775 HG13 VAL 99 HG13 VAL 99 -12.005 -42.717 9.947 776 HG21 VAL 99 HG21 VAL 99 -8.919 -42.651 7.902 777 HG22 VAL 99 HG22 VAL 99 -7.956 -43.697 8.977 778 HG23 VAL 99 HG23 VAL 99 -9.298 -44.378 8.037 779 H GLU 100 H GLU 100 -7.926 -40.349 11.775 780 HA GLU 100 HA GLU 100 -5.585 -41.884 12.108 781 HB2 GLU 100 HB2 GLU 100 -4.874 -40.090 13.608 782 HB3 GLU 100 HB3 GLU 100 -5.661 -39.425 12.170 783 HG2 GLU 100 HG2 GLU 100 -7.764 -39.127 13.442 784 HG3 GLU 100 HG3 GLU 100 -6.998 -39.806 14.888 785 H VAL 101 H VAL 101 -4.556 -42.246 14.334 786 HA VAL 101 HA VAL 101 -6.449 -43.370 16.304 787 HB VAL 101 HB VAL 101 -4.139 -44.898 15.026 788 HG11 VAL 101 HG11 VAL 101 -5.041 -46.818 16.359 789 HG12 VAL 101 HG12 VAL 101 -4.365 -45.534 17.371 790 HG13 VAL 101 HG13 VAL 101 -6.134 -45.694 17.192 791 HG21 VAL 101 HG21 VAL 101 -6.096 -44.826 13.537 792 HG22 VAL 101 HG22 VAL 101 -5.917 -46.436 14.238 793 HG23 VAL 101 HG23 VAL 101 -7.150 -45.335 14.875 794 H ASP 102 H ASP 102 -5.390 -43.792 18.396 795 HA ASP 102 HA ASP 102 -2.783 -42.466 18.818 796 HB2 ASP 102 HB2 ASP 102 -4.610 -40.751 18.966 797 HB3 ASP 102 HB3 ASP 102 -5.320 -41.694 20.279 798 H GLU 103 H GLU 103 -2.183 -42.719 21.248 799 HA GLU 103 HA GLU 103 -3.185 -45.317 22.302 800 HB2 GLU 103 HB2 GLU 103 -0.269 -44.517 22.217 801 HB3 GLU 103 HB3 GLU 103 -0.969 -46.078 22.648 802 HG2 GLU 103 HG2 GLU 103 -1.888 -46.195 20.274 803 HG3 GLU 103 HG3 GLU 103 -0.884 -44.788 19.898 804 H LEU 104 H LEU 104 -1.775 -45.621 24.517 805 HA LEU 104 HA LEU 104 -1.882 -43.148 26.103 806 HB2 LEU 104 HB2 LEU 104 -3.050 -44.842 27.794 807 HB3 LEU 104 HB3 LEU 104 -3.973 -43.814 26.703 808 HG LEU 104 HG LEU 104 -4.208 -45.732 25.135 809 HD11 LEU 104 HD11 LEU 104 -2.227 -47.074 25.733 810 HD12 LEU 104 HD12 LEU 104 -2.867 -47.302 27.383 811 HD13 LEU 104 HD13 LEU 104 -3.697 -48.016 25.988 812 HD21 LEU 104 HD21 LEU 104 -5.057 -46.290 28.003 813 HD22 LEU 104 HD22 LEU 104 -5.910 -45.226 26.861 814 HD23 LEU 104 HD23 LEU 104 -5.805 -46.970 26.536 815 HA PRO 105 HA PRO 105 1.632 -44.977 28.047 816 HB2 PRO 105 HB2 PRO 105 1.622 -43.877 30.536 817 HB3 PRO 105 HB3 PRO 105 1.788 -42.872 29.062 818 HG2 PRO 105 HG2 PRO 105 -0.725 -43.456 30.634 819 HG3 PRO 105 HG3 PRO 105 -0.110 -41.855 30.104 820 HD2 PRO 105 HD2 PRO 105 -1.996 -43.239 28.686 821 HD3 PRO 105 HD3 PRO 105 -0.756 -42.241 27.873 822 H GLU 106 H GLU 106 -0.896 -46.598 28.100 823 HA GLU 106 HA GLU 106 -1.715 -48.479 29.013 824 HB2 GLU 106 HB2 GLU 106 0.758 -48.991 28.617 825 HB3 GLU 106 HB3 GLU 106 0.956 -48.875 30.375 826 HG2 GLU 106 HG2 GLU 106 -0.764 -50.668 30.654 827 HG3 GLU 106 HG3 GLU 106 -0.959 -50.727 28.902 828 H GLY 107 H GLY 107 -2.041 -45.966 30.573 829 HA2 GLY 107 HA2 GLY 107 -3.360 -47.171 32.825 830 HA3 GLY 107 HA3 GLY 107 -1.867 -46.362 33.340 831 H TYR 108 H TYR 108 -2.158 -44.305 31.162 832 HA TYR 108 HA TYR 108 -2.722 -42.121 31.175 833 HB2 TYR 108 HB2 TYR 108 -5.048 -41.716 30.577 834 HB3 TYR 108 HB3 TYR 108 -4.309 -43.042 29.700 835 HD1 TYR 108 HD2 TYR 108 -4.923 -45.365 30.117 836 HD2 TYR 108 HD1 TYR 108 -6.942 -42.111 32.057 837 HE1 TYR 108 HE2 TYR 108 -6.794 -46.892 30.714 838 HE2 TYR 108 HE1 TYR 108 -8.811 -43.627 32.679 839 HH TYR 108 HH TYR 108 -9.661 -45.743 32.562 840 H ASP 109 H ASP 109 -4.941 -40.668 32.108 841 HA ASP 109 HA ASP 109 -4.052 -40.195 34.817 842 HB2 ASP 109 HB2 ASP 109 -4.661 -38.425 33.116 843 HB3 ASP 109 HB3 ASP 109 -6.351 -38.928 33.269 844 H ARG 110 H ARG 110 -5.592 -42.707 34.054 845 HA ARG 110 HA ARG 110 -7.313 -44.023 34.680 846 HB2 ARG 110 HB2 ARG 110 -6.711 -42.735 37.356 847 HB3 ARG 110 HB3 ARG 110 -7.527 -44.285 37.087 848 HG2 ARG 110 HG2 ARG 110 -5.496 -45.167 35.972 849 HG3 ARG 110 HG3 ARG 110 -4.670 -43.626 36.277 850 HD2 ARG 110 HD2 ARG 110 -4.980 -43.930 38.708 851 HD3 ARG 110 HD3 ARG 110 -5.797 -45.477 38.405 852 HE ARG 110 HE ARG 110 -3.249 -45.517 37.127 853 HH11 ARG 110 HH11 ARG 110 -4.658 -45.542 40.376 854 HH12 ARG 110 HH12 ARG 110 -3.328 -46.432 41.069 855 HH21 ARG 110 HH21 ARG 110 -1.526 -46.683 38.074 856 HH22 ARG 110 HH22 ARG 110 -1.558 -47.066 39.776 857 H SER 111 H SER 111 -8.138 -41.252 33.818 858 HA SER 111 HA SER 111 -10.946 -41.480 34.641 859 HB2 SER 111 HB2 SER 111 -9.913 -39.994 36.355 860 HB3 SER 111 HB3 SER 111 -9.327 -38.931 35.052 861 HG SER 111 HG SER 111 -11.340 -38.235 35.949 Start of MODEL 16 1 H1 SER 2 H1 SER 2 8.374 -3.408 -5.653 2 H2 SER 2 H2 SER 2 8.622 -3.287 -4.032 3 H3 SER 2 H3 SER 2 7.690 -2.173 -4.811 4 HA SER 2 HA SER 2 6.325 -3.681 -3.569 5 HB2 SER 2 HB2 SER 2 6.090 -4.029 -6.589 6 HB3 SER 2 HB3 SER 2 4.803 -4.285 -5.386 7 HG SER 2 HG SER 2 4.711 -2.207 -6.339 8 H GLN 3 H GLN 3 5.716 -5.773 -3.033 9 HA GLN 3 HA GLN 3 7.150 -8.019 -4.339 10 HB2 GLN 3 HB2 GLN 3 7.135 -7.465 -1.339 11 HB3 GLN 3 HB3 GLN 3 7.719 -8.953 -2.103 12 HG2 GLN 3 HG2 GLN 3 9.392 -7.607 -3.387 13 HG3 GLN 3 HG3 GLN 3 8.862 -6.156 -2.515 14 HE21 GLN 3 HE22 GLN 3 11.474 -6.696 -2.321 15 HE22 GLN 3 HE21 GLN 3 11.872 -7.366 -0.745 16 H PHE 4 H PHE 4 4.250 -6.766 -3.745 17 HA PHE 4 HA PHE 4 2.729 -8.601 -2.275 18 HB2 PHE 4 HB2 PHE 4 1.915 -6.465 -3.067 19 HB3 PHE 4 HB3 PHE 4 2.104 -6.934 -4.735 20 HD1 PHE 4 HD1 PHE 4 0.700 -9.133 -5.455 21 HD2 PHE 4 HD2 PHE 4 -0.214 -6.553 -2.143 22 HE1 PHE 4 HE1 PHE 4 -1.624 -9.964 -5.468 23 HE2 PHE 4 HE2 PHE 4 -2.575 -7.336 -2.194 24 HZ PHE 4 HZ PHE 4 -3.278 -9.036 -3.853 25 H GLU 5 H GLU 5 3.519 -8.654 -5.802 26 HA GLU 5 HA GLU 5 2.135 -11.200 -6.133 27 HB2 GLU 5 HB2 GLU 5 3.970 -9.607 -7.973 28 HB3 GLU 5 HB3 GLU 5 3.086 -11.069 -8.446 29 HG2 GLU 5 HG2 GLU 5 0.941 -9.969 -7.856 30 HG3 GLU 5 HG3 GLU 5 1.825 -8.483 -7.439 31 H LYS 6 H LYS 6 5.395 -10.237 -5.259 32 HA LYS 6 HA LYS 6 6.740 -12.603 -6.223 33 HB2 LYS 6 HB2 LYS 6 7.850 -10.494 -5.827 34 HB3 LYS 6 HB3 LYS 6 7.543 -10.648 -4.088 35 HG2 LYS 6 HG2 LYS 6 8.926 -12.609 -3.931 36 HG3 LYS 6 HG3 LYS 6 8.990 -12.778 -5.709 37 HD2 LYS 6 HD2 LYS 6 10.187 -10.674 -5.896 38 HD3 LYS 6 HD3 LYS 6 10.116 -10.442 -4.132 39 HE2 LYS 6 HE2 LYS 6 11.426 -12.513 -3.799 40 HE3 LYS 6 HE3 LYS 6 11.479 -12.770 -5.556 41 HZ1 LYS 6 HZ1 LYS 6 12.693 -10.704 -5.756 42 HZ2 LYS 6 HZ2 LYS 6 12.645 -10.474 -4.132 43 HZ3 LYS 6 HZ3 LYS 6 13.486 -11.739 -4.758 44 H GLN 7 H GLN 7 5.577 -11.599 -2.933 45 HA GLN 7 HA GLN 7 6.407 -14.030 -1.694 46 HB2 GLN 7 HB2 GLN 7 5.413 -11.557 -0.910 47 HB3 GLN 7 HB3 GLN 7 4.063 -12.637 -0.542 48 HG2 GLN 7 HG2 GLN 7 6.938 -12.896 0.400 49 HG3 GLN 7 HG3 GLN 7 5.537 -12.445 1.384 50 HE21 GLN 7 HE22 GLN 7 3.669 -14.178 1.347 51 HE22 GLN 7 HE21 GLN 7 4.192 -15.843 1.432 52 H LYS 8 H LYS 8 3.427 -13.016 -3.324 53 HA LYS 8 HA LYS 8 1.743 -15.163 -2.416 54 HB2 LYS 8 HB2 LYS 8 1.060 -12.898 -3.216 55 HB3 LYS 8 HB3 LYS 8 1.584 -13.346 -4.813 56 HG2 LYS 8 HG2 LYS 8 -0.129 -15.320 -4.620 57 HG3 LYS 8 HG3 LYS 8 -0.753 -14.457 -3.220 58 HD2 LYS 8 HD2 LYS 8 -2.057 -13.734 -5.124 59 HD3 LYS 8 HD3 LYS 8 -0.950 -12.395 -4.783 60 HE2 LYS 8 HE2 LYS 8 0.588 -13.076 -6.512 61 HE3 LYS 8 HE3 LYS 8 -0.219 -14.637 -6.693 62 HZ1 LYS 8 HZ1 LYS 8 -2.140 -13.488 -7.571 63 HZ2 LYS 8 HZ2 LYS 8 -1.421 -12.022 -7.364 64 HZ3 LYS 8 HZ3 LYS 8 -0.808 -13.096 -8.450 65 H GLU 9 H GLU 9 3.874 -14.725 -5.296 66 HA GLU 9 HA GLU 9 2.866 -17.155 -6.536 67 HB2 GLU 9 HB2 GLU 9 3.644 -15.136 -7.781 68 HB3 GLU 9 HB3 GLU 9 5.282 -15.393 -7.151 69 HG2 GLU 9 HG2 GLU 9 5.343 -17.614 -8.218 70 HG3 GLU 9 HG3 GLU 9 3.677 -17.378 -8.790 71 H GLN 10 H GLN 10 5.639 -16.176 -4.505 72 HA GLN 10 HA GLN 10 7.150 -18.590 -4.928 73 HB2 GLN 10 HB2 GLN 10 7.201 -16.395 -2.829 74 HB3 GLN 10 HB3 GLN 10 8.321 -17.776 -2.798 75 HG2 GLN 10 HG2 GLN 10 9.097 -17.233 -5.069 76 HG3 GLN 10 HG3 GLN 10 8.031 -15.824 -5.131 77 HE21 GLN 10 HE22 GLN 10 10.993 -15.982 -5.315 78 HE22 GLN 10 HE21 GLN 10 11.609 -14.992 -4.006 79 H GLY 11 H GLY 11 4.161 -18.374 -3.603 80 HA2 GLY 11 HA2 GLY 11 4.689 -20.714 -1.827 81 HA3 GLY 11 HA3 GLY 11 3.543 -19.454 -1.382 82 H ASN 12 H ASN 12 3.265 -19.670 -4.719 83 HA ASN 12 HA ASN 12 0.758 -21.035 -4.589 84 HB2 ASN 12 HB2 ASN 12 0.579 -20.531 -6.793 85 HB3 ASN 12 HB3 ASN 12 1.916 -19.441 -6.441 86 HD21 ASN 12 HD22 ASN 12 4.082 -20.184 -7.046 87 HD22 ASN 12 HD21 ASN 12 4.243 -21.348 -8.343 88 H SER 13 H SER 13 4.063 -22.126 -5.011 89 HA SER 13 HA SER 13 3.303 -24.800 -5.901 90 HB2 SER 13 HB2 SER 13 5.744 -25.240 -5.602 91 HB3 SER 13 HB3 SER 13 5.415 -23.836 -6.635 92 HG SER 13 HG SER 13 7.031 -23.425 -5.038 93 H LEU 14 H LEU 14 4.180 -23.194 -2.816 94 HA LEU 14 HA LEU 14 4.481 -25.543 -1.241 95 HB2 LEU 14 HB2 LEU 14 3.828 -22.630 -0.776 96 HB3 LEU 14 HB3 LEU 14 3.576 -23.771 0.536 97 HG LEU 14 HG LEU 14 5.925 -24.495 0.419 98 HD11 LEU 14 HD11 LEU 14 6.406 -24.126 -1.951 99 HD12 LEU 14 HD12 LEU 14 6.173 -22.369 -1.749 100 HD13 LEU 14 HD13 LEU 14 7.537 -23.197 -0.956 101 HD21 LEU 14 HD21 LEU 14 5.241 -22.602 1.867 102 HD22 LEU 14 HD22 LEU 14 6.900 -22.397 1.269 103 HD23 LEU 14 HD23 LEU 14 5.569 -21.472 0.538 104 H PHE 15 H PHE 15 1.629 -23.685 -2.302 105 HA PHE 15 HA PHE 15 -0.317 -25.002 -0.693 106 HB2 PHE 15 HB2 PHE 15 -0.817 -22.951 -1.862 107 HB3 PHE 15 HB3 PHE 15 -0.336 -23.637 -3.402 108 HD1 PHE 15 HD1 PHE 15 -2.676 -24.745 -0.661 109 HD2 PHE 15 HD2 PHE 15 -2.067 -23.937 -4.841 110 HE1 PHE 15 HE1 PHE 15 -5.024 -25.397 -1.121 111 HE2 PHE 15 HE2 PHE 15 -4.449 -24.552 -5.300 112 HZ PHE 15 HZ PHE 15 -5.908 -25.278 -3.447 113 H LYS 16 H LYS 16 1.537 -26.057 -3.429 114 HA LYS 16 HA LYS 16 -0.378 -28.249 -4.023 115 HB2 LYS 16 HB2 LYS 16 1.949 -27.149 -5.636 116 HB3 LYS 16 HB3 LYS 16 0.800 -28.394 -6.180 117 HG2 LYS 16 HG2 LYS 16 -1.058 -26.822 -6.031 118 HG3 LYS 16 HG3 LYS 16 -0.021 -25.597 -5.285 119 HD2 LYS 16 HD2 LYS 16 1.373 -25.548 -7.364 120 HD3 LYS 16 HD3 LYS 16 0.150 -26.612 -8.130 121 HE2 LYS 16 HE2 LYS 16 -1.607 -24.917 -7.550 122 HE3 LYS 16 HE3 LYS 16 -0.342 -23.868 -6.881 123 HZ1 LYS 16 HZ1 LYS 16 -0.461 -24.761 -9.683 124 HZ2 LYS 16 HZ2 LYS 16 -0.904 -23.270 -9.138 125 HZ3 LYS 16 HZ3 LYS 16 0.671 -23.744 -9.035 126 H GLN 17 H GLN 17 2.428 -27.676 -2.224 127 HA GLN 17 HA GLN 17 3.700 -30.266 -2.658 128 HB2 GLN 17 HB2 GLN 17 4.058 -28.156 -0.534 129 HB3 GLN 17 HB3 GLN 17 4.977 -29.668 -0.624 130 HG2 GLN 17 HG2 GLN 17 5.548 -29.000 -3.055 131 HG3 GLN 17 HG3 GLN 17 4.942 -27.395 -2.620 132 HE21 GLN 17 HE22 GLN 17 5.793 -26.922 -0.110 133 HE22 GLN 17 HE21 GLN 17 7.528 -27.023 -0.012 134 H GLY 18 H GLY 18 0.930 -29.175 -0.831 135 HA2 GLY 18 HA2 GLY 18 -0.579 -30.663 0.177 136 HA3 GLY 18 HA3 GLY 18 0.683 -31.888 0.327 137 H LEU 19 H LEU 19 1.220 -28.541 1.332 138 HA LEU 19 HA LEU 19 0.888 -29.261 4.182 139 HB2 LEU 19 HB2 LEU 19 3.086 -28.058 4.626 140 HB3 LEU 19 HB3 LEU 19 3.140 -29.694 3.961 141 HG LEU 19 HG LEU 19 3.588 -28.813 1.705 142 HD11 LEU 19 HD11 LEU 19 3.721 -26.115 3.105 143 HD12 LEU 19 HD12 LEU 19 4.221 -26.436 1.434 144 HD13 LEU 19 HD13 LEU 19 2.512 -26.605 1.886 145 HD21 LEU 19 HD21 LEU 19 5.881 -28.070 2.177 146 HD22 LEU 19 HD22 LEU 19 5.441 -27.751 3.865 147 HD23 LEU 19 HD23 LEU 19 5.412 -29.415 3.239 148 H TYR 20 H TYR 20 -1.007 -28.038 2.938 149 HA TYR 20 HA TYR 20 -1.077 -25.481 2.127 150 HB2 TYR 20 HB2 TYR 20 -3.165 -26.644 3.960 151 HB3 TYR 20 HB3 TYR 20 -3.420 -25.515 2.640 152 HD1 TYR 20 HD1 TYR 20 -1.950 -26.750 0.396 153 HD2 TYR 20 HD2 TYR 20 -4.320 -28.570 3.489 154 HE1 TYR 20 HE1 TYR 20 -2.439 -28.659 -1.096 155 HE2 TYR 20 HE2 TYR 20 -4.814 -30.477 1.998 156 HH TYR 20 HH TYR 20 -3.486 -30.690 -1.326 157 H ARG 21 H ARG 21 -0.666 -26.351 5.571 158 HA ARG 21 HA ARG 21 -1.735 -23.971 6.658 159 HB2 ARG 21 HB2 ARG 21 -0.452 -26.317 7.592 160 HB3 ARG 21 HB3 ARG 21 0.567 -24.984 8.156 161 HG2 ARG 21 HG2 ARG 21 -2.424 -25.311 8.614 162 HG3 ARG 21 HG3 ARG 21 -1.143 -25.545 9.813 163 HD2 ARG 21 HD2 ARG 21 -0.503 -23.161 9.606 164 HD3 ARG 21 HD3 ARG 21 -1.790 -22.917 8.412 165 HE ARG 21 HE ARG 21 -2.082 -23.160 11.316 166 HH11 ARG 21 HH11 ARG 21 -3.736 -23.370 8.189 167 HH12 ARG 21 HH12 ARG 21 -5.330 -23.153 8.904 168 HH21 ARG 21 HH21 ARG 21 -4.202 -22.853 12.182 169 HH22 ARG 21 HH22 ARG 21 -5.575 -22.864 11.097 170 H GLU 22 H GLU 22 1.349 -24.579 5.088 171 HA GLU 22 HA GLU 22 2.585 -22.074 5.962 172 HB2 GLU 22 HB2 GLU 22 3.186 -23.873 3.583 173 HB3 GLU 22 HB3 GLU 22 4.279 -22.678 4.295 174 HG2 GLU 22 HG2 GLU 22 3.222 -25.128 5.771 175 HG3 GLU 22 HG3 GLU 22 4.740 -25.058 4.886 176 H ALA 23 H ALA 23 0.834 -23.371 3.198 177 HA ALA 23 HA ALA 23 1.230 -21.183 1.408 178 HB1 ALA 23 HB1 ALA 23 -0.437 -22.316 0.059 179 HB2 ALA 23 HB2 ALA 23 0.738 -23.478 0.728 180 HB3 ALA 23 HB3 ALA 23 -0.889 -23.345 1.432 181 H VAL 24 H VAL 24 -0.965 -21.479 4.124 182 HA VAL 24 HA VAL 24 -2.997 -19.631 3.079 183 HB VAL 24 HB VAL 24 -2.116 -20.392 5.912 184 HG11 VAL 24 HG11 VAL 24 -4.666 -19.000 4.959 185 HG12 VAL 24 HG12 VAL 24 -4.323 -19.517 6.626 186 HG13 VAL 24 HG13 VAL 24 -3.343 -18.242 5.883 187 HG21 VAL 24 HG21 VAL 24 -3.072 -22.318 4.618 188 HG22 VAL 24 HG22 VAL 24 -4.160 -21.836 5.917 189 HG23 VAL 24 HG23 VAL 24 -4.506 -21.353 4.241 190 H HIS 25 H HIS 25 -0.212 -19.737 5.081 191 HA HIS 25 HA HIS 25 0.092 -17.003 5.853 192 HB2 HIS 25 HB2 HIS 25 1.108 -19.700 6.280 193 HB3 HIS 25 HB3 HIS 25 2.416 -18.618 6.095 194 HD2 HIS 25 HD2 HIS 25 2.906 -17.026 8.263 195 HE1 HIS 25 HE1 HIS 25 -0.535 -18.110 10.529 196 HE2 HIS 25 HE2 HIS 25 1.685 -16.826 10.569 197 H CYS 26 H CYS 26 0.281 -18.172 2.840 198 HA CYS 26 HA CYS 26 2.687 -16.584 2.066 199 HB2 CYS 26 HB2 CYS 26 1.407 -19.056 0.858 200 HB3 CYS 26 HB3 CYS 26 2.520 -18.003 -0.028 201 HG CYS 26 HG CYS 26 2.996 -19.492 2.886 202 H TYR 27 H TYR 27 -0.632 -16.517 2.124 203 HA TYR 27 HA TYR 27 -0.703 -14.592 -0.166 204 HB2 TYR 27 HB2 TYR 27 -2.980 -16.296 0.831 205 HB3 TYR 27 HB3 TYR 27 -2.984 -15.292 -0.620 206 HD1 TYR 27 HD2 TYR 27 -0.455 -16.153 -1.958 207 HD2 TYR 27 HD1 TYR 27 -3.379 -18.416 0.216 208 HE1 TYR 27 HE2 TYR 27 0.125 -18.167 -3.289 209 HE2 TYR 27 HE1 TYR 27 -2.809 -20.443 -1.111 210 HH TYR 27 HH TYR 27 -1.526 -21.310 -2.792 211 H ASP 28 H ASP 28 -1.011 -15.066 3.189 212 HA ASP 28 HA ASP 28 -3.198 -13.285 3.755 213 HB2 ASP 28 HB2 ASP 28 -2.255 -15.118 5.203 214 HB3 ASP 28 HB3 ASP 28 -0.830 -14.121 5.477 215 H GLN 29 H GLN 29 0.225 -12.819 3.046 216 HA GLN 29 HA GLN 29 0.504 -10.316 4.413 217 HB2 GLN 29 HB2 GLN 29 2.598 -10.152 3.413 218 HB3 GLN 29 HB3 GLN 29 2.366 -11.873 3.747 219 HG2 GLN 29 HG2 GLN 29 1.824 -10.515 1.100 220 HG3 GLN 29 HG3 GLN 29 3.360 -11.284 1.481 221 HE21 GLN 29 HE22 GLN 29 1.726 -11.961 -0.727 222 HE22 GLN 29 HE21 GLN 29 1.173 -13.607 -0.565 223 H LEU 30 H LEU 30 -1.315 -11.147 1.711 224 HA LEU 30 HA LEU 30 -1.012 -8.587 0.269 225 HB2 LEU 30 HB2 LEU 30 -2.974 -10.899 -0.061 226 HB3 LEU 30 HB3 LEU 30 -2.604 -9.647 -1.257 227 HG LEU 30 HG LEU 30 -0.774 -11.824 -0.190 228 HD11 LEU 30 HD11 LEU 30 -0.839 -12.560 -2.531 229 HD12 LEU 30 HD12 LEU 30 -2.417 -12.638 -1.744 230 HD13 LEU 30 HD13 LEU 30 -2.051 -11.315 -2.886 231 HD21 LEU 30 HD21 LEU 30 0.867 -11.012 -1.864 232 HD22 LEU 30 HD22 LEU 30 -0.206 -9.663 -2.231 233 HD23 LEU 30 HD23 LEU 30 0.544 -9.775 -0.629 234 H ILE 31 H ILE 31 -3.319 -10.296 2.365 235 HA ILE 31 HA ILE 31 -5.338 -8.241 2.216 236 HB ILE 31 HB ILE 31 -4.801 -10.493 4.193 237 HG12 ILE 31 HG12 ILE 31 -6.811 -10.575 1.923 238 HG13 ILE 31 HG13 ILE 31 -5.152 -11.057 1.668 239 HG21 ILE 31 HG21 ILE 31 -6.366 -8.895 5.168 240 HG22 ILE 31 HG22 ILE 31 -7.336 -8.900 3.680 241 HG23 ILE 31 HG23 ILE 31 -7.244 -10.351 4.695 242 HD11 ILE 31 HD11 ILE 31 -5.262 -12.664 3.487 243 HD12 ILE 31 HD12 ILE 31 -6.993 -12.293 3.706 244 HD13 ILE 31 HD13 ILE 31 -6.427 -13.016 2.178 245 H THR 32 H THR 32 -2.344 -8.660 3.764 246 HA THR 32 HA THR 32 -2.879 -6.708 5.936 247 HB THR 32 HB THR 32 -0.443 -8.413 5.299 248 HG1 THR 32 HG1 THR 32 -2.190 -9.670 5.892 249 HG21 THR 32 HG21 THR 32 -1.175 -6.755 7.742 250 HG22 THR 32 HG22 THR 32 0.135 -7.959 7.699 251 HG23 THR 32 HG23 THR 32 0.217 -6.522 6.660 252 H ALA 33 H ALA 33 -1.587 -6.797 2.697 253 HA ALA 33 HA ALA 33 -0.037 -4.331 3.307 254 HB1 ALA 33 HB1 ALA 33 0.420 -6.339 1.059 255 HB2 ALA 33 HB2 ALA 33 1.394 -4.903 1.386 256 HB3 ALA 33 HB3 ALA 33 1.365 -6.232 2.564 257 H GLN 34 H GLN 34 -2.193 -5.877 0.878 258 HA GLN 34 HA GLN 34 -3.074 -3.217 0.012 259 HB2 GLN 34 HB2 GLN 34 -2.046 -5.256 -1.970 260 HB3 GLN 34 HB3 GLN 34 -2.665 -3.670 -2.360 261 HG2 GLN 34 HG2 GLN 34 -0.103 -4.214 -0.802 262 HG3 GLN 34 HG3 GLN 34 -0.197 -3.834 -2.513 263 HE21 GLN 34 HE22 GLN 34 1.371 -2.240 -0.947 264 HE22 GLN 34 HE21 GLN 34 0.618 -0.671 -0.744 265 HA PRO 35 HA PRO 35 -6.138 -6.700 0.484 266 HB2 PRO 35 HB2 PRO 35 -7.897 -5.442 2.161 267 HB3 PRO 35 HB3 PRO 35 -6.377 -6.211 2.716 268 HG2 PRO 35 HG2 PRO 35 -6.832 -3.290 2.086 269 HG3 PRO 35 HG3 PRO 35 -6.103 -4.000 3.572 270 HD2 PRO 35 HD2 PRO 35 -4.554 -3.088 1.538 271 HD3 PRO 35 HD3 PRO 35 -4.127 -4.592 2.426 272 H GLN 36 H GLN 36 -6.093 -3.764 -1.151 273 HA GLN 36 HA GLN 36 -8.936 -3.472 -1.608 274 HB2 GLN 36 HB2 GLN 36 -6.959 -2.210 -3.470 275 HB3 GLN 36 HB3 GLN 36 -8.436 -1.568 -2.759 276 HG2 GLN 36 HG2 GLN 36 -6.790 -0.348 -1.663 277 HG3 GLN 36 HG3 GLN 36 -7.113 -1.645 -0.501 278 HE21 GLN 36 HE22 GLN 36 -4.744 -0.530 -0.065 279 HE22 GLN 36 HE21 GLN 36 -3.416 -1.464 -0.765 280 H ASN 37 H ASN 37 -7.164 -5.968 -2.480 281 HA ASN 37 HA ASN 37 -8.343 -6.159 -5.207 282 HB2 ASN 37 HB2 ASN 37 -5.520 -6.926 -4.369 283 HB3 ASN 37 HB3 ASN 37 -6.246 -7.288 -5.940 284 HD21 ASN 37 HD22 ASN 37 -4.947 -4.740 -3.845 285 HD22 ASN 37 HD21 ASN 37 -4.860 -3.514 -5.083 286 HA PRO 38 HA PRO 38 -9.976 -9.872 -3.483 287 HB2 PRO 38 HB2 PRO 38 -11.018 -10.995 -5.690 288 HB3 PRO 38 HB3 PRO 38 -11.581 -9.395 -5.141 289 HG2 PRO 38 HG2 PRO 38 -9.446 -9.904 -7.236 290 HG3 PRO 38 HG3 PRO 38 -10.953 -8.938 -7.418 291 HD2 PRO 38 HD2 PRO 38 -8.695 -7.658 -6.711 292 HD3 PRO 38 HD3 PRO 38 -10.202 -7.314 -5.905 293 H VAL 39 H VAL 39 -7.273 -9.936 -5.743 294 HA VAL 39 HA VAL 39 -7.158 -12.762 -6.138 295 HB VAL 39 HB VAL 39 -5.991 -11.055 -7.488 296 HG11 VAL 39 HG11 VAL 39 -4.005 -10.939 -5.178 297 HG12 VAL 39 HG12 VAL 39 -3.840 -10.154 -6.762 298 HG13 VAL 39 HG13 VAL 39 -5.112 -9.626 -5.644 299 HG21 VAL 39 HG21 VAL 39 -3.993 -12.396 -7.875 300 HG22 VAL 39 HG22 VAL 39 -4.166 -13.172 -6.278 301 HG23 VAL 39 HG23 VAL 39 -5.384 -13.454 -7.538 302 H GLY 40 H GLY 40 -5.923 -10.619 -3.586 303 HA2 GLY 40 HA2 GLY 40 -4.452 -12.474 -2.035 304 HA3 GLY 40 HA3 GLY 40 -5.252 -11.014 -1.442 305 H TYR 41 H TYR 41 -7.833 -12.338 -2.670 306 HA TYR 41 HA TYR 41 -8.350 -14.274 -0.475 307 HB2 TYR 41 HB2 TYR 41 -10.572 -12.709 -1.751 308 HB3 TYR 41 HB3 TYR 41 -10.531 -13.480 -0.244 309 HD1 TYR 41 HD2 TYR 41 -8.866 -10.554 -1.904 310 HD2 TYR 41 HD1 TYR 41 -10.334 -12.314 1.723 311 HE1 TYR 41 HE2 TYR 41 -8.429 -8.430 -0.705 312 HE2 TYR 41 HE1 TYR 41 -9.899 -10.200 2.932 313 HH TYR 41 HH TYR 41 -9.164 -8.031 2.785 314 H SER 42 H SER 42 -7.329 -14.561 -3.336 315 HA SER 42 HA SER 42 -9.496 -16.360 -4.307 316 HB2 SER 42 HB2 SER 42 -9.106 -14.305 -5.705 317 HB3 SER 42 HB3 SER 42 -7.455 -14.883 -5.999 318 HG SER 42 HG SER 42 -8.886 -15.535 -7.657 319 H ASN 43 H ASN 43 -6.549 -16.263 -2.819 320 HA ASN 43 HA ASN 43 -5.895 -18.995 -3.812 321 HB2 ASN 43 HB2 ASN 43 -3.991 -16.714 -3.142 322 HB3 ASN 43 HB3 ASN 43 -3.512 -18.398 -3.365 323 HD21 ASN 43 HD22 ASN 43 -3.248 -19.233 -5.424 324 HD22 ASN 43 HD21 ASN 43 -3.518 -18.292 -6.875 325 H LYS 44 H LYS 44 -5.795 -16.599 -1.081 326 HA LYS 44 HA LYS 44 -5.239 -18.644 0.894 327 HB2 LYS 44 HB2 LYS 44 -4.946 -16.171 1.204 328 HB3 LYS 44 HB3 LYS 44 -6.672 -15.970 1.142 329 HG2 LYS 44 HG2 LYS 44 -6.931 -17.444 3.130 330 HG3 LYS 44 HG3 LYS 44 -5.175 -17.710 3.162 331 HD2 LYS 44 HD2 LYS 44 -4.771 -15.347 3.632 332 HD3 LYS 44 HD3 LYS 44 -6.496 -14.993 3.416 333 HE2 LYS 44 HE2 LYS 44 -7.010 -16.572 5.299 334 HE3 LYS 44 HE3 LYS 44 -5.267 -16.733 5.586 335 HZ1 LYS 44 HZ1 LYS 44 -6.818 -14.229 5.732 336 HZ2 LYS 44 HZ2 LYS 44 -6.256 -15.093 7.017 337 HZ3 LYS 44 HZ3 LYS 44 -5.196 -14.348 5.998 338 H ALA 45 H ALA 45 -8.139 -17.118 -0.431 339 HA ALA 45 HA ALA 45 -10.066 -18.659 1.026 340 HB1 ALA 45 HB1 ALA 45 -10.349 -17.432 -1.746 341 HB2 ALA 45 HB2 ALA 45 -11.651 -17.802 -0.606 342 HB3 ALA 45 HB3 ALA 45 -10.497 -16.490 -0.239 343 H MET 46 H MET 46 -7.745 -19.920 -0.914 344 HA MET 46 HA MET 46 -9.480 -22.148 -1.819 345 HB2 MET 46 HB2 MET 46 -8.649 -20.273 -3.579 346 HB3 MET 46 HB3 MET 46 -7.189 -21.276 -3.562 347 HG2 MET 46 HG2 MET 46 -8.693 -21.990 -5.344 348 HG3 MET 46 HG3 MET 46 -8.602 -23.264 -4.114 349 HE1 MET 46 HE1 MET 46 -12.250 -23.500 -5.563 350 HE2 MET 46 HE2 MET 46 -10.786 -23.020 -6.449 351 HE3 MET 46 HE3 MET 46 -10.713 -24.359 -5.280 352 H ALA 47 H ALA 47 -7.023 -21.229 0.145 353 HA ALA 47 HA ALA 47 -5.839 -23.965 0.041 354 HB1 ALA 47 HB1 ALA 47 -4.198 -22.294 -0.763 355 HB2 ALA 47 HB2 ALA 47 -4.434 -21.336 0.721 356 HB3 ALA 47 HB3 ALA 47 -3.706 -22.958 0.814 357 H LEU 48 H LEU 48 -7.146 -21.267 1.938 358 HA LEU 48 HA LEU 48 -6.646 -22.523 4.493 359 HB2 LEU 48 HB2 LEU 48 -6.911 -20.092 4.152 360 HB3 LEU 48 HB3 LEU 48 -8.574 -20.345 3.596 361 HG LEU 48 HG LEU 48 -9.266 -21.111 5.785 362 HD11 LEU 48 HD11 LEU 48 -6.344 -20.764 6.597 363 HD12 LEU 48 HD12 LEU 48 -7.687 -21.060 7.719 364 HD13 LEU 48 HD13 LEU 48 -7.240 -22.301 6.537 365 HD21 LEU 48 HD21 LEU 48 -7.488 -18.633 5.925 366 HD22 LEU 48 HD22 LEU 48 -9.162 -18.672 5.327 367 HD23 LEU 48 HD23 LEU 48 -8.816 -19.004 7.042 368 H ILE 49 H ILE 49 -9.096 -22.679 1.954 369 HA ILE 49 HA ILE 49 -11.093 -24.104 3.436 370 HB ILE 49 HB ILE 49 -11.837 -24.887 1.199 371 HG12 ILE 49 HG12 ILE 49 -9.641 -23.151 0.102 372 HG13 ILE 49 HG13 ILE 49 -9.393 -24.856 0.297 373 HG21 ILE 49 HG21 ILE 49 -12.477 -22.659 0.364 374 HG22 ILE 49 HG22 ILE 49 -12.627 -22.743 2.126 375 HG23 ILE 49 HG23 ILE 49 -11.239 -21.909 1.385 376 HD11 ILE 49 HD11 ILE 49 -11.233 -25.466 -1.067 377 HD12 ILE 49 HD12 ILE 49 -11.628 -23.740 -1.376 378 HD13 ILE 49 HD13 ILE 49 -10.100 -24.441 -1.969 379 H LYS 50 H LYS 50 -8.034 -24.916 2.008 380 HA LYS 50 HA LYS 50 -8.631 -27.619 1.336 381 HB2 LYS 50 HB2 LYS 50 -6.729 -25.818 0.599 382 HB3 LYS 50 HB3 LYS 50 -5.803 -26.753 1.774 383 HG2 LYS 50 HG2 LYS 50 -5.377 -27.918 -0.163 384 HG3 LYS 50 HG3 LYS 50 -6.793 -28.827 0.398 385 HD2 LYS 50 HD2 LYS 50 -6.730 -26.572 -1.655 386 HD3 LYS 50 HD3 LYS 50 -6.906 -28.302 -2.011 387 HE2 LYS 50 HE2 LYS 50 -9.053 -28.226 -0.637 388 HE3 LYS 50 HE3 LYS 50 -8.876 -26.452 -0.606 389 HZ1 LYS 50 HZ1 LYS 50 -9.081 -28.121 -3.025 390 HZ2 LYS 50 HZ2 LYS 50 -10.281 -27.186 -2.407 391 HZ3 LYS 50 HZ3 LYS 50 -8.917 -26.482 -3.005 392 H LEU 51 H LEU 51 -8.381 -26.255 4.314 393 HA LEU 51 HA LEU 51 -7.015 -28.572 5.587 394 HB2 LEU 51 HB2 LEU 51 -7.085 -25.626 6.314 395 HB3 LEU 51 HB3 LEU 51 -6.491 -26.875 7.416 396 HG LEU 51 HG LEU 51 -5.341 -26.499 4.632 397 HD11 LEU 51 HD11 LEU 51 -5.055 -24.436 5.952 398 HD12 LEU 51 HD12 LEU 51 -4.391 -25.385 7.304 399 HD13 LEU 51 HD13 LEU 51 -3.510 -25.282 5.760 400 HD21 LEU 51 HD21 LEU 51 -4.940 -28.700 5.683 401 HD22 LEU 51 HD22 LEU 51 -3.439 -27.758 5.687 402 HD23 LEU 51 HD23 LEU 51 -4.393 -27.902 7.178 403 H GLY 52 H GLY 52 -9.997 -27.046 5.121 404 HA2 GLY 52 HA2 GLY 52 -11.987 -27.984 5.958 405 HA3 GLY 52 HA3 GLY 52 -11.130 -28.549 7.400 406 H GLU 53 H GLU 53 -10.014 -25.459 7.154 407 HA GLU 53 HA GLU 53 -11.901 -24.543 9.179 408 HB2 GLU 53 HB2 GLU 53 -9.603 -22.916 8.056 409 HB3 GLU 53 HB3 GLU 53 -10.450 -22.745 9.578 410 HG2 GLU 53 HG2 GLU 53 -9.624 -24.959 10.317 411 HG3 GLU 53 HG3 GLU 53 -8.701 -25.111 8.809 412 H TYR 54 H TYR 54 -13.432 -24.870 7.011 413 HA TYR 54 HA TYR 54 -13.590 -22.801 5.118 414 HB2 TYR 54 HB2 TYR 54 -15.745 -24.538 6.374 415 HB3 TYR 54 HB3 TYR 54 -16.014 -23.480 4.993 416 HD1 TYR 54 HD2 TYR 54 -14.760 -23.860 2.854 417 HD2 TYR 54 HD1 TYR 54 -14.762 -26.702 6.086 418 HE1 TYR 54 HE2 TYR 54 -14.002 -25.640 1.287 419 HE2 TYR 54 HE1 TYR 54 -13.995 -28.479 4.532 420 HH TYR 54 HH TYR 54 -13.416 -29.004 2.376 421 H THR 55 H THR 55 -14.581 -22.866 8.514 422 HA THR 55 HA THR 55 -16.381 -20.694 8.552 423 HB THR 55 HB THR 55 -14.249 -21.541 10.572 424 HG1 THR 55 HG1 THR 55 -15.990 -22.724 11.449 425 HG21 THR 55 HG21 THR 55 -15.865 -20.526 12.231 426 HG22 THR 55 HG22 THR 55 -15.165 -19.323 11.124 427 HG23 THR 55 HG23 THR 55 -16.821 -19.907 10.861 428 H GLN 56 H GLN 56 -12.906 -20.810 8.095 429 HA GLN 56 HA GLN 56 -12.610 -17.903 8.575 430 HB2 GLN 56 HB2 GLN 56 -10.534 -20.078 8.072 431 HB3 GLN 56 HB3 GLN 56 -10.224 -18.428 8.668 432 HG2 GLN 56 HG2 GLN 56 -11.400 -18.915 10.741 433 HG3 GLN 56 HG3 GLN 56 -11.924 -20.484 10.144 434 HE21 GLN 56 HE22 GLN 56 -11.008 -21.525 11.938 435 HE22 GLN 56 HE21 GLN 56 -9.287 -21.845 11.971 436 H ALA 57 H ALA 57 -13.568 -19.784 6.064 437 HA ALA 57 HA ALA 57 -11.859 -18.374 4.057 438 HB1 ALA 57 HB1 ALA 57 -13.284 -21.057 3.889 439 HB2 ALA 57 HB2 ALA 57 -12.299 -20.301 2.606 440 HB3 ALA 57 HB3 ALA 57 -11.538 -20.815 4.128 441 H ILE 58 H ILE 58 -15.212 -19.352 4.942 442 HA ILE 58 HA ILE 58 -16.479 -18.038 2.671 443 HB ILE 58 HB ILE 58 -17.432 -18.482 5.580 444 HG12 ILE 58 HG12 ILE 58 -17.881 -20.289 3.180 445 HG13 ILE 58 HG13 ILE 58 -16.658 -20.594 4.413 446 HG21 ILE 58 HG21 ILE 58 -18.842 -16.935 4.117 447 HG22 ILE 58 HG22 ILE 58 -19.126 -18.361 3.065 448 HG23 ILE 58 HG23 ILE 58 -19.686 -18.360 4.743 449 HD11 ILE 58 HD11 ILE 58 -18.620 -21.898 4.969 450 HD12 ILE 58 HD12 ILE 58 -18.434 -20.593 6.166 451 HD13 ILE 58 HD13 ILE 58 -19.660 -20.470 4.877 452 H GLN 59 H GLN 59 -15.312 -16.955 5.918 453 HA GLN 59 HA GLN 59 -16.422 -14.316 5.623 454 HB2 GLN 59 HB2 GLN 59 -15.739 -15.356 7.788 455 HB3 GLN 59 HB3 GLN 59 -14.044 -15.324 7.255 456 HG2 GLN 59 HG2 GLN 59 -14.134 -12.853 7.100 457 HG3 GLN 59 HG3 GLN 59 -15.831 -12.886 7.566 458 HE21 GLN 59 HE22 GLN 59 -15.278 -11.492 9.372 459 HE22 GLN 59 HE21 GLN 59 -14.544 -12.171 10.809 460 H MET 60 H MET 60 -13.456 -15.978 4.602 461 HA MET 60 HA MET 60 -12.071 -13.599 3.764 462 HB2 MET 60 HB2 MET 60 -11.161 -15.976 4.367 463 HB3 MET 60 HB3 MET 60 -11.660 -16.418 2.728 464 HG2 MET 60 HG2 MET 60 -9.473 -15.853 2.381 465 HG3 MET 60 HG3 MET 60 -10.231 -14.303 2.048 466 HE1 MET 60 HE1 MET 60 -10.251 -12.278 3.850 467 HE2 MET 60 HE2 MET 60 -10.810 -13.282 5.223 468 HE3 MET 60 HE3 MET 60 -9.333 -12.289 5.357 469 H CYS 61 H CYS 61 -14.407 -15.807 2.269 470 HA CYS 61 HA CYS 61 -13.894 -14.895 -0.415 471 HB2 CYS 61 HB2 CYS 61 -16.263 -16.333 0.891 472 HB3 CYS 61 HB3 CYS 61 -16.189 -15.968 -0.828 473 HG CYS 61 HG CYS 61 -13.932 -17.603 0.940 474 H GLN 62 H GLN 62 -16.535 -14.097 1.985 475 HA GLN 62 HA GLN 62 -17.649 -12.051 0.286 476 HB2 GLN 62 HB2 GLN 62 -17.754 -12.342 3.335 477 HB3 GLN 62 HB3 GLN 62 -18.884 -11.415 2.322 478 HG2 GLN 62 HG2 GLN 62 -19.707 -13.459 1.283 479 HG3 GLN 62 HG3 GLN 62 -18.476 -14.424 2.102 480 HE21 GLN 62 HE22 GLN 62 -20.173 -15.721 2.923 481 HE22 GLN 62 HE21 GLN 62 -21.156 -15.145 4.242 482 H GLN 63 H GLN 63 -14.663 -12.102 1.907 483 HA GLN 63 HA GLN 63 -14.575 -9.147 2.197 484 HB2 GLN 63 HB2 GLN 63 -12.809 -11.445 3.102 485 HB3 GLN 63 HB3 GLN 63 -12.239 -9.771 3.137 486 HG2 GLN 63 HG2 GLN 63 -14.853 -10.513 4.464 487 HG3 GLN 63 HG3 GLN 63 -13.303 -10.777 5.275 488 HE21 GLN 63 HE22 GLN 63 -12.430 -9.133 6.393 489 HE22 GLN 63 HE21 GLN 63 -12.875 -7.448 6.232 490 H GLY 64 H GLY 64 -14.180 -11.415 -0.205 491 HA2 GLY 64 HA2 GLY 64 -11.945 -9.896 -1.497 492 HA3 GLY 64 HA3 GLY 64 -12.322 -11.600 -1.785 493 H LEU 65 H LEU 65 -15.234 -11.322 -1.904 494 HA LEU 65 HA LEU 65 -15.517 -10.385 -4.607 495 HB2 LEU 65 HB2 LEU 65 -17.490 -11.217 -2.446 496 HB3 LEU 65 HB3 LEU 65 -18.033 -10.625 -3.989 497 HG LEU 65 HG LEU 65 -17.983 -12.880 -4.534 498 HD11 LEU 65 HD11 LEU 65 -15.058 -12.372 -4.948 499 HD12 LEU 65 HD12 LEU 65 -16.093 -13.565 -5.755 500 HD13 LEU 65 HD13 LEU 65 -16.354 -11.834 -6.041 501 HD21 LEU 65 HD21 LEU 65 -17.324 -13.356 -2.159 502 HD22 LEU 65 HD22 LEU 65 -16.863 -14.527 -3.391 503 HD23 LEU 65 HD23 LEU 65 -15.645 -13.381 -2.763 504 H ARG 66 H ARG 66 -15.058 -8.605 -1.836 505 HA ARG 66 HA ARG 66 -16.760 -6.323 -2.467 506 HB2 ARG 66 HB2 ARG 66 -14.291 -6.510 -0.688 507 HB3 ARG 66 HB3 ARG 66 -15.531 -5.248 -0.666 508 HG2 ARG 66 HG2 ARG 66 -17.212 -6.965 0.034 509 HG3 ARG 66 HG3 ARG 66 -15.915 -8.169 0.070 510 HD2 ARG 66 HD2 ARG 66 -16.307 -7.320 2.333 511 HD3 ARG 66 HD3 ARG 66 -14.712 -6.781 1.755 512 HE ARG 66 HE ARG 66 -16.641 -4.788 1.105 513 HH11 ARG 66 HH11 ARG 66 -15.081 -6.212 3.949 514 HH12 ARG 66 HH12 ARG 66 -15.205 -4.740 4.889 515 HH21 ARG 66 HH21 ARG 66 -16.803 -2.896 2.366 516 HH22 ARG 66 HH22 ARG 66 -16.198 -2.873 4.001 517 H TYR 67 H TYR 67 -14.188 -7.622 -4.072 518 HA TYR 67 HA TYR 67 -12.975 -5.003 -4.808 519 HB2 TYR 67 HB2 TYR 67 -11.549 -7.522 -3.957 520 HB3 TYR 67 HB3 TYR 67 -10.746 -6.101 -4.599 521 HD1 TYR 67 HD1 TYR 67 -11.559 -3.804 -3.356 522 HD2 TYR 67 HD2 TYR 67 -11.525 -7.753 -1.644 523 HE1 TYR 67 HE1 TYR 67 -11.505 -2.814 -1.075 524 HE2 TYR 67 HE2 TYR 67 -11.487 -6.773 0.628 525 HH TYR 67 HH TYR 67 -11.479 -3.217 1.176 526 H THR 68 H THR 68 -14.864 -7.219 -5.980 527 HA THR 68 HA THR 68 -13.340 -7.694 -8.493 528 HB THR 68 HB THR 68 -15.002 -9.535 -8.842 529 HG1 THR 68 HG1 THR 68 -16.632 -8.758 -7.462 530 HG21 THR 68 HG21 THR 68 -12.775 -9.957 -7.875 531 HG22 THR 68 HG22 THR 68 -13.428 -9.646 -6.245 532 HG23 THR 68 HG23 THR 68 -13.995 -11.042 -7.181 533 H SER 69 H SER 69 -14.847 -5.245 -7.609 534 HA SER 69 HA SER 69 -17.307 -5.063 -9.061 535 HB2 SER 69 HB2 SER 69 -15.381 -2.928 -8.058 536 HB3 SER 69 HB3 SER 69 -17.051 -2.643 -8.581 537 HG SER 69 HG SER 69 -16.863 -2.900 -6.309 538 H THR 70 H THR 70 -14.471 -5.663 -10.560 539 HA THR 70 HA THR 70 -15.208 -4.046 -12.910 540 HB THR 70 HB THR 70 -13.738 -2.524 -11.789 541 HG1 THR 70 HG1 THR 70 -12.095 -2.403 -13.314 542 HG21 THR 70 HG21 THR 70 -11.784 -4.856 -11.583 543 HG22 THR 70 HG22 THR 70 -11.406 -3.157 -11.185 544 HG23 THR 70 HG23 THR 70 -12.611 -4.043 -10.227 545 H ALA 71 H ALA 71 -13.815 -4.583 -14.793 546 HA ALA 71 HA ALA 71 -14.045 -7.366 -15.298 547 HB1 ALA 71 HB1 ALA 71 -12.650 -5.138 -16.841 548 HB2 ALA 71 HB2 ALA 71 -13.118 -6.728 -17.502 549 HB3 ALA 71 HB3 ALA 71 -14.372 -5.575 -16.963 550 H GLU 72 H GLU 72 -11.440 -5.616 -13.820 551 HA GLU 72 HA GLU 72 -9.246 -7.212 -14.743 552 HB2 GLU 72 HB2 GLU 72 -9.672 -5.747 -12.140 553 HB3 GLU 72 HB3 GLU 72 -8.128 -6.427 -12.669 554 HG2 GLU 72 HG2 GLU 72 -8.198 -4.982 -14.683 555 HG3 GLU 72 HG3 GLU 72 -9.698 -4.247 -14.088 556 H HIS 73 H HIS 73 -11.974 -8.102 -12.962 557 HA HIS 73 HA HIS 73 -10.620 -10.487 -11.823 558 HB2 HIS 73 HB2 HIS 73 -12.632 -8.880 -10.234 559 HB3 HIS 73 HB3 HIS 73 -11.508 -10.106 -9.662 560 HD2 HIS 73 HD2 HIS 73 -11.963 -6.462 -9.765 561 HE1 HIS 73 HE1 HIS 73 -7.760 -6.914 -9.348 562 HE2 HIS 73 HE2 HIS 73 -9.700 -5.262 -9.223 563 H VAL 74 H VAL 74 -12.428 -9.961 -14.153 564 HA VAL 74 HA VAL 74 -15.125 -10.349 -13.661 565 HB VAL 74 HB VAL 74 -13.964 -9.728 -15.786 566 HG11 VAL 74 HG11 VAL 74 -13.637 -12.731 -16.152 567 HG12 VAL 74 HG12 VAL 74 -13.265 -11.480 -17.346 568 HG13 VAL 74 HG13 VAL 74 -12.314 -11.575 -15.851 569 HG21 VAL 74 HG21 VAL 74 -16.011 -11.958 -16.067 570 HG22 VAL 74 HG22 VAL 74 -16.383 -10.253 -15.706 571 HG23 VAL 74 HG23 VAL 74 -15.650 -10.706 -17.265 572 H ALA 75 H ALA 75 -12.621 -12.773 -13.405 573 HA ALA 75 HA ALA 75 -14.720 -14.904 -13.231 574 HB1 ALA 75 HB1 ALA 75 -11.690 -15.122 -13.452 575 HB2 ALA 75 HB2 ALA 75 -12.838 -16.471 -13.438 576 HB3 ALA 75 HB3 ALA 75 -12.847 -15.312 -14.790 577 H ILE 76 H ILE 76 -12.076 -13.320 -11.353 578 HA ILE 76 HA ILE 76 -12.330 -15.010 -9.072 579 HB ILE 76 HB ILE 76 -11.509 -12.097 -9.314 580 HG12 ILE 76 HG12 ILE 76 -9.898 -14.680 -9.130 581 HG13 ILE 76 HG13 ILE 76 -10.068 -13.663 -10.562 582 HG21 ILE 76 HG21 ILE 76 -10.458 -12.394 -7.110 583 HG22 ILE 76 HG22 ILE 76 -12.201 -12.623 -7.000 584 HG23 ILE 76 HG23 ILE 76 -11.107 -14.035 -7.012 585 HD11 ILE 76 HD11 ILE 76 -8.660 -12.895 -7.981 586 HD12 ILE 76 HD12 ILE 76 -7.935 -13.174 -9.572 587 HD13 ILE 76 HD13 ILE 76 -8.993 -11.770 -9.323 588 H ARG 77 H ARG 77 -14.275 -12.408 -10.381 589 HA ARG 77 HA ARG 77 -15.870 -11.632 -8.215 590 HB2 ARG 77 HB2 ARG 77 -15.752 -10.632 -10.497 591 HB3 ARG 77 HB3 ARG 77 -16.589 -12.054 -11.142 592 HG2 ARG 77 HG2 ARG 77 -18.562 -11.515 -9.707 593 HG3 ARG 77 HG3 ARG 77 -17.708 -10.072 -9.112 594 HD2 ARG 77 HD2 ARG 77 -17.539 -9.235 -11.441 595 HD3 ARG 77 HD3 ARG 77 -18.331 -10.703 -12.024 596 HE ARG 77 HE ARG 77 -20.400 -9.913 -11.289 597 HH11 ARG 77 HH11 ARG 77 -17.825 -7.764 -10.156 598 HH12 ARG 77 HH12 ARG 77 -18.949 -6.518 -9.658 599 HH21 ARG 77 HH21 ARG 77 -21.824 -8.266 -10.627 600 HH22 ARG 77 HH22 ARG 77 -21.190 -6.798 -9.925 601 H SER 78 H SER 78 -15.735 -14.681 -9.859 602 HA SER 78 HA SER 78 -18.254 -15.565 -8.505 603 HB2 SER 78 HB2 SER 78 -17.150 -16.294 -11.245 604 HB3 SER 78 HB3 SER 78 -18.562 -17.070 -10.469 605 HG SER 78 HG SER 78 -19.159 -15.357 -11.882 606 H LYS 79 H LYS 79 -14.835 -16.035 -8.814 607 HA LYS 79 HA LYS 79 -14.979 -18.892 -8.235 608 HB2 LYS 79 HB2 LYS 79 -12.721 -16.886 -8.464 609 HB3 LYS 79 HB3 LYS 79 -12.454 -18.512 -7.861 610 HG2 LYS 79 HG2 LYS 79 -13.507 -17.775 -10.615 611 HG3 LYS 79 HG3 LYS 79 -11.926 -18.471 -10.212 612 HD2 LYS 79 HD2 LYS 79 -14.656 -19.793 -10.132 613 HD3 LYS 79 HD3 LYS 79 -13.222 -20.265 -11.044 614 HE2 LYS 79 HE2 LYS 79 -12.061 -20.715 -8.820 615 HE3 LYS 79 HE3 LYS 79 -13.628 -20.421 -8.031 616 HZ1 LYS 79 HZ1 LYS 79 -14.556 -22.229 -9.313 617 HZ2 LYS 79 HZ2 LYS 79 -13.117 -22.495 -10.060 618 HZ3 LYS 79 HZ3 LYS 79 -13.265 -22.756 -8.443 619 H LEU 80 H LEU 80 -15.169 -15.989 -6.211 620 HA LEU 80 HA LEU 80 -14.248 -17.643 -3.913 621 HB2 LEU 80 HB2 LEU 80 -14.983 -14.741 -4.362 622 HB3 LEU 80 HB3 LEU 80 -14.902 -15.443 -2.731 623 HG LEU 80 HG LEU 80 -12.565 -15.919 -2.973 624 HD11 LEU 80 HD11 LEU 80 -12.872 -14.843 -5.802 625 HD12 LEU 80 HD12 LEU 80 -11.315 -15.114 -4.989 626 HD13 LEU 80 HD13 LEU 80 -12.369 -16.487 -5.339 627 HD21 LEU 80 HD21 LEU 80 -13.226 -13.683 -2.239 628 HD22 LEU 80 HD22 LEU 80 -11.794 -13.533 -3.297 629 HD23 LEU 80 HD23 LEU 80 -13.408 -13.144 -3.922 630 H GLN 81 H GLN 81 -17.063 -16.286 -5.577 631 HA GLN 81 HA GLN 81 -19.047 -16.959 -3.646 632 HB2 GLN 81 HB2 GLN 81 -18.874 -16.406 -6.611 633 HB3 GLN 81 HB3 GLN 81 -20.335 -17.157 -6.009 634 HG2 GLN 81 HG2 GLN 81 -19.196 -14.510 -5.098 635 HG3 GLN 81 HG3 GLN 81 -20.687 -14.771 -6.018 636 HE21 GLN 81 HE22 GLN 81 -21.832 -16.951 -4.622 637 HE22 GLN 81 HE21 GLN 81 -22.204 -16.446 -2.982 638 H TYR 82 H TYR 82 -17.394 -18.772 -6.248 639 HA TYR 82 HA TYR 82 -19.086 -21.063 -6.302 640 HB2 TYR 82 HB2 TYR 82 -17.408 -20.664 -8.031 641 HB3 TYR 82 HB3 TYR 82 -16.134 -20.525 -6.826 642 HD1 TYR 82 HD1 TYR 82 -18.380 -22.943 -8.537 643 HD2 TYR 82 HD2 TYR 82 -14.977 -22.407 -5.960 644 HE1 TYR 82 HE1 TYR 82 -17.828 -25.351 -8.787 645 HE2 TYR 82 HE2 TYR 82 -14.422 -24.827 -6.200 646 HH TYR 82 HH TYR 82 -16.381 -27.041 -8.212 647 H ARG 83 H ARG 83 -16.296 -20.267 -4.130 648 HA ARG 83 HA ARG 83 -16.629 -22.921 -2.899 649 HB2 ARG 83 HB2 ARG 83 -14.545 -20.830 -2.969 650 HB3 ARG 83 HB3 ARG 83 -14.760 -21.573 -1.364 651 HG2 ARG 83 HG2 ARG 83 -14.399 -23.153 -3.940 652 HG3 ARG 83 HG3 ARG 83 -13.086 -22.751 -2.817 653 HD2 ARG 83 HD2 ARG 83 -14.153 -24.004 -1.026 654 HD3 ARG 83 HD3 ARG 83 -15.589 -24.297 -2.022 655 HE ARG 83 HE ARG 83 -13.246 -25.276 -3.352 656 HH11 ARG 83 HH11 ARG 83 -15.427 -26.011 -0.672 657 HH12 ARG 83 HH12 ARG 83 -15.137 -27.730 -0.754 658 HH21 ARG 83 HH21 ARG 83 -12.929 -27.543 -3.469 659 HH22 ARG 83 HH22 ARG 83 -13.714 -28.587 -2.314 660 H LEU 84 H LEU 84 -17.602 -19.598 -2.317 661 HA LEU 84 HA LEU 84 -18.402 -19.967 0.418 662 HB2 LEU 84 HB2 LEU 84 -18.129 -17.853 -1.060 663 HB3 LEU 84 HB3 LEU 84 -19.729 -18.214 -1.687 664 HG LEU 84 HG LEU 84 -18.951 -17.639 1.182 665 HD11 LEU 84 HD11 LEU 84 -18.864 -15.684 -0.259 666 HD12 LEU 84 HD12 LEU 84 -20.504 -16.024 -0.866 667 HD13 LEU 84 HD13 LEU 84 -20.260 -15.569 0.829 668 HD21 LEU 84 HD21 LEU 84 -21.436 -17.449 1.575 669 HD22 LEU 84 HD22 LEU 84 -21.686 -18.220 -0.010 670 HD23 LEU 84 HD23 LEU 84 -20.863 -19.094 1.310 671 H GLU 85 H GLU 85 -19.840 -20.490 -2.750 672 HA GLU 85 HA GLU 85 -22.429 -21.424 -1.969 673 HB2 GLU 85 HB2 GLU 85 -20.743 -21.373 -4.469 674 HB3 GLU 85 HB3 GLU 85 -22.234 -22.288 -4.482 675 HG2 GLU 85 HG2 GLU 85 -23.535 -20.340 -3.813 676 HG3 GLU 85 HG3 GLU 85 -22.070 -19.393 -3.561 677 H LEU 86 H LEU 86 -19.531 -22.931 -1.370 678 HA LEU 86 HA LEU 86 -20.864 -25.600 -1.388 679 HB2 LEU 86 HB2 LEU 86 -18.024 -24.934 -2.259 680 HB3 LEU 86 HB3 LEU 86 -18.595 -26.573 -1.942 681 HG LEU 86 HG LEU 86 -19.784 -24.729 -4.053 682 HD11 LEU 86 HD11 LEU 86 -17.880 -27.091 -4.295 683 HD12 LEU 86 HD12 LEU 86 -18.613 -26.205 -5.649 684 HD13 LEU 86 HD13 LEU 86 -17.468 -25.380 -4.575 685 HD21 LEU 86 HD21 LEU 86 -20.168 -27.695 -3.460 686 HD22 LEU 86 HD22 LEU 86 -21.391 -26.426 -3.241 687 HD23 LEU 86 HD23 LEU 86 -20.833 -26.829 -4.869 688 H ALA 87 H ALA 87 -18.796 -23.266 0.228 689 HA ALA 87 HA ALA 87 -17.801 -25.012 2.264 690 HB1 ALA 87 HB1 ALA 87 -17.368 -22.844 3.434 691 HB2 ALA 87 HB2 ALA 87 -16.817 -22.815 1.753 692 HB3 ALA 87 HB3 ALA 87 -18.341 -22.010 2.197 693 H GLN 88 H GLN 88 -20.916 -23.406 1.733 694 HA GLN 88 HA GLN 88 -21.831 -23.526 4.449 695 HB2 GLN 88 HB2 GLN 88 -23.247 -23.266 1.766 696 HB3 GLN 88 HB3 GLN 88 -24.052 -23.118 3.336 697 HG2 GLN 88 HG2 GLN 88 -22.551 -21.255 3.961 698 HG3 GLN 88 HG3 GLN 88 -21.740 -21.375 2.397 699 HE21 GLN 88 HE22 GLN 88 -23.093 -19.034 3.464 700 HE22 GLN 88 HE21 GLN 88 -24.425 -18.687 2.392 701 H GLY 89 H GLY 89 -20.906 -26.010 2.585 702 HA2 GLY 89 HA2 GLY 89 -22.898 -27.879 3.775 703 HA3 GLY 89 HA3 GLY 89 -22.302 -28.059 2.105 704 H ALA 90 H ALA 90 -19.972 -26.780 4.279 705 HA ALA 90 HA ALA 90 -18.883 -29.432 5.013 706 HB1 ALA 90 HB1 ALA 90 -16.686 -28.851 4.060 707 HB2 ALA 90 HB2 ALA 90 -17.930 -28.891 2.795 708 HB3 ALA 90 HB3 ALA 90 -17.360 -27.323 3.417 709 H VAL 91 H VAL 91 -19.445 -26.108 5.688 710 HA VAL 91 HA VAL 91 -17.352 -25.773 7.676 711 HB VAL 91 HB VAL 91 -18.459 -23.983 6.289 712 HG11 VAL 91 HG11 VAL 91 -20.590 -23.052 7.014 713 HG12 VAL 91 HG12 VAL 91 -20.807 -24.741 6.522 714 HG13 VAL 91 HG13 VAL 91 -20.761 -24.322 8.244 715 HG21 VAL 91 HG21 VAL 91 -17.140 -23.486 8.319 716 HG22 VAL 91 HG22 VAL 91 -18.437 -22.303 8.048 717 HG23 VAL 91 HG23 VAL 91 -18.622 -23.553 9.294 718 H GLY 92 H GLY 92 -20.332 -27.393 7.557 719 HA2 GLY 92 HA2 GLY 92 -20.333 -27.827 10.471 720 HA3 GLY 92 HA3 GLY 92 -21.785 -27.067 9.794 721 H SER 93 H SER 93 -19.949 -29.388 7.881 722 HA SER 93 HA SER 93 -21.797 -31.611 8.551 723 HB2 SER 93 HB2 SER 93 -21.291 -30.575 5.739 724 HB3 SER 93 HB3 SER 93 -22.241 -32.007 6.182 725 HG SER 93 HG SER 93 -23.579 -30.177 5.831 726 H VAL 94 H VAL 94 -21.096 -33.607 7.140 727 HA VAL 94 HA VAL 94 -18.177 -33.740 6.864 728 HB VAL 94 HB VAL 94 -19.707 -35.503 8.785 729 HG11 VAL 94 HG11 VAL 94 -17.463 -36.344 9.378 730 HG12 VAL 94 HG12 VAL 94 -17.815 -36.614 7.655 731 HG13 VAL 94 HG13 VAL 94 -16.737 -35.280 8.142 732 HG21 VAL 94 HG21 VAL 94 -19.451 -33.275 9.770 733 HG22 VAL 94 HG22 VAL 94 -18.340 -34.416 10.554 734 HG23 VAL 94 HG23 VAL 94 -17.720 -33.268 9.356 735 H GLN 95 H GLN 95 -17.948 -34.631 4.992 736 HA GLN 95 HA GLN 95 -19.473 -37.093 4.309 737 HB2 GLN 95 HB2 GLN 95 -19.631 -36.339 1.990 738 HB3 GLN 95 HB3 GLN 95 -20.479 -35.231 3.074 739 HG2 GLN 95 HG2 GLN 95 -17.642 -34.712 2.122 740 HG3 GLN 95 HG3 GLN 95 -19.062 -34.203 1.208 741 HE21 GLN 95 HE22 GLN 95 -20.578 -32.680 2.212 742 HE22 GLN 95 HE21 GLN 95 -19.982 -31.548 3.403 743 H ILE 96 H ILE 96 -16.551 -35.884 5.105 744 HA ILE 96 HA ILE 96 -15.099 -38.032 3.713 745 HB ILE 96 HB ILE 96 -13.232 -36.409 3.206 746 HG12 ILE 96 HG12 ILE 96 -15.379 -34.298 3.651 747 HG13 ILE 96 HG13 ILE 96 -13.996 -34.595 4.718 748 HG21 ILE 96 HG21 ILE 96 -14.135 -35.711 1.089 749 HG22 ILE 96 HG22 ILE 96 -14.815 -37.293 1.493 750 HG23 ILE 96 HG23 ILE 96 -15.794 -35.824 1.697 751 HD11 ILE 96 HD11 ILE 96 -13.854 -33.691 1.807 752 HD12 ILE 96 HD12 ILE 96 -13.492 -32.723 3.251 753 HD13 ILE 96 HD13 ILE 96 -12.447 -34.101 2.822 754 HA PRO 97 HA PRO 97 -13.058 -38.502 7.596 755 HB2 PRO 97 HB2 PRO 97 -10.473 -38.309 6.061 756 HB3 PRO 97 HB3 PRO 97 -10.966 -39.542 7.267 757 HG2 PRO 97 HG2 PRO 97 -11.056 -40.122 4.627 758 HG3 PRO 97 HG3 PRO 97 -12.426 -40.588 5.688 759 HD2 PRO 97 HD2 PRO 97 -12.207 -38.195 3.850 760 HD3 PRO 97 HD3 PRO 97 -13.580 -39.332 4.076 761 H VAL 98 H VAL 98 -11.619 -37.480 9.153 762 HA VAL 98 HA VAL 98 -10.685 -34.765 8.458 763 HB VAL 98 HB VAL 98 -11.734 -33.830 10.497 764 HG11 VAL 98 HG11 VAL 98 -13.765 -35.074 8.606 765 HG12 VAL 98 HG12 VAL 98 -14.008 -33.648 9.640 766 HG13 VAL 98 HG13 VAL 98 -12.840 -33.587 8.298 767 HG21 VAL 98 HG21 VAL 98 -13.256 -36.469 10.611 768 HG22 VAL 98 HG22 VAL 98 -12.026 -35.936 11.778 769 HG23 VAL 98 HG23 VAL 98 -13.550 -35.047 11.621 770 H VAL 99 H VAL 99 -10.311 -37.723 10.052 771 HA VAL 99 HA VAL 99 -8.951 -38.556 11.633 772 HB VAL 99 HB VAL 99 -6.581 -38.285 11.098 773 HG11 VAL 99 HG11 VAL 99 -6.754 -38.999 8.753 774 HG12 VAL 99 HG12 VAL 99 -8.045 -39.728 9.727 775 HG13 VAL 99 HG13 VAL 99 -8.411 -38.355 8.654 776 HG21 VAL 99 HG21 VAL 99 -6.580 -35.824 10.658 777 HG22 VAL 99 HG22 VAL 99 -5.836 -36.759 9.349 778 HG23 VAL 99 HG23 VAL 99 -7.476 -36.116 9.149 779 H GLU 100 H GLU 100 -10.223 -36.068 12.659 780 HA GLU 100 HA GLU 100 -8.338 -35.691 14.901 781 HB2 GLU 100 HB2 GLU 100 -8.487 -33.323 14.825 782 HB3 GLU 100 HB3 GLU 100 -8.099 -33.860 13.176 783 HG2 GLU 100 HG2 GLU 100 -10.502 -33.659 12.561 784 HG3 GLU 100 HG3 GLU 100 -10.853 -33.069 14.194 785 H VAL 101 H VAL 101 -9.464 -34.497 16.738 786 HA VAL 101 HA VAL 101 -12.370 -34.887 16.826 787 HB VAL 101 HB VAL 101 -11.106 -36.940 17.557 788 HG11 VAL 101 HG11 VAL 101 -10.329 -35.225 19.944 789 HG12 VAL 101 HG12 VAL 101 -10.056 -36.973 19.765 790 HG13 VAL 101 HG13 VAL 101 -9.224 -35.832 18.690 791 HG21 VAL 101 HG21 VAL 101 -12.518 -37.378 19.502 792 HG22 VAL 101 HG22 VAL 101 -12.782 -35.643 19.736 793 HG23 VAL 101 HG23 VAL 101 -13.442 -36.455 18.297 794 H ASP 102 H ASP 102 -13.345 -33.777 18.710 795 HA ASP 102 HA ASP 102 -11.658 -31.882 20.144 796 HB2 ASP 102 HB2 ASP 102 -12.271 -30.878 17.907 797 HB3 ASP 102 HB3 ASP 102 -13.959 -30.930 18.414 798 H GLU 103 H GLU 103 -13.305 -34.165 20.685 799 HA GLU 103 HA GLU 103 -15.214 -33.035 22.659 800 HB2 GLU 103 HB2 GLU 103 -15.772 -35.471 20.953 801 HB3 GLU 103 HB3 GLU 103 -16.875 -34.633 22.051 802 HG2 GLU 103 HG2 GLU 103 -16.574 -32.570 20.557 803 HG3 GLU 103 HG3 GLU 103 -15.774 -33.636 19.400 804 H LEU 104 H LEU 104 -16.109 -35.186 23.873 805 HA LEU 104 HA LEU 104 -13.955 -36.047 25.531 806 HB2 LEU 104 HB2 LEU 104 -16.651 -37.395 25.291 807 HB3 LEU 104 HB3 LEU 104 -15.635 -37.291 26.715 808 HG LEU 104 HG LEU 104 -17.096 -34.974 25.429 809 HD11 LEU 104 HD11 LEU 104 -18.541 -36.562 26.655 810 HD12 LEU 104 HD12 LEU 104 -17.480 -36.420 28.080 811 HD13 LEU 104 HD13 LEU 104 -18.410 -35.012 27.515 812 HD21 LEU 104 HD21 LEU 104 -15.354 -35.100 27.932 813 HD22 LEU 104 HD22 LEU 104 -14.957 -34.238 26.429 814 HD23 LEU 104 HD23 LEU 104 -16.326 -33.705 27.426 815 HA PRO 105 HA PRO 105 -12.536 -39.622 23.440 816 HB2 PRO 105 HB2 PRO 105 -11.680 -41.286 25.408 817 HB3 PRO 105 HB3 PRO 105 -11.000 -39.643 25.217 818 HG2 PRO 105 HG2 PRO 105 -13.166 -40.545 27.125 819 HG3 PRO 105 HG3 PRO 105 -11.718 -39.548 27.481 820 HD2 PRO 105 HD2 PRO 105 -14.219 -38.529 26.965 821 HD3 PRO 105 HD3 PRO 105 -12.742 -37.618 26.576 822 H GLU 106 H GLU 106 -15.560 -39.612 24.336 823 HA GLU 106 HA GLU 106 -17.337 -40.999 24.311 824 HB2 GLU 106 HB2 GLU 106 -16.278 -41.273 22.004 825 HB3 GLU 106 HB3 GLU 106 -15.689 -42.845 22.558 826 HG2 GLU 106 HG2 GLU 106 -18.029 -43.550 23.014 827 HG3 GLU 106 HG3 GLU 106 -18.600 -41.946 22.524 828 H GLY 107 H GLY 107 -15.332 -41.368 26.430 829 HA2 GLY 107 HA2 GLY 107 -16.306 -43.962 27.460 830 HA3 GLY 107 HA3 GLY 107 -14.546 -43.684 27.385 831 H TYR 108 H TYR 108 -16.323 -40.811 27.862 832 HA TYR 108 HA TYR 108 -15.077 -40.358 30.397 833 HB2 TYR 108 HB2 TYR 108 -15.977 -38.804 28.367 834 HB3 TYR 108 HB3 TYR 108 -17.327 -38.649 29.502 835 HD1 TYR 108 HD1 TYR 108 -13.591 -38.812 29.750 836 HD2 TYR 108 HD2 TYR 108 -17.179 -36.679 30.756 837 HE1 TYR 108 HE1 TYR 108 -12.248 -37.170 31.069 838 HE2 TYR 108 HE2 TYR 108 -15.870 -35.063 32.106 839 HH TYR 108 HH TYR 108 -12.297 -35.293 32.378 840 H ASP 109 H ASP 109 -16.564 -39.108 32.046 841 HA ASP 109 HA ASP 109 -19.071 -40.491 32.626 842 HB2 ASP 109 HB2 ASP 109 -17.084 -41.841 33.425 843 HB3 ASP 109 HB3 ASP 109 -16.738 -40.544 34.580 844 H ARG 110 H ARG 110 -18.145 -37.791 31.952 845 HA ARG 110 HA ARG 110 -18.193 -35.625 32.508 846 HB2 ARG 110 HB2 ARG 110 -20.195 -36.487 34.596 847 HB3 ARG 110 HB3 ARG 110 -19.998 -34.881 33.884 848 HG2 ARG 110 HG2 ARG 110 -20.556 -35.793 31.646 849 HG3 ARG 110 HG3 ARG 110 -20.833 -37.389 32.381 850 HD2 ARG 110 HD2 ARG 110 -22.581 -36.416 33.835 851 HD3 ARG 110 HD3 ARG 110 -22.331 -34.835 33.081 852 HE ARG 110 HE ARG 110 -23.701 -37.168 31.924 853 HH11 ARG 110 HH11 ARG 110 -22.235 -34.013 31.298 854 HH12 ARG 110 HH12 ARG 110 -23.097 -33.779 29.798 855 HH21 ARG 110 HH21 ARG 110 -24.815 -36.831 29.973 856 HH22 ARG 110 HH22 ARG 110 -24.560 -35.370 29.050 857 H SER 111 H SER 111 -18.157 -33.992 34.475 858 HA SER 111 HA SER 111 -15.615 -34.288 35.658 859 HB2 SER 111 HB2 SER 111 -17.929 -32.487 36.486 860 HB3 SER 111 HB3 SER 111 -16.224 -32.259 36.928 861 HG SER 111 HG SER 111 -15.731 -32.046 34.704 Start of MODEL 17 1 H1 SER 2 H1 SER 2 7.353 -2.320 -6.374 2 H2 SER 2 H2 SER 2 7.703 -3.729 -7.157 3 H3 SER 2 H3 SER 2 8.505 -3.332 -5.779 4 HA SER 2 HA SER 2 6.525 -3.495 -4.478 5 HB2 SER 2 HB2 SER 2 4.970 -2.848 -6.296 6 HB3 SER 2 HB3 SER 2 5.238 -4.427 -7.083 7 HG SER 2 HG SER 2 3.367 -4.378 -5.734 8 H GLN 3 H GLN 3 5.525 -5.654 -3.837 9 HA GLN 3 HA GLN 3 6.968 -8.008 -4.866 10 HB2 GLN 3 HB2 GLN 3 7.752 -8.656 -2.636 11 HB3 GLN 3 HB3 GLN 3 8.459 -7.113 -3.131 12 HG2 GLN 3 HG2 GLN 3 6.771 -5.903 -1.752 13 HG3 GLN 3 HG3 GLN 3 6.062 -7.452 -1.273 14 HE21 GLN 3 HE22 GLN 3 6.575 -6.410 0.919 15 HE22 GLN 3 HE21 GLN 3 8.148 -6.763 1.594 16 H PHE 4 H PHE 4 4.113 -6.685 -4.265 17 HA PHE 4 HA PHE 4 2.675 -8.345 -2.522 18 HB2 PHE 4 HB2 PHE 4 1.842 -6.271 -3.520 19 HB3 PHE 4 HB3 PHE 4 1.879 -6.974 -5.116 20 HD1 PHE 4 HD2 PHE 4 0.404 -9.197 -5.423 21 HD2 PHE 4 HD1 PHE 4 -0.187 -6.215 -2.386 22 HE1 PHE 4 HE2 PHE 4 -1.909 -9.983 -5.113 23 HE2 PHE 4 HE1 PHE 4 -2.547 -6.947 -2.125 24 HZ PHE 4 HZ PHE 4 -3.414 -8.826 -3.498 25 H GLU 5 H GLU 5 3.296 -8.760 -6.048 26 HA GLU 5 HA GLU 5 1.873 -11.312 -6.089 27 HB2 GLU 5 HB2 GLU 5 3.669 -9.931 -8.124 28 HB3 GLU 5 HB3 GLU 5 2.713 -11.394 -8.429 29 HG2 GLU 5 HG2 GLU 5 0.636 -10.145 -7.882 30 HG3 GLU 5 HG3 GLU 5 1.592 -8.678 -7.611 31 H LYS 6 H LYS 6 5.160 -10.282 -5.446 32 HA LYS 6 HA LYS 6 6.502 -12.669 -6.309 33 HB2 LYS 6 HB2 LYS 6 7.569 -10.506 -6.076 34 HB3 LYS 6 HB3 LYS 6 7.370 -10.608 -4.312 35 HG2 LYS 6 HG2 LYS 6 8.792 -12.547 -4.169 36 HG3 LYS 6 HG3 LYS 6 8.765 -12.764 -5.940 37 HD2 LYS 6 HD2 LYS 6 9.915 -10.645 -6.258 38 HD3 LYS 6 HD3 LYS 6 9.951 -10.364 -4.496 39 HE2 LYS 6 HE2 LYS 6 11.281 -12.437 -4.201 40 HE3 LYS 6 HE3 LYS 6 11.265 -12.699 -5.956 41 HZ1 LYS 6 HZ1 LYS 6 13.291 -11.639 -5.235 42 HZ2 LYS 6 HZ2 LYS 6 12.444 -10.634 -6.223 43 HZ3 LYS 6 HZ3 LYS 6 12.464 -10.374 -4.597 44 H GLN 7 H GLN 7 5.351 -11.543 -3.061 45 HA GLN 7 HA GLN 7 6.302 -13.877 -1.704 46 HB2 GLN 7 HB2 GLN 7 5.293 -11.369 -1.033 47 HB3 GLN 7 HB3 GLN 7 3.972 -12.439 -0.557 48 HG2 GLN 7 HG2 GLN 7 6.884 -12.628 0.293 49 HG3 GLN 7 HG3 GLN 7 5.520 -12.102 1.306 50 HE21 GLN 7 HE22 GLN 7 3.656 -13.825 1.435 51 HE22 GLN 7 HE21 GLN 7 4.181 -15.480 1.642 52 H LYS 8 H LYS 8 3.312 -13.014 -3.361 53 HA LYS 8 HA LYS 8 1.624 -15.032 -2.156 54 HB2 LYS 8 HB2 LYS 8 0.907 -12.835 -3.058 55 HB3 LYS 8 HB3 LYS 8 1.396 -13.341 -4.651 56 HG2 LYS 8 HG2 LYS 8 -0.312 -15.323 -4.293 57 HG3 LYS 8 HG3 LYS 8 -0.939 -14.301 -2.994 58 HD2 LYS 8 HD2 LYS 8 -2.231 -13.665 -4.899 59 HD3 LYS 8 HD3 LYS 8 -0.980 -12.413 -4.795 60 HE2 LYS 8 HE2 LYS 8 -1.041 -13.111 -7.101 61 HE3 LYS 8 HE3 LYS 8 0.443 -13.754 -6.392 62 HZ1 LYS 8 HZ1 LYS 8 -2.064 -15.244 -6.857 63 HZ2 LYS 8 HZ2 LYS 8 -0.628 -15.433 -7.668 64 HZ3 LYS 8 HZ3 LYS 8 -0.748 -15.861 -6.089 65 H GLU 9 H GLU 9 2.961 -14.694 -5.543 66 HA GLU 9 HA GLU 9 1.957 -17.213 -6.377 67 HB2 GLU 9 HB2 GLU 9 2.654 -15.093 -7.673 68 HB3 GLU 9 HB3 GLU 9 4.316 -15.657 -7.482 69 HG2 GLU 9 HG2 GLU 9 3.432 -16.363 -9.623 70 HG3 GLU 9 HG3 GLU 9 3.684 -17.782 -8.600 71 H GLN 10 H GLN 10 4.926 -16.346 -4.630 72 HA GLN 10 HA GLN 10 6.342 -18.753 -5.331 73 HB2 GLN 10 HB2 GLN 10 6.669 -16.650 -3.175 74 HB3 GLN 10 HB3 GLN 10 7.719 -18.087 -3.261 75 HG2 GLN 10 HG2 GLN 10 8.340 -17.539 -5.573 76 HG3 GLN 10 HG3 GLN 10 7.318 -16.102 -5.541 77 HE21 GLN 10 HE22 GLN 10 10.007 -15.878 -6.154 78 HE22 GLN 10 HE21 GLN 10 10.856 -15.089 -4.843 79 H GLY 11 H GLY 11 3.496 -18.491 -3.650 80 HA2 GLY 11 HA2 GLY 11 4.158 -20.910 -2.023 81 HA3 GLY 11 HA3 GLY 11 2.952 -19.731 -1.546 82 H ASN 12 H ASN 12 2.625 -19.882 -4.873 83 HA ASN 12 HA ASN 12 0.190 -21.367 -4.730 84 HB2 ASN 12 HB2 ASN 12 -0.060 -20.759 -6.899 85 HB3 ASN 12 HB3 ASN 12 1.250 -19.647 -6.524 86 HD21 ASN 12 HD22 ASN 12 3.375 -20.167 -7.309 87 HD22 ASN 12 HD21 ASN 12 3.574 -21.294 -8.629 88 H SER 13 H SER 13 3.530 -22.281 -5.265 89 HA SER 13 HA SER 13 2.805 -24.981 -6.168 90 HB2 SER 13 HB2 SER 13 5.270 -25.343 -6.094 91 HB3 SER 13 HB3 SER 13 4.832 -23.915 -7.055 92 HG SER 13 HG SER 13 6.556 -23.511 -5.581 93 H LEU 14 H LEU 14 3.926 -23.354 -3.163 94 HA LEU 14 HA LEU 14 4.326 -25.669 -1.587 95 HB2 LEU 14 HB2 LEU 14 3.322 -22.875 -0.896 96 HB3 LEU 14 HB3 LEU 14 3.924 -24.041 0.262 97 HG LEU 14 HG LEU 14 5.525 -22.752 -1.975 98 HD11 LEU 14 HD11 LEU 14 6.756 -21.722 -0.104 99 HD12 LEU 14 HD12 LEU 14 5.029 -21.307 -0.010 100 HD13 LEU 14 HD13 LEU 14 5.696 -22.556 1.060 101 HD21 LEU 14 HD21 LEU 14 6.333 -25.043 -1.635 102 HD22 LEU 14 HD22 LEU 14 7.473 -23.895 -0.925 103 HD23 LEU 14 HD23 LEU 14 6.370 -24.796 0.130 104 H PHE 15 H PHE 15 1.432 -23.824 -2.502 105 HA PHE 15 HA PHE 15 -0.435 -25.110 -0.770 106 HB2 PHE 15 HB2 PHE 15 -0.983 -23.025 -1.779 107 HB3 PHE 15 HB3 PHE 15 -0.559 -23.610 -3.388 108 HD1 PHE 15 HD2 PHE 15 -2.908 -24.562 -0.612 109 HD2 PHE 15 HD1 PHE 15 -2.265 -24.056 -4.822 110 HE1 PHE 15 HE2 PHE 15 -5.269 -25.220 -1.050 111 HE2 PHE 15 HE1 PHE 15 -4.656 -24.618 -5.262 112 HZ PHE 15 HZ PHE 15 -6.148 -25.206 -3.373 113 H LYS 16 H LYS 16 1.262 -26.254 -3.525 114 HA LYS 16 HA LYS 16 -0.755 -28.387 -3.995 115 HB2 LYS 16 HB2 LYS 16 1.526 -27.390 -5.726 116 HB3 LYS 16 HB3 LYS 16 0.373 -28.662 -6.183 117 HG2 LYS 16 HG2 LYS 16 -1.495 -27.093 -6.079 118 HG3 LYS 16 HG3 LYS 16 -0.456 -25.831 -5.393 119 HD2 LYS 16 HD2 LYS 16 0.919 -25.881 -7.502 120 HD3 LYS 16 HD3 LYS 16 -0.299 -26.981 -8.195 121 HE2 LYS 16 HE2 LYS 16 -2.057 -25.255 -7.672 122 HE3 LYS 16 HE3 LYS 16 -0.769 -24.170 -7.110 123 HZ1 LYS 16 HZ1 LYS 16 -0.977 -25.255 -9.843 124 HZ2 LYS 16 HZ2 LYS 16 -1.355 -23.712 -9.385 125 HZ3 LYS 16 HZ3 LYS 16 0.197 -24.233 -9.289 126 H GLN 17 H GLN 17 2.171 -27.805 -2.372 127 HA GLN 17 HA GLN 17 3.321 -30.470 -2.748 128 HB2 GLN 17 HB2 GLN 17 3.947 -28.260 -0.771 129 HB3 GLN 17 HB3 GLN 17 4.799 -29.809 -0.896 130 HG2 GLN 17 HG2 GLN 17 5.085 -29.220 -3.425 131 HG3 GLN 17 HG3 GLN 17 4.704 -27.570 -2.904 132 HE21 GLN 17 HE22 GLN 17 5.898 -27.274 -0.498 133 HE22 GLN 17 HE21 GLN 17 7.618 -27.518 -0.624 134 H GLY 18 H GLY 18 0.781 -29.144 -0.711 135 HA2 GLY 18 HA2 GLY 18 -0.686 -30.532 0.487 136 HA3 GLY 18 HA3 GLY 18 0.546 -31.803 0.556 137 H LEU 19 H LEU 19 1.174 -28.417 1.444 138 HA LEU 19 HA LEU 19 1.196 -29.126 4.318 139 HB2 LEU 19 HB2 LEU 19 3.427 -27.877 4.446 140 HB3 LEU 19 HB3 LEU 19 3.410 -29.539 3.879 141 HG LEU 19 HG LEU 19 3.592 -28.817 1.549 142 HD11 LEU 19 HD11 LEU 19 4.090 -26.459 1.012 143 HD12 LEU 19 HD12 LEU 19 2.457 -26.621 1.693 144 HD13 LEU 19 HD13 LEU 19 3.786 -26.009 2.697 145 HD21 LEU 19 HD21 LEU 19 5.900 -27.981 1.697 146 HD22 LEU 19 HD22 LEU 19 5.626 -27.514 3.397 147 HD23 LEU 19 HD23 LEU 19 5.606 -29.224 2.927 148 H TYR 20 H TYR 20 -0.876 -27.912 3.479 149 HA TYR 20 HA TYR 20 -0.915 -25.315 2.625 150 HB2 TYR 20 HB2 TYR 20 -2.952 -26.470 4.536 151 HB3 TYR 20 HB3 TYR 20 -3.199 -25.295 3.231 152 HD1 TYR 20 HD2 TYR 20 -1.828 -26.543 0.921 153 HD2 TYR 20 HD1 TYR 20 -4.220 -28.332 4.023 154 HE1 TYR 20 HE2 TYR 20 -2.410 -28.418 -0.590 155 HE2 TYR 20 HE1 TYR 20 -4.804 -30.199 2.507 156 HH TYR 20 HH TYR 20 -4.500 -31.141 0.440 157 H ARG 21 H ARG 21 -0.104 -26.277 5.913 158 HA ARG 21 HA ARG 21 -0.983 -23.880 7.196 159 HB2 ARG 21 HB2 ARG 21 -0.535 -26.047 8.313 160 HB3 ARG 21 HB3 ARG 21 1.179 -25.935 7.924 161 HG2 ARG 21 HG2 ARG 21 0.609 -25.339 10.297 162 HG3 ARG 21 HG3 ARG 21 1.492 -24.079 9.428 163 HD2 ARG 21 HD2 ARG 21 -0.635 -22.895 8.980 164 HD3 ARG 21 HD3 ARG 21 -1.525 -24.165 9.825 165 HE ARG 21 HE ARG 21 -0.852 -23.279 11.862 166 HH11 ARG 21 HH11 ARG 21 1.056 -21.804 9.266 167 HH12 ARG 21 HH12 ARG 21 1.726 -20.569 10.309 168 HH21 ARG 21 HH21 ARG 21 0.052 -21.662 13.188 169 HH22 ARG 21 HH22 ARG 21 1.177 -20.507 12.521 170 H GLU 22 H GLU 22 1.450 -24.223 4.940 171 HA GLU 22 HA GLU 22 2.426 -21.541 5.681 172 HB2 GLU 22 HB2 GLU 22 4.757 -22.263 4.930 173 HB3 GLU 22 HB3 GLU 22 4.201 -22.760 6.532 174 HG2 GLU 22 HG2 GLU 22 3.506 -24.916 5.666 175 HG3 GLU 22 HG3 GLU 22 4.094 -24.488 4.037 176 H ALA 23 H ALA 23 0.507 -22.889 3.791 177 HA ALA 23 HA ALA 23 1.405 -21.446 1.369 178 HB1 ALA 23 HB1 ALA 23 0.545 -23.170 -0.049 179 HB2 ALA 23 HB2 ALA 23 1.739 -23.884 1.044 180 HB3 ALA 23 HB3 ALA 23 0.011 -24.138 1.345 181 H VAL 24 H VAL 24 -0.393 -20.990 3.777 182 HA VAL 24 HA VAL 24 -2.823 -20.042 2.262 183 HB VAL 24 HB VAL 24 -2.303 -20.801 5.180 184 HG11 VAL 24 HG11 VAL 24 -4.821 -19.579 3.932 185 HG12 VAL 24 HG12 VAL 24 -4.687 -20.192 5.592 186 HG13 VAL 24 HG13 VAL 24 -3.733 -18.784 5.096 187 HG21 VAL 24 HG21 VAL 24 -2.928 -22.680 3.532 188 HG22 VAL 24 HG22 VAL 24 -4.153 -22.436 4.797 189 HG23 VAL 24 HG23 VAL 24 -4.402 -21.797 3.164 190 H HIS 25 H HIS 25 -0.618 -19.662 4.982 191 HA HIS 25 HA HIS 25 -0.897 -16.966 5.611 192 HB2 HIS 25 HB2 HIS 25 1.210 -19.146 5.857 193 HB3 HIS 25 HB3 HIS 25 1.262 -17.639 6.686 194 HD2 HIS 25 HD2 HIS 25 -0.244 -17.262 8.832 195 HE1 HIS 25 HE1 HIS 25 -2.168 -21.051 8.832 196 HE2 HIS 25 HE2 HIS 25 -1.815 -18.904 10.152 197 H CYS 26 H CYS 26 0.623 -18.529 2.920 198 HA CYS 26 HA CYS 26 2.592 -16.509 2.291 199 HB2 CYS 26 HB2 CYS 26 2.746 -17.774 0.193 200 HB3 CYS 26 HB3 CYS 26 2.721 -18.867 1.600 201 HG CYS 26 HG CYS 26 0.197 -17.977 -0.329 202 H TYR 27 H TYR 27 -0.732 -16.607 2.121 203 HA TYR 27 HA TYR 27 -0.859 -14.539 -0.065 204 HB2 TYR 27 HB2 TYR 27 -3.113 -16.205 1.065 205 HB3 TYR 27 HB3 TYR 27 -3.183 -15.202 -0.374 206 HD1 TYR 27 HD1 TYR 27 -0.730 -16.033 -1.836 207 HD2 TYR 27 HD2 TYR 27 -3.533 -18.350 0.445 208 HE1 TYR 27 HE1 TYR 27 -0.188 -18.024 -3.202 209 HE2 TYR 27 HE2 TYR 27 -2.975 -20.367 -0.906 210 HH TYR 27 HH TYR 27 -0.592 -20.228 -3.579 211 H ASP 28 H ASP 28 -1.037 -14.953 3.328 212 HA ASP 28 HA ASP 28 -3.274 -13.220 3.901 213 HB2 ASP 28 HB2 ASP 28 -2.253 -15.037 5.344 214 HB3 ASP 28 HB3 ASP 28 -0.880 -13.966 5.646 215 H GLN 29 H GLN 29 0.145 -12.657 3.188 216 HA GLN 29 HA GLN 29 0.312 -10.145 4.549 217 HB2 GLN 29 HB2 GLN 29 2.402 -9.881 3.564 218 HB3 GLN 29 HB3 GLN 29 2.252 -11.610 3.880 219 HG2 GLN 29 HG2 GLN 29 1.655 -10.271 1.238 220 HG3 GLN 29 HG3 GLN 29 3.219 -10.993 1.622 221 HE21 GLN 29 HE22 GLN 29 1.560 -11.705 -0.592 222 HE22 GLN 29 HE21 GLN 29 1.102 -13.379 -0.413 223 H LEU 30 H LEU 30 -1.389 -11.052 1.750 224 HA LEU 30 HA LEU 30 -1.164 -8.476 0.358 225 HB2 LEU 30 HB2 LEU 30 -3.115 -10.793 0.013 226 HB3 LEU 30 HB3 LEU 30 -2.780 -9.502 -1.160 227 HG LEU 30 HG LEU 30 -0.920 -11.717 -0.205 228 HD11 LEU 30 HD11 LEU 30 -0.993 -12.239 -2.647 229 HD12 LEU 30 HD12 LEU 30 -2.528 -12.461 -1.809 230 HD13 LEU 30 HD13 LEU 30 -2.269 -11.029 -2.833 231 HD21 LEU 30 HD21 LEU 30 0.414 -9.676 -0.481 232 HD22 LEU 30 HD22 LEU 30 0.718 -10.785 -1.825 233 HD23 LEU 30 HD23 LEU 30 -0.331 -9.390 -2.063 234 H ILE 31 H ILE 31 -3.411 -10.156 2.505 235 HA ILE 31 HA ILE 31 -5.515 -8.206 2.244 236 HB ILE 31 HB ILE 31 -4.886 -10.377 4.275 237 HG12 ILE 31 HG12 ILE 31 -6.998 -10.569 2.114 238 HG13 ILE 31 HG13 ILE 31 -5.325 -10.862 1.709 239 HG21 ILE 31 HG21 ILE 31 -7.488 -8.865 3.819 240 HG22 ILE 31 HG22 ILE 31 -7.329 -10.326 4.826 241 HG23 ILE 31 HG23 ILE 31 -6.480 -8.845 5.287 242 HD11 ILE 31 HD11 ILE 31 -6.870 -12.336 3.833 243 HD12 ILE 31 HD12 ILE 31 -6.383 -12.950 2.232 244 HD13 ILE 31 HD13 ILE 31 -5.140 -12.540 3.453 245 H THR 32 H THR 32 -2.514 -8.300 3.797 246 HA THR 32 HA THR 32 -3.259 -6.094 5.672 247 HB THR 32 HB THR 32 -0.751 -7.819 5.624 248 HG1 THR 32 HG1 THR 32 -2.596 -9.014 6.151 249 HG21 THR 32 HG21 THR 32 -1.865 -5.856 7.674 250 HG22 THR 32 HG22 THR 32 -0.485 -6.945 7.944 251 HG23 THR 32 HG23 THR 32 -0.368 -5.669 6.729 252 H ALA 33 H ALA 33 -1.259 -6.850 2.814 253 HA ALA 33 HA ALA 33 0.293 -4.386 3.043 254 HB1 ALA 33 HB1 ALA 33 -0.069 -6.382 0.761 255 HB2 ALA 33 HB2 ALA 33 1.108 -5.046 0.781 256 HB3 ALA 33 HB3 ALA 33 1.249 -6.369 1.957 257 H GLN 34 H GLN 34 -2.560 -5.517 1.230 258 HA GLN 34 HA GLN 34 -3.628 -2.926 0.826 259 HB2 GLN 34 HB2 GLN 34 -3.347 -2.819 -1.677 260 HB3 GLN 34 HB3 GLN 34 -1.930 -2.426 -0.702 261 HG2 GLN 34 HG2 GLN 34 -1.377 -5.000 -1.083 262 HG3 GLN 34 HG3 GLN 34 -2.434 -4.775 -2.489 263 HE21 GLN 34 HE22 GLN 34 0.468 -3.530 -0.808 264 HE22 GLN 34 HE21 GLN 34 1.248 -2.887 -2.227 265 HA PRO 35 HA PRO 35 -6.305 -6.655 0.576 266 HB2 PRO 35 HB2 PRO 35 -8.345 -5.610 2.118 267 HB3 PRO 35 HB3 PRO 35 -6.894 -6.424 2.769 268 HG2 PRO 35 HG2 PRO 35 -7.385 -3.458 2.444 269 HG3 PRO 35 HG3 PRO 35 -6.736 -4.326 3.873 270 HD2 PRO 35 HD2 PRO 35 -5.114 -3.081 2.106 271 HD3 PRO 35 HD3 PRO 35 -4.637 -4.652 2.825 272 H GLN 36 H GLN 36 -6.427 -3.521 -0.694 273 HA GLN 36 HA GLN 36 -9.101 -3.383 -1.649 274 HB2 GLN 36 HB2 GLN 36 -8.259 -1.581 -3.047 275 HB3 GLN 36 HB3 GLN 36 -7.609 -1.455 -1.412 276 HG2 GLN 36 HG2 GLN 36 -5.517 -2.582 -2.177 277 HG3 GLN 36 HG3 GLN 36 -6.162 -2.627 -3.818 278 HE21 GLN 36 HE22 GLN 36 -3.754 -1.411 -3.507 279 HE22 GLN 36 HE21 GLN 36 -3.917 0.325 -3.629 280 H ASN 37 H ASN 37 -7.279 -5.908 -2.298 281 HA ASN 37 HA ASN 37 -8.090 -6.059 -5.152 282 HB2 ASN 37 HB2 ASN 37 -5.430 -6.823 -3.894 283 HB3 ASN 37 HB3 ASN 37 -5.926 -7.303 -5.532 284 HD21 ASN 37 HD22 ASN 37 -4.184 -5.051 -3.795 285 HD22 ASN 37 HD21 ASN 37 -4.167 -3.761 -4.985 286 HA PRO 38 HA PRO 38 -10.033 -9.720 -3.509 287 HB2 PRO 38 HB2 PRO 38 -10.992 -10.772 -5.797 288 HB3 PRO 38 HB3 PRO 38 -11.567 -9.196 -5.179 289 HG2 PRO 38 HG2 PRO 38 -9.401 -9.636 -7.252 290 HG3 PRO 38 HG3 PRO 38 -10.893 -8.634 -7.405 291 HD2 PRO 38 HD2 PRO 38 -8.605 -7.439 -6.613 292 HD3 PRO 38 HD3 PRO 38 -10.122 -7.082 -5.822 293 H VAL 39 H VAL 39 -7.231 -9.812 -5.666 294 HA VAL 39 HA VAL 39 -7.144 -12.638 -6.053 295 HB VAL 39 HB VAL 39 -5.893 -10.954 -7.363 296 HG11 VAL 39 HG11 VAL 39 -4.027 -10.817 -4.956 297 HG12 VAL 39 HG12 VAL 39 -3.787 -10.042 -6.533 298 HG13 VAL 39 HG13 VAL 39 -5.111 -9.509 -5.486 299 HG21 VAL 39 HG21 VAL 39 -5.262 -13.340 -7.392 300 HG22 VAL 39 HG22 VAL 39 -3.848 -12.290 -7.608 301 HG23 VAL 39 HG23 VAL 39 -4.145 -13.072 -6.040 302 H GLY 40 H GLY 40 -6.051 -10.512 -3.433 303 HA2 GLY 40 HA2 GLY 40 -4.582 -12.353 -1.858 304 HA3 GLY 40 HA3 GLY 40 -5.445 -10.928 -1.266 305 H TYR 41 H TYR 41 -7.936 -12.240 -2.613 306 HA TYR 41 HA TYR 41 -8.541 -14.233 -0.492 307 HB2 TYR 41 HB2 TYR 41 -10.656 -12.596 -1.855 308 HB3 TYR 41 HB3 TYR 41 -10.745 -13.433 -0.384 309 HD1 TYR 41 HD1 TYR 41 -9.186 -10.428 -1.903 310 HD2 TYR 41 HD2 TYR 41 -10.321 -12.426 1.713 311 HE1 TYR 41 HE1 TYR 41 -8.820 -8.329 -0.649 312 HE2 TYR 41 HE2 TYR 41 -9.946 -10.331 2.995 313 HH TYR 41 HH TYR 41 -8.945 -7.289 1.386 314 H SER 42 H SER 42 -7.374 -14.538 -3.280 315 HA SER 42 HA SER 42 -9.531 -16.263 -4.405 316 HB2 SER 42 HB2 SER 42 -9.039 -14.210 -5.758 317 HB3 SER 42 HB3 SER 42 -7.366 -14.792 -5.954 318 HG SER 42 HG SER 42 -8.669 -15.433 -7.698 319 H ASN 43 H ASN 43 -6.615 -16.218 -2.801 320 HA ASN 43 HA ASN 43 -6.019 -18.969 -3.761 321 HB2 ASN 43 HB2 ASN 43 -4.045 -16.764 -3.020 322 HB3 ASN 43 HB3 ASN 43 -3.637 -18.457 -3.308 323 HD21 ASN 43 HD22 ASN 43 -4.417 -19.361 -5.491 324 HD22 ASN 43 HD21 ASN 43 -4.214 -18.297 -6.871 325 H LYS 44 H LYS 44 -5.929 -16.564 -1.032 326 HA LYS 44 HA LYS 44 -5.476 -18.596 0.977 327 HB2 LYS 44 HB2 LYS 44 -5.180 -16.095 1.212 328 HB3 LYS 44 HB3 LYS 44 -6.910 -15.920 1.168 329 HG2 LYS 44 HG2 LYS 44 -7.098 -17.423 3.169 330 HG3 LYS 44 HG3 LYS 44 -5.326 -17.551 3.205 331 HD2 LYS 44 HD2 LYS 44 -5.144 -15.117 3.583 332 HD3 LYS 44 HD3 LYS 44 -6.915 -14.972 3.486 333 HE2 LYS 44 HE2 LYS 44 -7.136 -16.547 5.396 334 HE3 LYS 44 HE3 LYS 44 -5.366 -16.615 5.539 335 HZ1 LYS 44 HZ1 LYS 44 -6.344 -15.040 7.068 336 HZ2 LYS 44 HZ2 LYS 44 -5.378 -14.252 5.994 337 HZ3 LYS 44 HZ3 LYS 44 -7.015 -14.186 5.838 338 H ALA 45 H ALA 45 -8.281 -17.092 -0.534 339 HA ALA 45 HA ALA 45 -10.313 -18.481 0.918 340 HB1 ALA 45 HB1 ALA 45 -10.371 -17.328 -1.895 341 HB2 ALA 45 HB2 ALA 45 -11.777 -17.678 -0.880 342 HB3 ALA 45 HB3 ALA 45 -10.643 -16.385 -0.409 343 H MET 46 H MET 46 -7.979 -19.908 -0.953 344 HA MET 46 HA MET 46 -9.757 -22.199 -1.613 345 HB2 MET 46 HB2 MET 46 -9.134 -20.535 -3.599 346 HB3 MET 46 HB3 MET 46 -7.560 -21.356 -3.523 347 HG2 MET 46 HG2 MET 46 -8.787 -23.542 -3.764 348 HG3 MET 46 HG3 MET 46 -10.292 -22.627 -3.974 349 HE1 MET 46 HE1 MET 46 -10.821 -21.051 -5.981 350 HE2 MET 46 HE2 MET 46 -9.320 -20.128 -5.742 351 HE3 MET 46 HE3 MET 46 -9.724 -20.762 -7.351 352 H ALA 47 H ALA 47 -7.299 -21.138 0.200 353 HA ALA 47 HA ALA 47 -6.034 -23.833 0.179 354 HB1 ALA 47 HB1 ALA 47 -4.686 -21.164 0.740 355 HB2 ALA 47 HB2 ALA 47 -3.919 -22.774 0.824 356 HB3 ALA 47 HB3 ALA 47 -4.487 -22.142 -0.738 357 H LEU 48 H LEU 48 -7.360 -21.103 2.037 358 HA LEU 48 HA LEU 48 -6.759 -22.272 4.601 359 HB2 LEU 48 HB2 LEU 48 -7.163 -19.867 4.225 360 HB3 LEU 48 HB3 LEU 48 -8.809 -20.206 3.692 361 HG LEU 48 HG LEU 48 -9.454 -20.966 5.899 362 HD11 LEU 48 HD11 LEU 48 -6.557 -20.471 6.702 363 HD12 LEU 48 HD12 LEU 48 -7.889 -20.853 7.815 364 HD13 LEU 48 HD13 LEU 48 -7.361 -22.059 6.641 365 HD21 LEU 48 HD21 LEU 48 -9.082 -18.848 7.134 366 HD22 LEU 48 HD22 LEU 48 -7.783 -18.416 6.007 367 HD23 LEU 48 HD23 LEU 48 -9.464 -18.533 5.431 368 H ILE 49 H ILE 49 -9.296 -22.628 2.160 369 HA ILE 49 HA ILE 49 -11.154 -24.143 3.720 370 HB ILE 49 HB ILE 49 -11.824 -25.114 1.543 371 HG12 ILE 49 HG12 ILE 49 -9.815 -23.238 0.327 372 HG13 ILE 49 HG13 ILE 49 -9.388 -24.909 0.609 373 HG21 ILE 49 HG21 ILE 49 -12.754 -22.955 2.371 374 HG22 ILE 49 HG22 ILE 49 -11.468 -22.091 1.503 375 HG23 ILE 49 HG23 ILE 49 -12.682 -23.020 0.602 376 HD11 ILE 49 HD11 ILE 49 -10.162 -24.686 -1.670 377 HD12 ILE 49 HD12 ILE 49 -11.172 -25.767 -0.701 378 HD13 ILE 49 HD13 ILE 49 -11.744 -24.112 -1.086 379 H LYS 50 H LYS 50 -8.044 -24.806 2.289 380 HA LYS 50 HA LYS 50 -8.481 -27.586 1.830 381 HB2 LYS 50 HB2 LYS 50 -6.732 -25.701 0.921 382 HB3 LYS 50 HB3 LYS 50 -5.693 -26.583 2.042 383 HG2 LYS 50 HG2 LYS 50 -5.359 -27.754 0.086 384 HG3 LYS 50 HG3 LYS 50 -6.661 -28.717 0.780 385 HD2 LYS 50 HD2 LYS 50 -6.918 -26.497 -1.302 386 HD3 LYS 50 HD3 LYS 50 -6.956 -28.229 -1.650 387 HE2 LYS 50 HE2 LYS 50 -8.934 -26.834 0.179 388 HE3 LYS 50 HE3 LYS 50 -9.196 -27.036 -1.556 389 HZ1 LYS 50 HZ1 LYS 50 -10.233 -28.792 -0.308 390 HZ2 LYS 50 HZ2 LYS 50 -9.054 -29.407 -1.265 391 HZ3 LYS 50 HZ3 LYS 50 -8.791 -29.246 0.350 392 H LEU 51 H LEU 51 -7.676 -25.821 4.692 393 HA LEU 51 HA LEU 51 -6.377 -28.136 6.019 394 HB2 LEU 51 HB2 LEU 51 -7.209 -25.368 7.008 395 HB3 LEU 51 HB3 LEU 51 -6.463 -26.611 8.006 396 HG LEU 51 HG LEU 51 -4.868 -24.944 7.433 397 HD11 LEU 51 HD11 LEU 51 -4.289 -27.595 6.072 398 HD12 LEU 51 HD12 LEU 51 -3.095 -26.444 6.694 399 HD13 LEU 51 HD13 LEU 51 -4.174 -27.286 7.818 400 HD21 LEU 51 HD21 LEU 51 -4.054 -24.582 5.208 401 HD22 LEU 51 HD22 LEU 51 -5.162 -25.801 4.537 402 HD23 LEU 51 HD23 LEU 51 -5.808 -24.292 5.235 403 H GLY 52 H GLY 52 -9.550 -26.984 5.364 404 HA2 GLY 52 HA2 GLY 52 -11.502 -28.177 6.010 405 HA3 GLY 52 HA3 GLY 52 -10.691 -28.695 7.502 406 H GLU 53 H GLU 53 -9.772 -25.572 7.276 407 HA GLU 53 HA GLU 53 -11.700 -24.648 9.241 408 HB2 GLU 53 HB2 GLU 53 -9.329 -23.274 7.888 409 HB3 GLU 53 HB3 GLU 53 -10.293 -22.599 9.203 410 HG2 GLU 53 HG2 GLU 53 -9.727 -24.609 10.605 411 HG3 GLU 53 HG3 GLU 53 -8.603 -25.111 9.322 412 H TYR 54 H TYR 54 -13.223 -25.171 7.042 413 HA TYR 54 HA TYR 54 -13.458 -23.186 5.078 414 HB2 TYR 54 HB2 TYR 54 -15.608 -24.882 6.385 415 HB3 TYR 54 HB3 TYR 54 -15.815 -23.970 4.890 416 HD1 TYR 54 HD1 TYR 54 -14.416 -24.556 2.872 417 HD2 TYR 54 HD2 TYR 54 -14.606 -27.049 6.368 418 HE1 TYR 54 HE1 TYR 54 -13.578 -26.477 1.545 419 HE2 TYR 54 HE2 TYR 54 -13.766 -28.975 5.052 420 HH TYR 54 HH TYR 54 -13.026 -28.692 1.544 421 H THR 55 H THR 55 -14.596 -23.214 8.447 422 HA THR 55 HA THR 55 -16.465 -21.091 8.286 423 HB THR 55 HB THR 55 -14.625 -21.965 10.535 424 HG1 THR 55 HG1 THR 55 -16.440 -23.162 11.152 425 HG21 THR 55 HG21 THR 55 -16.388 -20.942 12.005 426 HG22 THR 55 HG22 THR 55 -15.601 -19.726 10.972 427 HG23 THR 55 HG23 THR 55 -17.216 -20.338 10.554 428 H GLN 56 H GLN 56 -12.893 -21.081 8.614 429 HA GLN 56 HA GLN 56 -12.813 -18.164 8.965 430 HB2 GLN 56 HB2 GLN 56 -10.706 -20.330 8.721 431 HB3 GLN 56 HB3 GLN 56 -10.347 -18.598 8.771 432 HG2 GLN 56 HG2 GLN 56 -10.119 -19.401 10.956 433 HG3 GLN 56 HG3 GLN 56 -11.559 -18.392 10.925 434 HE21 GLN 56 HE22 GLN 56 -10.306 -21.728 11.124 435 HE22 GLN 56 HE21 GLN 56 -11.785 -22.424 11.768 436 H ALA 57 H ALA 57 -13.091 -20.354 6.291 437 HA ALA 57 HA ALA 57 -11.421 -18.723 4.495 438 HB1 ALA 57 HB1 ALA 57 -11.407 -21.195 4.363 439 HB2 ALA 57 HB2 ALA 57 -13.147 -21.187 4.005 440 HB3 ALA 57 HB3 ALA 57 -11.996 -20.453 2.857 441 H ILE 58 H ILE 58 -14.891 -19.403 5.120 442 HA ILE 58 HA ILE 58 -15.919 -17.991 2.819 443 HB ILE 58 HB ILE 58 -17.109 -18.432 5.608 444 HG12 ILE 58 HG12 ILE 58 -17.488 -20.029 3.045 445 HG13 ILE 58 HG13 ILE 58 -16.425 -20.525 4.368 446 HG21 ILE 58 HG21 ILE 58 -19.273 -18.139 4.415 447 HG22 ILE 58 HG22 ILE 58 -18.255 -16.687 4.299 448 HG23 ILE 58 HG23 ILE 58 -18.377 -17.810 2.918 449 HD11 ILE 58 HD11 ILE 58 -19.438 -20.154 4.501 450 HD12 ILE 58 HD12 ILE 58 -18.517 -21.658 4.713 451 HD13 ILE 58 HD13 ILE 58 -18.378 -20.373 5.933 452 H GLN 59 H GLN 59 -14.894 -17.018 6.103 453 HA GLN 59 HA GLN 59 -15.859 -14.332 5.970 454 HB2 GLN 59 HB2 GLN 59 -13.587 -15.584 7.571 455 HB3 GLN 59 HB3 GLN 59 -14.237 -13.953 7.841 456 HG2 GLN 59 HG2 GLN 59 -16.481 -14.920 8.283 457 HG3 GLN 59 HG3 GLN 59 -15.823 -16.541 8.036 458 HE21 GLN 59 HE22 GLN 59 -15.325 -17.613 9.873 459 HE22 GLN 59 HE21 GLN 59 -14.838 -16.863 11.381 460 H MET 60 H MET 60 -13.489 -15.792 4.069 461 HA MET 60 HA MET 60 -12.123 -13.192 3.580 462 HB2 MET 60 HB2 MET 60 -11.350 -16.026 2.808 463 HB3 MET 60 HB3 MET 60 -10.380 -14.589 2.482 464 HG2 MET 60 HG2 MET 60 -11.144 -15.285 5.322 465 HG3 MET 60 HG3 MET 60 -9.864 -16.178 4.508 466 HE1 MET 60 HE1 MET 60 -10.441 -12.266 3.880 467 HE2 MET 60 HE2 MET 60 -11.083 -12.610 5.512 468 HE3 MET 60 HE3 MET 60 -9.604 -11.623 5.297 469 H CYS 61 H CYS 61 -14.186 -15.715 2.241 470 HA CYS 61 HA CYS 61 -13.852 -14.921 -0.514 471 HB2 CYS 61 HB2 CYS 61 -16.114 -16.378 0.973 472 HB3 CYS 61 HB3 CYS 61 -15.979 -16.263 -0.789 473 HG CYS 61 HG CYS 61 -13.758 -17.514 1.319 474 H GLN 62 H GLN 62 -16.268 -14.045 2.068 475 HA GLN 62 HA GLN 62 -17.756 -12.314 0.303 476 HB2 GLN 62 HB2 GLN 62 -17.564 -12.285 3.341 477 HB3 GLN 62 HB3 GLN 62 -18.851 -11.586 2.344 478 HG2 GLN 62 HG2 GLN 62 -19.509 -13.815 1.554 479 HG3 GLN 62 HG3 GLN 62 -18.164 -14.540 2.440 480 HE21 GLN 62 HE22 GLN 62 -19.726 -15.863 3.467 481 HE22 GLN 62 HE21 GLN 62 -20.695 -15.232 4.755 482 H GLN 63 H GLN 63 -14.661 -11.974 1.819 483 HA GLN 63 HA GLN 63 -14.844 -9.037 1.970 484 HB2 GLN 63 HB2 GLN 63 -12.582 -11.007 2.471 485 HB3 GLN 63 HB3 GLN 63 -12.442 -9.260 2.700 486 HG2 GLN 63 HG2 GLN 63 -14.519 -10.951 4.155 487 HG3 GLN 63 HG3 GLN 63 -12.888 -10.660 4.776 488 HE21 GLN 63 HE22 GLN 63 -13.982 -9.692 6.630 489 HE22 GLN 63 HE21 GLN 63 -14.484 -8.025 6.531 490 H GLY 64 H GLY 64 -13.579 -11.574 -0.180 491 HA2 GLY 64 HA2 GLY 64 -11.937 -9.697 -1.702 492 HA3 GLY 64 HA3 GLY 64 -12.293 -11.382 -2.100 493 H LEU 65 H LEU 65 -15.222 -11.031 -1.870 494 HA LEU 65 HA LEU 65 -15.820 -10.161 -4.530 495 HB2 LEU 65 HB2 LEU 65 -17.466 -10.878 -2.087 496 HB3 LEU 65 HB3 LEU 65 -18.221 -10.402 -3.601 497 HG LEU 65 HG LEU 65 -16.247 -12.722 -3.404 498 HD11 LEU 65 HD11 LEU 65 -19.292 -12.719 -3.494 499 HD12 LEU 65 HD12 LEU 65 -18.236 -14.156 -3.548 500 HD13 LEU 65 HD13 LEU 65 -18.299 -13.155 -2.081 501 HD21 LEU 65 HD21 LEU 65 -16.412 -11.759 -5.655 502 HD22 LEU 65 HD22 LEU 65 -17.236 -13.327 -5.590 503 HD23 LEU 65 HD23 LEU 65 -18.186 -11.827 -5.571 504 H ARG 66 H ARG 66 -14.965 -8.294 -1.913 505 HA ARG 66 HA ARG 66 -16.738 -6.012 -2.515 506 HB2 ARG 66 HB2 ARG 66 -14.362 -6.277 -0.631 507 HB3 ARG 66 HB3 ARG 66 -15.523 -4.953 -0.678 508 HG2 ARG 66 HG2 ARG 66 -17.328 -6.489 0.025 509 HG3 ARG 66 HG3 ARG 66 -16.183 -7.846 0.007 510 HD2 ARG 66 HD2 ARG 66 -16.469 -7.049 2.293 511 HD3 ARG 66 HD3 ARG 66 -14.815 -6.727 1.735 512 HE ARG 66 HE ARG 66 -16.544 -4.463 1.248 513 HH11 ARG 66 HH11 ARG 66 -14.774 -6.156 3.805 514 HH12 ARG 66 HH12 ARG 66 -14.582 -4.714 4.780 515 HH21 ARG 66 HH21 ARG 66 -16.276 -2.600 2.549 516 HH22 ARG 66 HH22 ARG 66 -15.450 -2.721 4.082 517 H TYR 67 H TYR 67 -14.141 -7.374 -4.015 518 HA TYR 67 HA TYR 67 -12.882 -4.783 -4.783 519 HB2 TYR 67 HB2 TYR 67 -11.488 -7.314 -3.879 520 HB3 TYR 67 HB3 TYR 67 -10.663 -5.883 -4.487 521 HD1 TYR 67 HD1 TYR 67 -11.492 -3.601 -3.206 522 HD2 TYR 67 HD2 TYR 67 -11.548 -7.587 -1.597 523 HE1 TYR 67 HE1 TYR 67 -11.519 -2.667 -0.902 524 HE2 TYR 67 HE2 TYR 67 -11.584 -6.663 0.705 525 HH TYR 67 HH TYR 67 -11.559 -3.128 1.334 526 H THR 68 H THR 68 -14.564 -7.399 -5.843 527 HA THR 68 HA THR 68 -12.964 -7.903 -8.249 528 HB THR 68 HB THR 68 -14.925 -9.478 -8.740 529 HG1 THR 68 HG1 THR 68 -16.176 -9.964 -6.914 530 HG21 THR 68 HG21 THR 68 -13.345 -9.851 -6.173 531 HG22 THR 68 HG22 THR 68 -13.943 -11.126 -7.247 532 HG23 THR 68 HG23 THR 68 -12.657 -10.022 -7.810 533 H SER 69 H SER 69 -14.231 -5.226 -7.703 534 HA SER 69 HA SER 69 -16.142 -4.703 -9.757 535 HB2 SER 69 HB2 SER 69 -13.912 -2.943 -8.652 536 HB3 SER 69 HB3 SER 69 -15.356 -2.384 -9.524 537 HG SER 69 HG SER 69 -15.593 -2.240 -7.251 538 H THR 70 H THR 70 -14.783 -2.731 -11.376 539 HA THR 70 HA THR 70 -13.750 -2.644 -13.405 540 HB THR 70 HB THR 70 -11.420 -3.130 -13.434 541 HG1 THR 70 HG1 THR 70 -12.007 -4.911 -11.343 542 HG21 THR 70 HG21 THR 70 -10.616 -2.131 -11.365 543 HG22 THR 70 HG22 THR 70 -12.113 -1.315 -11.875 544 HG23 THR 70 HG23 THR 70 -12.150 -2.505 -10.543 545 H ALA 71 H ALA 71 -11.853 -4.665 -14.490 546 HA ALA 71 HA ALA 71 -13.675 -6.962 -15.000 547 HB1 ALA 71 HB1 ALA 71 -12.116 -5.383 -17.082 548 HB2 ALA 71 HB2 ALA 71 -13.084 -6.843 -17.385 549 HB3 ALA 71 HB3 ALA 71 -13.884 -5.341 -16.859 550 H GLU 72 H GLU 72 -10.812 -5.995 -13.722 551 HA GLU 72 HA GLU 72 -8.995 -7.882 -14.954 552 HB2 GLU 72 HB2 GLU 72 -8.832 -6.333 -12.361 553 HB3 GLU 72 HB3 GLU 72 -7.492 -7.212 -13.108 554 HG2 GLU 72 HG2 GLU 72 -7.706 -5.764 -15.132 555 HG3 GLU 72 HG3 GLU 72 -8.979 -4.846 -14.309 556 H HIS 73 H HIS 73 -11.646 -8.405 -13.043 557 HA HIS 73 HA HIS 73 -10.466 -10.808 -11.749 558 HB2 HIS 73 HB2 HIS 73 -12.475 -9.099 -10.293 559 HB3 HIS 73 HB3 HIS 73 -11.334 -10.269 -9.642 560 HD2 HIS 73 HD2 HIS 73 -11.858 -6.650 -9.961 561 HE1 HIS 73 HE1 HIS 73 -7.676 -6.990 -9.376 562 HE2 HIS 73 HE2 HIS 73 -9.638 -5.381 -9.405 563 H VAL 74 H VAL 74 -12.203 -10.313 -14.152 564 HA VAL 74 HA VAL 74 -14.924 -10.630 -13.707 565 HB VAL 74 HB VAL 74 -13.724 -10.105 -15.825 566 HG11 VAL 74 HG11 VAL 74 -13.349 -13.115 -16.041 567 HG12 VAL 74 HG12 VAL 74 -12.979 -11.917 -17.297 568 HG13 VAL 74 HG13 VAL 74 -12.051 -11.919 -15.782 569 HG21 VAL 74 HG21 VAL 74 -16.147 -10.656 -15.782 570 HG22 VAL 74 HG22 VAL 74 -15.370 -11.154 -17.301 571 HG23 VAL 74 HG23 VAL 74 -15.737 -12.366 -16.065 572 H ALA 75 H ALA 75 -12.453 -13.080 -13.320 573 HA ALA 75 HA ALA 75 -14.564 -15.189 -13.143 574 HB1 ALA 75 HB1 ALA 75 -11.524 -15.390 -13.141 575 HB2 ALA 75 HB2 ALA 75 -12.666 -16.755 -13.139 576 HB3 ALA 75 HB3 ALA 75 -12.585 -15.667 -14.537 577 H ILE 76 H ILE 76 -12.002 -13.566 -11.176 578 HA ILE 76 HA ILE 76 -12.383 -15.141 -8.827 579 HB ILE 76 HB ILE 76 -11.585 -12.217 -9.139 580 HG12 ILE 76 HG12 ILE 76 -9.916 -14.756 -8.962 581 HG13 ILE 76 HG13 ILE 76 -10.105 -13.717 -10.377 582 HG21 ILE 76 HG21 ILE 76 -11.169 -14.127 -6.811 583 HG22 ILE 76 HG22 ILE 76 -10.548 -12.472 -6.916 584 HG23 ILE 76 HG23 ILE 76 -12.286 -12.737 -6.828 585 HD11 ILE 76 HD11 ILE 76 -7.985 -13.216 -9.374 586 HD12 ILE 76 HD12 ILE 76 -9.069 -11.823 -9.129 587 HD13 ILE 76 HD13 ILE 76 -8.725 -12.950 -7.787 588 H ARG 77 H ARG 77 -14.204 -12.512 -10.304 589 HA ARG 77 HA ARG 77 -15.848 -11.662 -8.185 590 HB2 ARG 77 HB2 ARG 77 -15.563 -10.665 -10.479 591 HB3 ARG 77 HB3 ARG 77 -16.504 -12.010 -11.141 592 HG2 ARG 77 HG2 ARG 77 -18.448 -11.298 -9.735 593 HG3 ARG 77 HG3 ARG 77 -17.474 -9.929 -9.140 594 HD2 ARG 77 HD2 ARG 77 -17.177 -9.160 -11.480 595 HD3 ARG 77 HD3 ARG 77 -18.106 -10.553 -12.050 596 HE ARG 77 HE ARG 77 -20.095 -9.528 -11.381 597 HH11 ARG 77 HH11 ARG 77 -17.336 -7.685 -10.132 598 HH12 ARG 77 HH12 ARG 77 -18.329 -6.344 -9.628 599 HH21 ARG 77 HH21 ARG 77 -21.343 -7.743 -10.731 600 HH22 ARG 77 HH22 ARG 77 -20.584 -6.372 -9.959 601 H SER 78 H SER 78 -15.740 -14.704 -9.809 602 HA SER 78 HA SER 78 -18.353 -15.475 -8.568 603 HB2 SER 78 HB2 SER 78 -17.115 -16.391 -11.199 604 HB3 SER 78 HB3 SER 78 -18.596 -17.068 -10.472 605 HG SER 78 HG SER 78 -19.027 -15.411 -12.029 606 H LYS 79 H LYS 79 -14.907 -16.135 -8.707 607 HA LYS 79 HA LYS 79 -15.197 -18.928 -7.988 608 HB2 LYS 79 HB2 LYS 79 -12.885 -16.954 -7.891 609 HB3 LYS 79 HB3 LYS 79 -12.758 -18.599 -7.292 610 HG2 LYS 79 HG2 LYS 79 -13.333 -17.753 -10.154 611 HG3 LYS 79 HG3 LYS 79 -11.883 -18.542 -9.532 612 HD2 LYS 79 HD2 LYS 79 -14.652 -19.725 -9.905 613 HD3 LYS 79 HD3 LYS 79 -13.117 -20.243 -10.622 614 HE2 LYS 79 HE2 LYS 79 -12.323 -20.806 -8.262 615 HE3 LYS 79 HE3 LYS 79 -13.989 -20.497 -7.708 616 HZ1 LYS 79 HZ1 LYS 79 -13.621 -22.825 -8.183 617 HZ2 LYS 79 HZ2 LYS 79 -14.744 -22.203 -9.219 618 HZ3 LYS 79 HZ3 LYS 79 -13.218 -22.493 -9.738 619 H LEU 80 H LEU 80 -15.050 -15.847 -6.147 620 HA LEU 80 HA LEU 80 -14.650 -17.237 -3.620 621 HB2 LEU 80 HB2 LEU 80 -15.343 -14.427 -4.492 622 HB3 LEU 80 HB3 LEU 80 -15.427 -14.905 -2.787 623 HG LEU 80 HG LEU 80 -13.087 -15.441 -2.713 624 HD11 LEU 80 HD11 LEU 80 -13.052 -14.888 -5.701 625 HD12 LEU 80 HD12 LEU 80 -11.602 -15.045 -4.695 626 HD13 LEU 80 HD13 LEU 80 -12.674 -16.431 -4.894 627 HD21 LEU 80 HD21 LEU 80 -12.118 -13.228 -3.305 628 HD22 LEU 80 HD22 LEU 80 -13.588 -12.843 -4.223 629 HD23 LEU 80 HD23 LEU 80 -13.672 -13.083 -2.457 630 H GLN 81 H GLN 81 -17.339 -16.346 -5.716 631 HA GLN 81 HA GLN 81 -19.408 -16.857 -3.739 632 HB2 GLN 81 HB2 GLN 81 -19.162 -16.122 -6.555 633 HB3 GLN 81 HB3 GLN 81 -20.336 -17.435 -6.375 634 HG2 GLN 81 HG2 GLN 81 -20.387 -14.871 -4.736 635 HG3 GLN 81 HG3 GLN 81 -21.432 -15.200 -6.122 636 HE21 GLN 81 HE22 GLN 81 -21.245 -15.452 -2.762 637 HE22 GLN 81 HE21 GLN 81 -22.538 -16.615 -2.561 638 H TYR 82 H TYR 82 -17.765 -18.709 -6.323 639 HA TYR 82 HA TYR 82 -19.223 -21.123 -6.112 640 HB2 TYR 82 HB2 TYR 82 -17.759 -20.679 -7.979 641 HB3 TYR 82 HB3 TYR 82 -16.420 -20.321 -6.918 642 HD1 TYR 82 HD1 TYR 82 -15.195 -22.124 -5.737 643 HD2 TYR 82 HD2 TYR 82 -18.294 -22.968 -8.603 644 HE1 TYR 82 HE1 TYR 82 -14.389 -24.478 -5.924 645 HE2 TYR 82 HE2 TYR 82 -17.495 -25.313 -8.792 646 HH TYR 82 HH TYR 82 -14.689 -26.524 -6.900 647 H ARG 83 H ARG 83 -16.121 -20.160 -4.451 648 HA ARG 83 HA ARG 83 -16.032 -22.698 -3.068 649 HB2 ARG 83 HB2 ARG 83 -14.567 -20.077 -2.943 650 HB3 ARG 83 HB3 ARG 83 -14.364 -21.235 -1.601 651 HG2 ARG 83 HG2 ARG 83 -13.679 -21.637 -4.540 652 HG3 ARG 83 HG3 ARG 83 -12.564 -21.494 -3.184 653 HD2 ARG 83 HD2 ARG 83 -13.507 -23.587 -2.204 654 HD3 ARG 83 HD3 ARG 83 -14.539 -23.767 -3.634 655 HE ARG 83 HE ARG 83 -11.867 -23.466 -4.524 656 HH11 ARG 83 HH11 ARG 83 -13.867 -25.799 -2.766 657 HH12 ARG 83 HH12 ARG 83 -12.939 -27.167 -3.305 658 HH21 ARG 83 HH21 ARG 83 -10.669 -25.278 -5.200 659 HH22 ARG 83 HH22 ARG 83 -11.120 -26.878 -4.664 660 H LEU 84 H LEU 84 -17.485 -19.535 -2.313 661 HA LEU 84 HA LEU 84 -18.081 -20.178 0.423 662 HB2 LEU 84 HB2 LEU 84 -18.025 -17.933 -0.573 663 HB3 LEU 84 HB3 LEU 84 -19.450 -18.302 -1.555 664 HG LEU 84 HG LEU 84 -19.534 -18.566 1.459 665 HD11 LEU 84 HD11 LEU 84 -20.253 -16.187 1.554 666 HD12 LEU 84 HD12 LEU 84 -18.580 -16.337 0.957 667 HD13 LEU 84 HD13 LEU 84 -19.915 -16.023 -0.177 668 HD21 LEU 84 HD21 LEU 84 -21.515 -19.359 0.232 669 HD22 LEU 84 HD22 LEU 84 -21.891 -17.886 1.129 670 HD23 LEU 84 HD23 LEU 84 -21.620 -17.809 -0.628 671 H GLU 85 H GLU 85 -19.682 -20.697 -2.717 672 HA GLU 85 HA GLU 85 -22.179 -21.679 -1.758 673 HB2 GLU 85 HB2 GLU 85 -20.672 -21.678 -4.354 674 HB3 GLU 85 HB3 GLU 85 -22.040 -22.764 -4.200 675 HG2 GLU 85 HG2 GLU 85 -23.487 -20.891 -3.500 676 HG3 GLU 85 HG3 GLU 85 -22.135 -19.766 -3.704 677 H LEU 86 H LEU 86 -19.070 -23.154 -1.591 678 HA LEU 86 HA LEU 86 -20.389 -25.812 -1.198 679 HB2 LEU 86 HB2 LEU 86 -17.615 -25.128 -2.233 680 HB3 LEU 86 HB3 LEU 86 -18.013 -26.693 -1.545 681 HG LEU 86 HG LEU 86 -18.122 -27.001 -3.844 682 HD11 LEU 86 HD11 LEU 86 -20.405 -27.652 -4.287 683 HD12 LEU 86 HD12 LEU 86 -20.038 -27.982 -2.577 684 HD13 LEU 86 HD13 LEU 86 -21.019 -26.567 -3.028 685 HD21 LEU 86 HD21 LEU 86 -19.440 -25.662 -5.398 686 HD22 LEU 86 HD22 LEU 86 -19.921 -24.564 -4.085 687 HD23 LEU 86 HD23 LEU 86 -18.210 -24.680 -4.573 688 H ALA 87 H ALA 87 -18.439 -23.237 0.210 689 HA ALA 87 HA ALA 87 -17.324 -24.789 2.340 690 HB1 ALA 87 HB1 ALA 87 -17.008 -22.604 3.418 691 HB2 ALA 87 HB2 ALA 87 -16.547 -22.513 1.712 692 HB3 ALA 87 HB3 ALA 87 -18.104 -21.841 2.245 693 H GLN 88 H GLN 88 -20.444 -23.111 1.864 694 HA GLN 88 HA GLN 88 -21.397 -23.571 4.541 695 HB2 GLN 88 HB2 GLN 88 -22.794 -22.873 1.923 696 HB3 GLN 88 HB3 GLN 88 -23.557 -22.842 3.531 697 HG2 GLN 88 HG2 GLN 88 -21.867 -21.165 4.287 698 HG3 GLN 88 HG3 GLN 88 -21.183 -21.141 2.662 699 HE21 GLN 88 HE22 GLN 88 -22.443 -18.941 4.210 700 HE22 GLN 88 HE21 GLN 88 -23.775 -18.368 3.227 701 H GLY 89 H GLY 89 -20.552 -25.829 2.398 702 HA2 GLY 89 HA2 GLY 89 -22.642 -27.728 3.306 703 HA3 GLY 89 HA3 GLY 89 -22.244 -27.615 1.574 704 H ALA 90 H ALA 90 -19.601 -26.968 3.692 705 HA ALA 90 HA ALA 90 -18.702 -29.795 3.722 706 HB1 ALA 90 HB1 ALA 90 -16.502 -29.134 2.835 707 HB2 ALA 90 HB2 ALA 90 -17.792 -28.765 1.659 708 HB3 ALA 90 HB3 ALA 90 -17.075 -27.461 2.637 709 H VAL 91 H VAL 91 -18.903 -26.650 5.165 710 HA VAL 91 HA VAL 91 -16.824 -26.790 7.077 711 HB VAL 91 HB VAL 91 -18.232 -24.839 6.475 712 HG11 VAL 91 HG11 VAL 91 -20.422 -24.517 7.519 713 HG12 VAL 91 HG12 VAL 91 -20.441 -25.942 6.452 714 HG13 VAL 91 HG13 VAL 91 -20.359 -26.153 8.210 715 HG21 VAL 91 HG21 VAL 91 -16.866 -24.869 8.554 716 HG22 VAL 91 HG22 VAL 91 -18.324 -23.865 8.703 717 HG23 VAL 91 HG23 VAL 91 -18.287 -25.473 9.446 718 H GLY 92 H GLY 92 -19.670 -28.663 6.745 719 HA2 GLY 92 HA2 GLY 92 -19.454 -29.675 9.551 720 HA3 GLY 92 HA3 GLY 92 -20.980 -29.566 8.651 721 H SER 93 H SER 93 -18.070 -30.534 6.938 722 HA SER 93 HA SER 93 -18.757 -33.419 7.117 723 HB2 SER 93 HB2 SER 93 -18.527 -31.839 4.523 724 HB3 SER 93 HB3 SER 93 -18.732 -33.599 4.662 725 HG SER 93 HG SER 93 -20.717 -32.503 4.300 726 H VAL 94 H VAL 94 -17.047 -34.608 5.571 727 HA VAL 94 HA VAL 94 -14.442 -33.316 5.669 728 HB VAL 94 HB VAL 94 -14.726 -34.355 7.856 729 HG11 VAL 94 HG11 VAL 94 -16.272 -36.208 7.219 730 HG12 VAL 94 HG12 VAL 94 -14.905 -37.045 6.450 731 HG13 VAL 94 HG13 VAL 94 -14.887 -36.743 8.193 732 HG21 VAL 94 HG21 VAL 94 -12.628 -35.656 7.844 733 HG22 VAL 94 HG22 VAL 94 -12.758 -35.853 6.080 734 HG23 VAL 94 HG23 VAL 94 -12.493 -34.234 6.779 735 H GLN 95 H GLN 95 -13.680 -33.549 3.777 736 HA GLN 95 HA GLN 95 -13.829 -36.116 2.334 737 HB2 GLN 95 HB2 GLN 95 -14.477 -34.983 0.259 738 HB3 GLN 95 HB3 GLN 95 -15.689 -34.755 1.543 739 HG2 GLN 95 HG2 GLN 95 -13.620 -32.629 1.068 740 HG3 GLN 95 HG3 GLN 95 -15.083 -32.721 0.074 741 HE21 GLN 95 HE22 GLN 95 -13.868 -31.275 2.842 742 HE22 GLN 95 HE21 GLN 95 -15.370 -31.109 3.723 743 H ILE 96 H ILE 96 -11.855 -34.190 3.804 744 HA ILE 96 HA ILE 96 -9.633 -34.582 1.907 745 HB ILE 96 HB ILE 96 -8.786 -32.283 2.484 746 HG12 ILE 96 HG12 ILE 96 -11.622 -31.814 3.498 747 HG13 ILE 96 HG13 ILE 96 -10.178 -31.966 4.519 748 HG21 ILE 96 HG21 ILE 96 -11.458 -32.271 1.034 749 HG22 ILE 96 HG22 ILE 96 -10.117 -31.131 0.822 750 HG23 ILE 96 HG23 ILE 96 -9.923 -32.814 0.325 751 HD11 ILE 96 HD11 ILE 96 -10.666 -29.816 2.420 752 HD12 ILE 96 HD12 ILE 96 -10.697 -29.612 4.178 753 HD13 ILE 96 HD13 ILE 96 -9.175 -30.009 3.362 754 HA PRO 97 HA PRO 97 -7.370 -35.872 5.467 755 HB2 PRO 97 HB2 PRO 97 -5.347 -33.748 4.788 756 HB3 PRO 97 HB3 PRO 97 -5.070 -35.480 5.167 757 HG2 PRO 97 HG2 PRO 97 -4.994 -34.636 2.599 758 HG3 PRO 97 HG3 PRO 97 -5.864 -36.152 3.016 759 HD2 PRO 97 HD2 PRO 97 -7.013 -33.399 2.526 760 HD3 PRO 97 HD3 PRO 97 -7.596 -34.990 1.942 761 H VAL 98 H VAL 98 -6.840 -35.329 7.599 762 HA VAL 98 HA VAL 98 -7.205 -32.555 8.511 763 HB VAL 98 HB VAL 98 -8.813 -33.306 10.285 764 HG11 VAL 98 HG11 VAL 98 -10.799 -33.271 8.880 765 HG12 VAL 98 HG12 VAL 98 -9.594 -32.137 8.238 766 HG13 VAL 98 HG13 VAL 98 -9.846 -33.708 7.451 767 HG21 VAL 98 HG21 VAL 98 -8.343 -35.751 10.164 768 HG22 VAL 98 HG22 VAL 98 -10.069 -35.383 9.972 769 HG23 VAL 98 HG23 VAL 98 -9.094 -35.802 8.556 770 H VAL 99 H VAL 99 -5.691 -35.523 8.615 771 HA VAL 99 HA VAL 99 -4.366 -36.673 9.995 772 HB VAL 99 HB VAL 99 -2.371 -35.449 10.659 773 HG11 VAL 99 HG11 VAL 99 -3.575 -34.500 8.015 774 HG12 VAL 99 HG12 VAL 99 -1.846 -34.541 8.426 775 HG13 VAL 99 HG13 VAL 99 -2.758 -36.057 8.298 776 HG21 VAL 99 HG21 VAL 99 -3.893 -32.911 9.917 777 HG22 VAL 99 HG22 VAL 99 -3.459 -33.404 11.574 778 HG23 VAL 99 HG23 VAL 99 -2.185 -33.036 10.394 779 H GLU 100 H GLU 100 -6.839 -35.571 11.464 780 HA GLU 100 HA GLU 100 -6.130 -35.143 14.157 781 HB2 GLU 100 HB2 GLU 100 -8.423 -35.176 12.583 782 HB3 GLU 100 HB3 GLU 100 -8.658 -36.585 13.634 783 HG2 GLU 100 HG2 GLU 100 -8.136 -35.122 15.607 784 HG3 GLU 100 HG3 GLU 100 -7.953 -33.755 14.484 785 H VAL 101 H VAL 101 -6.822 -36.701 15.949 786 HA VAL 101 HA VAL 101 -6.315 -39.545 15.336 787 HB VAL 101 HB VAL 101 -4.742 -37.924 17.387 788 HG11 VAL 101 HG11 VAL 101 -5.193 -40.189 18.210 789 HG12 VAL 101 HG12 VAL 101 -4.641 -40.877 16.663 790 HG13 VAL 101 HG13 VAL 101 -3.497 -40.043 17.738 791 HG21 VAL 101 HG21 VAL 101 -3.876 -37.548 15.115 792 HG22 VAL 101 HG22 VAL 101 -2.764 -38.582 16.033 793 HG23 VAL 101 HG23 VAL 101 -3.850 -39.304 14.822 794 H ASP 102 H ASP 102 -7.253 -40.950 16.857 795 HA ASP 102 HA ASP 102 -8.595 -39.822 19.225 796 HB2 ASP 102 HB2 ASP 102 -10.131 -39.540 17.258 797 HB3 ASP 102 HB3 ASP 102 -10.075 -41.289 17.023 798 H GLU 103 H GLU 103 -9.321 -41.505 20.687 799 HA GLU 103 HA GLU 103 -8.312 -44.231 20.143 800 HB2 GLU 103 HB2 GLU 103 -7.815 -42.789 22.762 801 HB3 GLU 103 HB3 GLU 103 -7.147 -44.320 22.188 802 HG2 GLU 103 HG2 GLU 103 -6.035 -43.010 20.308 803 HG3 GLU 103 HG3 GLU 103 -6.515 -41.537 21.156 804 H LEU 104 H LEU 104 -8.890 -45.537 22.339 805 HA LEU 104 HA LEU 104 -11.712 -45.745 22.414 806 HB2 LEU 104 HB2 LEU 104 -11.094 -47.208 24.480 807 HB3 LEU 104 HB3 LEU 104 -10.631 -47.710 22.862 808 HG LEU 104 HG LEU 104 -8.323 -46.946 23.255 809 HD11 LEU 104 HD11 LEU 104 -9.330 -46.267 26.047 810 HD12 LEU 104 HD12 LEU 104 -7.620 -46.369 25.579 811 HD13 LEU 104 HD13 LEU 104 -8.652 -45.121 24.863 812 HD21 LEU 104 HD21 LEU 104 -9.025 -49.241 23.822 813 HD22 LEU 104 HD22 LEU 104 -7.740 -48.660 24.899 814 HD23 LEU 104 HD23 LEU 104 -9.426 -48.712 25.470 815 HA PRO 105 HA PRO 105 -12.918 -42.872 25.474 816 HB2 PRO 105 HB2 PRO 105 -15.177 -43.973 26.509 817 HB3 PRO 105 HB3 PRO 105 -15.054 -43.514 24.777 818 HG2 PRO 105 HG2 PRO 105 -14.622 -46.244 26.013 819 HG3 PRO 105 HG3 PRO 105 -15.662 -45.820 24.613 820 HD2 PRO 105 HD2 PRO 105 -13.106 -46.773 24.315 821 HD3 PRO 105 HD3 PRO 105 -13.800 -45.570 23.198 822 H GLU 106 H GLU 106 -10.829 -44.841 26.327 823 HA GLU 106 HA GLU 106 -9.752 -45.538 28.160 824 HB2 GLU 106 HB2 GLU 106 -10.103 -43.036 28.538 825 HB3 GLU 106 HB3 GLU 106 -11.321 -43.488 29.744 826 HG2 GLU 106 HG2 GLU 106 -9.599 -44.787 30.980 827 HG3 GLU 106 HG3 GLU 106 -8.409 -44.401 29.729 828 H GLY 107 H GLY 107 -12.290 -46.909 27.512 829 HA2 GLY 107 HA2 GLY 107 -12.305 -48.678 29.758 830 HA3 GLY 107 HA3 GLY 107 -13.745 -47.645 29.802 831 H TYR 108 H TYR 108 -13.751 -47.554 26.759 832 HA TYR 108 HA TYR 108 -15.124 -48.489 25.219 833 HB2 TYR 108 HB2 TYR 108 -14.240 -50.532 24.249 834 HB3 TYR 108 HB3 TYR 108 -13.014 -49.321 24.579 835 HD1 TYR 108 HD1 TYR 108 -11.380 -49.607 26.371 836 HD2 TYR 108 HD2 TYR 108 -14.207 -52.682 25.381 837 HE1 TYR 108 HE1 TYR 108 -10.003 -51.265 27.629 838 HE2 TYR 108 HE2 TYR 108 -12.865 -54.342 26.653 839 HH TYR 108 HH TYR 108 -9.809 -53.447 28.310 840 H ASP 109 H ASP 109 -15.933 -51.135 24.681 841 HA ASP 109 HA ASP 109 -18.236 -51.265 26.393 842 HB2 ASP 109 HB2 ASP 109 -17.264 -53.111 24.200 843 HB3 ASP 109 HB3 ASP 109 -18.876 -53.157 24.927 844 H ARG 110 H ARG 110 -15.422 -51.933 27.412 845 HA ARG 110 HA ARG 110 -14.259 -53.442 28.616 846 HB2 ARG 110 HB2 ARG 110 -17.000 -53.961 29.804 847 HB3 ARG 110 HB3 ARG 110 -15.428 -54.278 30.560 848 HG2 ARG 110 HG2 ARG 110 -14.870 -51.868 30.444 849 HG3 ARG 110 HG3 ARG 110 -16.477 -51.540 29.751 850 HD2 ARG 110 HD2 ARG 110 -17.545 -52.482 31.768 851 HD3 ARG 110 HD3 ARG 110 -15.952 -52.802 32.468 852 HE ARG 110 HE ARG 110 -17.315 -50.218 32.247 853 HH11 ARG 110 HH11 ARG 110 -14.222 -51.848 32.770 854 HH12 ARG 110 HH12 ARG 110 -13.497 -50.472 33.556 855 HH21 ARG 110 HH21 ARG 110 -16.330 -48.428 33.245 856 HH22 ARG 110 HH22 ARG 110 -14.681 -48.532 33.807 857 H SER 111 H SER 111 -15.502 -54.549 26.059 858 HA SER 111 HA SER 111 -14.750 -57.341 26.604 859 HB2 SER 111 HB2 SER 111 -16.763 -58.243 25.542 860 HB3 SER 111 HB3 SER 111 -17.196 -57.302 26.983 861 HG SER 111 HG SER 111 -18.518 -56.793 25.175 Start of MODEL 18 1 H1 SER 2 H1 SER 2 7.833 -2.400 -3.097 2 H2 SER 2 H2 SER 2 8.718 -3.563 -3.853 3 H3 SER 2 H3 SER 2 8.439 -3.667 -2.233 4 HA SER 2 HA SER 2 6.108 -3.956 -2.576 5 HB2 SER 2 HB2 SER 2 6.855 -3.903 -5.527 6 HB3 SER 2 HB3 SER 2 5.240 -4.250 -4.849 7 HG SER 2 HG SER 2 5.493 -2.049 -5.483 8 H GLN 3 H GLN 3 5.429 -6.049 -2.334 9 HA GLN 3 HA GLN 3 7.019 -8.213 -3.595 10 HB2 GLN 3 HB2 GLN 3 6.462 -7.979 -0.603 11 HB3 GLN 3 HB3 GLN 3 7.122 -9.408 -1.414 12 HG2 GLN 3 HG2 GLN 3 9.063 -8.054 -2.187 13 HG3 GLN 3 HG3 GLN 3 8.426 -6.658 -1.310 14 HE21 GLN 3 HE22 GLN 3 10.858 -7.190 -0.534 15 HE22 GLN 3 HE21 GLN 3 10.931 -8.083 0.963 16 H PHE 4 H PHE 4 4.122 -6.877 -3.453 17 HA PHE 4 HA PHE 4 2.308 -8.790 -2.467 18 HB2 PHE 4 HB2 PHE 4 1.886 -6.433 -3.218 19 HB3 PHE 4 HB3 PHE 4 2.010 -6.959 -4.885 20 HD1 PHE 4 HD2 PHE 4 0.385 -8.900 -5.621 21 HD2 PHE 4 HD1 PHE 4 -0.191 -6.419 -2.162 22 HE1 PHE 4 HE2 PHE 4 -2.010 -9.532 -5.557 23 HE2 PHE 4 HE1 PHE 4 -2.605 -6.992 -2.141 24 HZ PHE 4 HZ PHE 4 -3.515 -8.568 -3.841 25 H GLU 5 H GLU 5 4.105 -8.643 -5.504 26 HA GLU 5 HA GLU 5 2.684 -11.060 -6.518 27 HB2 GLU 5 HB2 GLU 5 4.424 -8.981 -7.903 28 HB3 GLU 5 HB3 GLU 5 3.717 -10.409 -8.688 29 HG2 GLU 5 HG2 GLU 5 1.449 -9.642 -8.049 30 HG3 GLU 5 HG3 GLU 5 2.156 -8.188 -7.317 31 H LYS 6 H LYS 6 5.148 -10.648 -4.489 32 HA LYS 6 HA LYS 6 6.967 -12.569 -5.839 33 HB2 LYS 6 HB2 LYS 6 7.837 -10.365 -5.248 34 HB3 LYS 6 HB3 LYS 6 7.486 -10.711 -3.548 35 HG2 LYS 6 HG2 LYS 6 9.025 -12.579 -3.528 36 HG3 LYS 6 HG3 LYS 6 9.193 -12.505 -5.314 37 HD2 LYS 6 HD2 LYS 6 10.110 -10.266 -5.168 38 HD3 LYS 6 HD3 LYS 6 9.931 -10.262 -3.404 39 HE2 LYS 6 HE2 LYS 6 11.510 -12.185 -3.248 40 HE3 LYS 6 HE3 LYS 6 11.685 -12.178 -5.010 41 HZ1 LYS 6 HZ1 LYS 6 12.607 -9.968 -4.862 42 HZ2 LYS 6 HZ2 LYS 6 12.437 -9.955 -3.221 43 HZ3 LYS 6 HZ3 LYS 6 13.479 -11.002 -3.937 44 H GLN 7 H GLN 7 5.554 -11.779 -2.564 45 HA GLN 7 HA GLN 7 6.328 -14.351 -1.524 46 HB2 GLN 7 HB2 GLN 7 5.472 -11.885 -0.520 47 HB3 GLN 7 HB3 GLN 7 4.094 -12.946 -0.193 48 HG2 GLN 7 HG2 GLN 7 6.983 -13.439 0.591 49 HG3 GLN 7 HG3 GLN 7 5.670 -12.971 1.689 50 HE21 GLN 7 HE22 GLN 7 3.630 -14.532 1.440 51 HE22 GLN 7 HE21 GLN 7 4.021 -16.239 1.422 52 H LYS 8 H LYS 8 3.416 -12.963 -2.956 53 HA LYS 8 HA LYS 8 1.556 -15.035 -2.293 54 HB2 LYS 8 HB2 LYS 8 1.122 -12.627 -2.873 55 HB3 LYS 8 HB3 LYS 8 1.657 -12.976 -4.486 56 HG2 LYS 8 HG2 LYS 8 -0.297 -14.776 -4.469 57 HG3 LYS 8 HG3 LYS 8 -0.899 -13.854 -3.102 58 HD2 LYS 8 HD2 LYS 8 -1.897 -13.093 -5.209 59 HD3 LYS 8 HD3 LYS 8 -0.882 -11.801 -4.527 60 HE2 LYS 8 HE2 LYS 8 0.917 -12.285 -6.046 61 HE3 LYS 8 HE3 LYS 8 0.191 -13.822 -6.529 62 HZ1 LYS 8 HZ1 LYS 8 -0.889 -11.145 -7.134 63 HZ2 LYS 8 HZ2 LYS 8 -0.109 -12.136 -8.188 64 HZ3 LYS 8 HZ3 LYS 8 -1.579 -12.570 -7.588 65 H GLU 9 H GLU 9 4.076 -14.833 -4.632 66 HA GLU 9 HA GLU 9 2.896 -17.075 -6.204 67 HB2 GLU 9 HB2 GLU 9 4.489 -14.667 -7.095 68 HB3 GLU 9 HB3 GLU 9 4.133 -16.079 -8.140 69 HG2 GLU 9 HG2 GLU 9 1.722 -15.722 -7.803 70 HG3 GLU 9 HG3 GLU 9 2.066 -14.326 -6.764 71 H GLN 10 H GLN 10 4.848 -16.849 -3.822 72 HA GLN 10 HA GLN 10 6.797 -18.783 -4.973 73 HB2 GLN 10 HB2 GLN 10 7.241 -16.604 -2.907 74 HB3 GLN 10 HB3 GLN 10 8.318 -18.009 -3.061 75 HG2 GLN 10 HG2 GLN 10 8.741 -17.476 -5.423 76 HG3 GLN 10 HG3 GLN 10 7.671 -16.074 -5.330 77 HE21 GLN 10 HE22 GLN 10 10.248 -15.696 -6.191 78 HE22 GLN 10 HE21 GLN 10 11.188 -14.883 -4.959 79 H GLY 11 H GLY 11 4.057 -18.513 -3.386 80 HA2 GLY 11 HA2 GLY 11 4.586 -20.944 -1.743 81 HA3 GLY 11 HA3 GLY 11 3.493 -19.663 -1.202 82 H ASN 12 H ASN 12 3.103 -19.589 -4.469 83 HA ASN 12 HA ASN 12 0.557 -20.851 -4.505 84 HB2 ASN 12 HB2 ASN 12 0.667 -20.431 -6.904 85 HB3 ASN 12 HB3 ASN 12 1.323 -19.057 -6.028 86 HD21 ASN 12 HD22 ASN 12 1.756 -20.248 -8.834 87 HD22 ASN 12 HD21 ASN 12 3.496 -20.319 -8.977 88 H SER 13 H SER 13 3.810 -22.074 -5.012 89 HA SER 13 HA SER 13 2.760 -24.561 -6.171 90 HB2 SER 13 HB2 SER 13 5.167 -25.200 -6.278 91 HB3 SER 13 HB3 SER 13 4.843 -23.661 -7.097 92 HG SER 13 HG SER 13 6.676 -23.525 -5.730 93 H LEU 14 H LEU 14 4.084 -23.300 -3.109 94 HA LEU 14 HA LEU 14 4.394 -25.780 -1.756 95 HB2 LEU 14 HB2 LEU 14 3.945 -22.889 -0.996 96 HB3 LEU 14 HB3 LEU 14 3.862 -24.133 0.237 97 HG LEU 14 HG LEU 14 6.128 -24.897 -0.259 98 HD11 LEU 14 HD11 LEU 14 6.290 -24.345 -2.649 99 HD12 LEU 14 HD12 LEU 14 6.167 -22.613 -2.278 100 HD13 LEU 14 HD13 LEU 14 7.586 -23.544 -1.748 101 HD21 LEU 14 HD21 LEU 14 5.742 -23.098 1.409 102 HD22 LEU 14 HD22 LEU 14 7.306 -22.915 0.584 103 HD23 LEU 14 HD23 LEU 14 5.934 -21.873 0.129 104 H PHE 15 H PHE 15 1.595 -23.666 -2.399 105 HA PHE 15 HA PHE 15 -0.275 -24.984 -0.687 106 HB2 PHE 15 HB2 PHE 15 -0.756 -22.799 -1.553 107 HB3 PHE 15 HB3 PHE 15 -0.470 -23.331 -3.217 108 HD1 PHE 15 HD2 PHE 15 -2.697 -24.241 -0.322 109 HD2 PHE 15 HD1 PHE 15 -2.270 -23.684 -4.553 110 HE1 PHE 15 HE2 PHE 15 -5.116 -24.765 -0.631 111 HE2 PHE 15 HE1 PHE 15 -4.711 -24.132 -4.867 112 HZ PHE 15 HZ PHE 15 -6.113 -24.680 -2.909 113 H LYS 16 H LYS 16 1.254 -25.980 -3.617 114 HA LYS 16 HA LYS 16 -0.819 -28.067 -4.062 115 HB2 LYS 16 HB2 LYS 16 1.367 -26.998 -5.886 116 HB3 LYS 16 HB3 LYS 16 0.181 -28.244 -6.323 117 HG2 LYS 16 HG2 LYS 16 -1.656 -26.680 -6.041 118 HG3 LYS 16 HG3 LYS 16 -0.582 -25.449 -5.347 119 HD2 LYS 16 HD2 LYS 16 0.636 -25.289 -7.492 120 HD3 LYS 16 HD3 LYS 16 -0.488 -26.481 -8.204 121 HE2 LYS 16 HE2 LYS 16 -2.396 -24.962 -7.640 122 HE3 LYS 16 HE3 LYS 16 -1.245 -23.811 -6.941 123 HZ1 LYS 16 HZ1 LYS 16 -1.831 -23.217 -9.190 124 HZ2 LYS 16 HZ2 LYS 16 -0.230 -23.594 -9.115 125 HZ3 LYS 16 HZ3 LYS 16 -1.302 -24.664 -9.772 126 H GLN 17 H GLN 17 2.185 -27.619 -2.556 127 HA GLN 17 HA GLN 17 3.247 -30.286 -3.113 128 HB2 GLN 17 HB2 GLN 17 3.988 -28.212 -1.042 129 HB3 GLN 17 HB3 GLN 17 4.807 -29.771 -1.289 130 HG2 GLN 17 HG2 GLN 17 5.034 -29.028 -3.777 131 HG3 GLN 17 HG3 GLN 17 4.666 -27.414 -3.163 132 HE21 GLN 17 HE22 GLN 17 5.922 -27.211 -0.798 133 HE22 GLN 17 HE21 GLN 17 7.637 -27.439 -0.981 134 H GLY 18 H GLY 18 0.790 -28.996 -0.991 135 HA2 GLY 18 HA2 GLY 18 -0.691 -30.389 0.173 136 HA3 GLY 18 HA3 GLY 18 0.500 -31.691 0.190 137 H LEU 19 H LEU 19 1.247 -28.353 1.174 138 HA LEU 19 HA LEU 19 1.252 -29.158 4.024 139 HB2 LEU 19 HB2 LEU 19 3.496 -27.966 4.222 140 HB3 LEU 19 HB3 LEU 19 3.457 -29.593 3.541 141 HG LEU 19 HG LEU 19 3.645 -28.710 1.259 142 HD11 LEU 19 HD11 LEU 19 4.196 -26.338 0.889 143 HD12 LEU 19 HD12 LEU 19 2.571 -26.503 1.572 144 HD13 LEU 19 HD13 LEU 19 3.920 -26.001 2.606 145 HD21 LEU 19 HD21 LEU 19 5.650 -29.275 2.568 146 HD22 LEU 19 HD22 LEU 19 5.967 -27.915 1.471 147 HD23 LEU 19 HD23 LEU 19 5.716 -27.616 3.202 148 H TYR 20 H TYR 20 -0.779 -27.883 3.108 149 HA TYR 20 HA TYR 20 -0.857 -25.233 2.489 150 HB2 TYR 20 HB2 TYR 20 -2.830 -26.538 4.369 151 HB3 TYR 20 HB3 TYR 20 -3.152 -25.334 3.116 152 HD1 TYR 20 HD2 TYR 20 -2.123 -26.281 0.663 153 HD2 TYR 20 HD1 TYR 20 -3.676 -28.610 3.936 154 HE1 TYR 20 HE2 TYR 20 -2.668 -28.129 -0.898 155 HE2 TYR 20 HE1 TYR 20 -4.213 -30.456 2.375 156 HH TYR 20 HH TYR 20 -4.136 -31.215 0.217 157 H ARG 21 H ARG 21 -0.138 -26.503 5.712 158 HA ARG 21 HA ARG 21 -0.968 -24.259 7.237 159 HB2 ARG 21 HB2 ARG 21 -0.446 -26.521 8.108 160 HB3 ARG 21 HB3 ARG 21 1.259 -26.294 7.718 161 HG2 ARG 21 HG2 ARG 21 0.692 -25.965 10.137 162 HG3 ARG 21 HG3 ARG 21 1.484 -24.569 9.401 163 HD2 ARG 21 HD2 ARG 21 -0.681 -23.457 9.111 164 HD3 ARG 21 HD3 ARG 21 -1.525 -24.878 9.766 165 HE ARG 21 HE ARG 21 0.418 -23.980 11.651 166 HH11 ARG 21 HH11 ARG 21 -2.665 -22.991 10.250 167 HH12 ARG 21 HH12 ARG 21 -3.151 -22.078 11.650 168 HH21 ARG 21 HH21 ARG 21 -0.237 -22.789 13.483 169 HH22 ARG 21 HH22 ARG 21 -1.771 -21.960 13.485 170 H GLU 22 H GLU 22 1.506 -24.404 4.950 171 HA GLU 22 HA GLU 22 2.507 -21.810 5.917 172 HB2 GLU 22 HB2 GLU 22 4.850 -22.515 5.204 173 HB3 GLU 22 HB3 GLU 22 4.223 -23.127 6.742 174 HG2 GLU 22 HG2 GLU 22 3.520 -25.196 5.673 175 HG3 GLU 22 HG3 GLU 22 4.179 -24.641 4.112 176 H ALA 23 H ALA 23 0.629 -22.891 3.840 177 HA ALA 23 HA ALA 23 1.747 -21.282 1.598 178 HB1 ALA 23 HB1 ALA 23 0.060 -23.778 1.309 179 HB2 ALA 23 HB2 ALA 23 0.752 -22.789 0.002 180 HB3 ALA 23 HB3 ALA 23 1.821 -23.715 1.078 181 H VAL 24 H VAL 24 -0.766 -21.815 3.867 182 HA VAL 24 HA VAL 24 -2.858 -20.260 2.498 183 HB VAL 24 HB VAL 24 -2.220 -21.072 5.393 184 HG11 VAL 24 HG11 VAL 24 -4.555 -20.398 5.939 185 HG12 VAL 24 HG12 VAL 24 -3.580 -19.019 5.415 186 HG13 VAL 24 HG13 VAL 24 -4.751 -19.750 4.292 187 HG21 VAL 24 HG21 VAL 24 -4.060 -22.686 5.141 188 HG22 VAL 24 HG22 VAL 24 -4.496 -22.023 3.561 189 HG23 VAL 24 HG23 VAL 24 -2.982 -22.908 3.741 190 H HIS 25 H HIS 25 -0.433 -20.075 4.934 191 HA HIS 25 HA HIS 25 -0.544 -17.384 5.769 192 HB2 HIS 25 HB2 HIS 25 0.879 -19.920 6.128 193 HB3 HIS 25 HB3 HIS 25 1.964 -18.607 6.163 194 HD2 HIS 25 HD2 HIS 25 2.080 -17.325 8.518 195 HE1 HIS 25 HE1 HIS 25 -1.513 -18.845 10.230 196 HE2 HIS 25 HE2 HIS 25 0.575 -17.438 10.670 197 H CYS 26 H CYS 26 0.031 -18.275 2.736 198 HA CYS 26 HA CYS 26 2.263 -16.359 2.286 199 HB2 CYS 26 HB2 CYS 26 1.416 -18.882 0.813 200 HB3 CYS 26 HB3 CYS 26 2.426 -17.634 0.079 201 HG CYS 26 HG CYS 26 3.898 -19.643 0.953 202 H TYR 27 H TYR 27 -1.052 -16.672 2.029 203 HA TYR 27 HA TYR 27 -1.102 -14.602 -0.129 204 HB2 TYR 27 HB2 TYR 27 -3.422 -16.278 0.792 205 HB3 TYR 27 HB3 TYR 27 -3.341 -15.268 -0.657 206 HD1 TYR 27 HD2 TYR 27 -0.808 -16.152 -1.925 207 HD2 TYR 27 HD1 TYR 27 -3.832 -18.381 0.163 208 HE1 TYR 27 HE2 TYR 27 -0.168 -18.182 -3.191 209 HE2 TYR 27 HE1 TYR 27 -3.181 -20.445 -1.099 210 HH TYR 27 HH TYR 27 -1.822 -21.330 -2.705 211 H ASP 28 H ASP 28 -1.244 -15.024 3.192 212 HA ASP 28 HA ASP 28 -3.555 -13.390 3.795 213 HB2 ASP 28 HB2 ASP 28 -2.500 -15.211 5.216 214 HB3 ASP 28 HB3 ASP 28 -1.151 -14.111 5.529 215 H GLN 29 H GLN 29 -0.125 -12.779 3.137 216 HA GLN 29 HA GLN 29 -0.083 -10.284 4.578 217 HB2 GLN 29 HB2 GLN 29 2.121 -10.069 3.912 218 HB3 GLN 29 HB3 GLN 29 1.890 -11.797 4.169 219 HG2 GLN 29 HG2 GLN 29 1.744 -10.398 1.504 220 HG3 GLN 29 HG3 GLN 29 3.197 -11.198 2.097 221 HE21 GLN 29 HE22 GLN 29 1.848 -11.783 -0.364 222 HE22 GLN 29 HE21 GLN 29 1.243 -13.415 -0.294 223 H LEU 30 H LEU 30 -1.368 -11.142 1.483 224 HA LEU 30 HA LEU 30 -1.019 -8.505 0.283 225 HB2 LEU 30 HB2 LEU 30 -2.981 -10.764 -0.309 226 HB3 LEU 30 HB3 LEU 30 -2.717 -9.332 -1.303 227 HG LEU 30 HG LEU 30 -1.453 -10.810 -2.449 228 HD11 LEU 30 HD11 LEU 30 0.567 -10.155 -0.269 229 HD12 LEU 30 HD12 LEU 30 0.929 -10.661 -1.924 230 HD13 LEU 30 HD13 LEU 30 0.157 -9.091 -1.615 231 HD21 LEU 30 HD21 LEU 30 -2.076 -12.698 -1.072 232 HD22 LEU 30 HD22 LEU 30 -0.340 -12.768 -1.408 233 HD23 LEU 30 HD23 LEU 30 -0.897 -12.223 0.171 234 H ILE 31 H ILE 31 -3.392 -10.151 2.322 235 HA ILE 31 HA ILE 31 -5.435 -8.147 2.002 236 HB ILE 31 HB ILE 31 -4.942 -10.291 4.118 237 HG12 ILE 31 HG12 ILE 31 -6.843 -10.437 1.751 238 HG13 ILE 31 HG13 ILE 31 -5.181 -10.988 1.640 239 HG21 ILE 31 HG21 ILE 31 -7.478 -8.740 3.459 240 HG22 ILE 31 HG22 ILE 31 -7.393 -10.145 4.549 241 HG23 ILE 31 HG23 ILE 31 -6.544 -8.651 4.965 242 HD11 ILE 31 HD11 ILE 31 -5.482 -12.501 3.502 243 HD12 ILE 31 HD12 ILE 31 -7.212 -12.056 3.594 244 HD13 ILE 31 HD13 ILE 31 -6.583 -12.871 2.136 245 H THR 32 H THR 32 -2.538 -8.453 3.824 246 HA THR 32 HA THR 32 -3.303 -6.261 5.685 247 HB THR 32 HB THR 32 -0.855 -8.062 5.615 248 HG1 THR 32 HG1 THR 32 -1.924 -9.077 7.342 249 HG21 THR 32 HG21 THR 32 -1.879 -6.084 7.706 250 HG22 THR 32 HG22 THR 32 -0.594 -7.284 7.988 251 HG23 THR 32 HG23 THR 32 -0.353 -5.990 6.802 252 H ALA 33 H ALA 33 -1.501 -6.791 2.720 253 HA ALA 33 HA ALA 33 0.165 -4.393 3.188 254 HB1 ALA 33 HB1 ALA 33 1.237 -5.051 1.068 255 HB2 ALA 33 HB2 ALA 33 1.213 -6.400 2.221 256 HB3 ALA 33 HB3 ALA 33 0.056 -6.367 0.872 257 H GLN 34 H GLN 34 -2.600 -5.483 1.247 258 HA GLN 34 HA GLN 34 -3.570 -2.893 0.721 259 HB2 GLN 34 HB2 GLN 34 -3.192 -2.851 -1.776 260 HB3 GLN 34 HB3 GLN 34 -1.821 -2.426 -0.741 261 HG2 GLN 34 HG2 GLN 34 -1.268 -5.022 -1.031 262 HG3 GLN 34 HG3 GLN 34 -2.229 -4.804 -2.511 263 HE21 GLN 34 HE22 GLN 34 0.542 -3.499 -0.645 264 HE22 GLN 34 HE21 GLN 34 1.430 -2.909 -2.026 265 HA PRO 35 HA PRO 35 -6.259 -6.599 0.401 266 HB2 PRO 35 HB2 PRO 35 -8.391 -5.506 1.789 267 HB3 PRO 35 HB3 PRO 35 -6.982 -6.300 2.561 268 HG2 PRO 35 HG2 PRO 35 -7.479 -3.351 2.094 269 HG3 PRO 35 HG3 PRO 35 -6.893 -4.157 3.594 270 HD2 PRO 35 HD2 PRO 35 -5.192 -2.951 1.862 271 HD3 PRO 35 HD3 PRO 35 -4.740 -4.481 2.678 272 H GLN 36 H GLN 36 -6.352 -3.499 -0.967 273 HA GLN 36 HA GLN 36 -8.962 -3.417 -2.072 274 HB2 GLN 36 HB2 GLN 36 -8.042 -1.678 -3.524 275 HB3 GLN 36 HB3 GLN 36 -7.513 -1.475 -1.846 276 HG2 GLN 36 HG2 GLN 36 -5.360 -2.599 -2.405 277 HG3 GLN 36 HG3 GLN 36 -5.897 -2.749 -4.089 278 HE21 GLN 36 HE22 GLN 36 -3.525 -1.499 -3.688 279 HE22 GLN 36 HE21 GLN 36 -3.684 0.226 -3.900 280 H ASN 37 H ASN 37 -7.191 -5.990 -2.521 281 HA ASN 37 HA ASN 37 -7.865 -6.271 -5.402 282 HB2 ASN 37 HB2 ASN 37 -5.233 -6.893 -4.014 283 HB3 ASN 37 HB3 ASN 37 -5.671 -7.535 -5.611 284 HD21 ASN 37 HD22 ASN 37 -4.006 -5.104 -4.055 285 HD22 ASN 37 HD21 ASN 37 -3.990 -3.917 -5.350 286 HA PRO 38 HA PRO 38 -9.821 -9.839 -3.540 287 HB2 PRO 38 HB2 PRO 38 -10.856 -10.960 -5.755 288 HB3 PRO 38 HB3 PRO 38 -11.382 -9.342 -5.209 289 HG2 PRO 38 HG2 PRO 38 -9.249 -9.917 -7.290 290 HG3 PRO 38 HG3 PRO 38 -10.736 -8.918 -7.480 291 HD2 PRO 38 HD2 PRO 38 -8.454 -7.683 -6.775 292 HD3 PRO 38 HD3 PRO 38 -9.949 -7.306 -5.969 293 H VAL 39 H VAL 39 -7.175 -10.034 -5.906 294 HA VAL 39 HA VAL 39 -7.057 -12.879 -6.069 295 HB VAL 39 HB VAL 39 -5.925 -11.253 -7.578 296 HG11 VAL 39 HG11 VAL 39 -3.844 -11.077 -5.363 297 HG12 VAL 39 HG12 VAL 39 -3.733 -10.376 -6.991 298 HG13 VAL 39 HG13 VAL 39 -4.945 -9.762 -5.852 299 HG21 VAL 39 HG21 VAL 39 -4.129 -13.369 -6.315 300 HG22 VAL 39 HG22 VAL 39 -5.382 -13.667 -7.541 301 HG23 VAL 39 HG23 VAL 39 -3.962 -12.682 -7.948 302 H GLY 40 H GLY 40 -6.044 -10.574 -3.655 303 HA2 GLY 40 HA2 GLY 40 -4.275 -12.219 -2.102 304 HA3 GLY 40 HA3 GLY 40 -5.185 -10.803 -1.540 305 H TYR 41 H TYR 41 -7.735 -12.298 -2.581 306 HA TYR 41 HA TYR 41 -8.045 -14.062 -0.188 307 HB2 TYR 41 HB2 TYR 41 -10.303 -12.813 -1.788 308 HB3 TYR 41 HB3 TYR 41 -10.375 -13.533 -0.262 309 HD1 TYR 41 HD1 TYR 41 -8.962 -10.525 -1.932 310 HD2 TYR 41 HD2 TYR 41 -10.114 -12.373 1.758 311 HE1 TYR 41 HE1 TYR 41 -8.750 -8.345 -0.794 312 HE2 TYR 41 HE2 TYR 41 -9.899 -10.192 2.923 313 HH TYR 41 HH TYR 41 -8.974 -7.207 1.167 314 H SER 42 H SER 42 -7.911 -13.902 -3.617 315 HA SER 42 HA SER 42 -9.726 -16.031 -4.277 316 HB2 SER 42 HB2 SER 42 -8.940 -14.185 -5.807 317 HB3 SER 42 HB3 SER 42 -7.367 -15.011 -5.895 318 HG SER 42 HG SER 42 -8.508 -16.857 -6.676 319 H ASN 43 H ASN 43 -6.844 -16.237 -2.601 320 HA ASN 43 HA ASN 43 -6.489 -19.064 -3.460 321 HB2 ASN 43 HB2 ASN 43 -4.324 -16.981 -2.965 322 HB3 ASN 43 HB3 ASN 43 -4.048 -18.688 -3.279 323 HD21 ASN 43 HD22 ASN 43 -4.687 -15.584 -4.689 324 HD22 ASN 43 HD21 ASN 43 -4.701 -16.116 -6.357 325 H LYS 44 H LYS 44 -6.235 -16.539 -0.954 326 HA LYS 44 HA LYS 44 -5.559 -18.283 1.236 327 HB2 LYS 44 HB2 LYS 44 -5.377 -15.787 1.220 328 HB3 LYS 44 HB3 LYS 44 -7.080 -15.671 0.987 329 HG2 LYS 44 HG2 LYS 44 -6.729 -15.219 3.287 330 HG3 LYS 44 HG3 LYS 44 -7.380 -16.874 3.245 331 HD2 LYS 44 HD2 LYS 44 -4.983 -17.716 3.321 332 HD3 LYS 44 HD3 LYS 44 -4.456 -16.037 3.547 333 HE2 LYS 44 HE2 LYS 44 -6.292 -17.633 5.379 334 HE3 LYS 44 HE3 LYS 44 -4.612 -17.172 5.707 335 HZ1 LYS 44 HZ1 LYS 44 -6.195 -15.709 6.784 336 HZ2 LYS 44 HZ2 LYS 44 -5.269 -14.877 5.717 337 HZ3 LYS 44 HZ3 LYS 44 -6.831 -15.260 5.337 338 H ALA 45 H ALA 45 -8.582 -17.024 -0.140 339 HA ALA 45 HA ALA 45 -10.346 -18.483 1.608 340 HB1 ALA 45 HB1 ALA 45 -10.838 -16.311 0.318 341 HB2 ALA 45 HB2 ALA 45 -11.028 -17.329 -1.120 342 HB3 ALA 45 HB3 ALA 45 -12.088 -17.578 0.277 343 H MET 46 H MET 46 -8.247 -19.767 -0.510 344 HA MET 46 HA MET 46 -10.026 -22.057 -1.204 345 HB2 MET 46 HB2 MET 46 -9.355 -20.278 -3.103 346 HB3 MET 46 HB3 MET 46 -7.821 -21.151 -3.064 347 HG2 MET 46 HG2 MET 46 -9.256 -22.096 -4.777 348 HG3 MET 46 HG3 MET 46 -9.052 -23.280 -3.481 349 HE1 MET 46 HE1 MET 46 -11.345 -20.701 -5.253 350 HE2 MET 46 HE2 MET 46 -12.862 -20.781 -4.343 351 HE3 MET 46 HE3 MET 46 -11.426 -20.059 -3.596 352 H ALA 47 H ALA 47 -7.596 -21.058 0.669 353 HA ALA 47 HA ALA 47 -6.306 -23.734 0.532 354 HB1 ALA 47 HB1 ALA 47 -5.040 -21.088 1.333 355 HB2 ALA 47 HB2 ALA 47 -4.242 -22.685 1.350 356 HB3 ALA 47 HB3 ALA 47 -4.758 -21.968 -0.186 357 H LEU 48 H LEU 48 -7.875 -21.256 2.521 358 HA LEU 48 HA LEU 48 -7.398 -22.590 5.045 359 HB2 LEU 48 HB2 LEU 48 -9.518 -20.686 3.968 360 HB3 LEU 48 HB3 LEU 48 -9.624 -21.358 5.610 361 HG LEU 48 HG LEU 48 -7.220 -19.790 4.574 362 HD11 LEU 48 HD11 LEU 48 -9.591 -18.951 6.298 363 HD12 LEU 48 HD12 LEU 48 -8.153 -17.959 5.998 364 HD13 LEU 48 HD13 LEU 48 -9.230 -18.383 4.647 365 HD21 LEU 48 HD21 LEU 48 -6.705 -21.303 6.471 366 HD22 LEU 48 HD22 LEU 48 -6.720 -19.614 7.022 367 HD23 LEU 48 HD23 LEU 48 -8.110 -20.672 7.355 368 H ILE 49 H ILE 49 -9.757 -22.956 2.390 369 HA ILE 49 HA ILE 49 -11.442 -24.852 3.685 370 HB ILE 49 HB ILE 49 -11.992 -25.599 1.382 371 HG12 ILE 49 HG12 ILE 49 -10.097 -23.419 0.500 372 HG13 ILE 49 HG13 ILE 49 -9.566 -25.075 0.589 373 HG21 ILE 49 HG21 ILE 49 -13.053 -23.513 0.709 374 HG22 ILE 49 HG22 ILE 49 -13.090 -23.616 2.479 375 HG23 ILE 49 HG23 ILE 49 -11.898 -22.573 1.672 376 HD11 ILE 49 HD11 ILE 49 -11.221 -25.881 -0.900 377 HD12 ILE 49 HD12 ILE 49 -11.874 -24.223 -1.128 378 HD13 ILE 49 HD13 ILE 49 -10.227 -24.630 -1.675 379 H LYS 50 H LYS 50 -8.244 -25.026 2.328 380 HA LYS 50 HA LYS 50 -8.385 -27.755 1.521 381 HB2 LYS 50 HB2 LYS 50 -6.797 -25.661 0.858 382 HB3 LYS 50 HB3 LYS 50 -5.720 -26.505 1.982 383 HG2 LYS 50 HG2 LYS 50 -5.182 -27.555 0.017 384 HG3 LYS 50 HG3 LYS 50 -6.499 -28.630 0.529 385 HD2 LYS 50 HD2 LYS 50 -6.632 -26.295 -1.425 386 HD3 LYS 50 HD3 LYS 50 -6.658 -28.017 -1.851 387 HE2 LYS 50 HE2 LYS 50 -8.824 -28.157 -0.472 388 HE3 LYS 50 HE3 LYS 50 -8.804 -26.373 -0.471 389 HZ1 LYS 50 HZ1 LYS 50 -10.096 -27.273 -2.292 390 HZ2 LYS 50 HZ2 LYS 50 -8.799 -26.436 -2.860 391 HZ3 LYS 50 HZ3 LYS 50 -8.795 -28.080 -2.878 392 H LEU 51 H LEU 51 -8.274 -26.405 4.558 393 HA LEU 51 HA LEU 51 -6.705 -28.627 5.783 394 HB2 LEU 51 HB2 LEU 51 -6.888 -25.680 6.475 395 HB3 LEU 51 HB3 LEU 51 -6.321 -26.889 7.639 396 HG LEU 51 HG LEU 51 -5.043 -26.529 4.912 397 HD11 LEU 51 HD11 LEU 51 -3.283 -25.289 6.140 398 HD12 LEU 51 HD12 LEU 51 -4.853 -24.467 6.257 399 HD13 LEU 51 HD13 LEU 51 -4.243 -25.401 7.631 400 HD21 LEU 51 HD21 LEU 51 -3.166 -27.740 6.074 401 HD22 LEU 51 HD22 LEU 51 -4.199 -27.919 7.506 402 HD23 LEU 51 HD23 LEU 51 -4.644 -28.718 5.985 403 H GLY 52 H GLY 52 -9.748 -26.993 5.524 404 HA2 GLY 52 HA2 GLY 52 -11.663 -28.188 6.445 405 HA3 GLY 52 HA3 GLY 52 -10.722 -28.486 7.919 406 H GLU 53 H GLU 53 -9.870 -25.393 7.120 407 HA GLU 53 HA GLU 53 -11.677 -24.283 9.130 408 HB2 GLU 53 HB2 GLU 53 -9.387 -23.042 7.540 409 HB3 GLU 53 HB3 GLU 53 -10.289 -22.257 8.843 410 HG2 GLU 53 HG2 GLU 53 -9.653 -24.187 10.351 411 HG3 GLU 53 HG3 GLU 53 -8.554 -24.734 9.073 412 H TYR 54 H TYR 54 -13.266 -25.070 7.040 413 HA TYR 54 HA TYR 54 -13.635 -23.289 4.902 414 HB2 TYR 54 HB2 TYR 54 -15.706 -24.869 6.478 415 HB3 TYR 54 HB3 TYR 54 -15.969 -24.143 4.887 416 HD1 TYR 54 HD1 TYR 54 -14.777 -25.030 2.890 417 HD2 TYR 54 HD2 TYR 54 -14.537 -26.948 6.725 418 HE1 TYR 54 HE1 TYR 54 -13.942 -27.093 1.793 419 HE2 TYR 54 HE2 TYR 54 -13.704 -29.025 5.639 420 HH TYR 54 HH TYR 54 -13.237 -29.257 2.097 421 H THR 55 H THR 55 -14.884 -23.112 8.260 422 HA THR 55 HA THR 55 -16.649 -20.949 7.932 423 HB THR 55 HB THR 55 -14.909 -21.752 10.292 424 HG1 THR 55 HG1 THR 55 -16.790 -22.867 10.889 425 HG21 THR 55 HG21 THR 55 -16.673 -20.658 11.662 426 HG22 THR 55 HG22 THR 55 -15.858 -19.483 10.619 427 HG23 THR 55 HG23 THR 55 -17.470 -20.091 10.169 428 H GLN 56 H GLN 56 -13.074 -20.965 8.344 429 HA GLN 56 HA GLN 56 -12.985 -18.045 8.534 430 HB2 GLN 56 HB2 GLN 56 -10.879 -20.214 8.359 431 HB3 GLN 56 HB3 GLN 56 -10.513 -18.488 8.333 432 HG2 GLN 56 HG2 GLN 56 -10.265 -19.151 10.553 433 HG3 GLN 56 HG3 GLN 56 -11.767 -18.227 10.495 434 HE21 GLN 56 HE22 GLN 56 -10.320 -21.464 10.841 435 HE22 GLN 56 HE21 GLN 56 -11.752 -22.224 11.514 436 H ALA 57 H ALA 57 -13.201 -20.401 5.970 437 HA ALA 57 HA ALA 57 -11.502 -18.937 4.100 438 HB1 ALA 57 HB1 ALA 57 -13.512 -21.193 3.666 439 HB2 ALA 57 HB2 ALA 57 -12.283 -20.627 2.511 440 HB3 ALA 57 HB3 ALA 57 -11.782 -21.412 4.031 441 H ILE 58 H ILE 58 -15.001 -19.307 4.759 442 HA ILE 58 HA ILE 58 -15.886 -17.770 2.491 443 HB ILE 58 HB ILE 58 -17.284 -18.055 5.175 444 HG12 ILE 58 HG12 ILE 58 -17.385 -19.993 2.827 445 HG13 ILE 58 HG13 ILE 58 -16.510 -20.298 4.330 446 HG21 ILE 58 HG21 ILE 58 -19.297 -17.856 3.761 447 HG22 ILE 58 HG22 ILE 58 -18.201 -16.513 3.404 448 HG23 ILE 58 HG23 ILE 58 -18.273 -17.915 2.307 449 HD11 ILE 58 HD11 ILE 58 -18.638 -21.356 4.570 450 HD12 ILE 58 HD12 ILE 58 -18.603 -19.930 5.619 451 HD13 ILE 58 HD13 ILE 58 -19.490 -19.870 4.057 452 H GLN 59 H GLN 59 -14.785 -17.040 5.779 453 HA GLN 59 HA GLN 59 -15.660 -14.330 5.898 454 HB2 GLN 59 HB2 GLN 59 -15.000 -15.805 7.824 455 HB3 GLN 59 HB3 GLN 59 -13.311 -15.662 7.312 456 HG2 GLN 59 HG2 GLN 59 -13.862 -14.110 9.155 457 HG3 GLN 59 HG3 GLN 59 -13.369 -13.240 7.711 458 HE21 GLN 59 HE22 GLN 59 -14.475 -11.305 8.068 459 HE22 GLN 59 HE21 GLN 59 -16.225 -11.201 8.159 460 H MET 60 H MET 60 -13.348 -15.781 3.883 461 HA MET 60 HA MET 60 -11.923 -13.204 3.496 462 HB2 MET 60 HB2 MET 60 -11.266 -16.024 2.574 463 HB3 MET 60 HB3 MET 60 -10.260 -14.609 2.263 464 HG2 MET 60 HG2 MET 60 -10.976 -15.381 5.100 465 HG3 MET 60 HG3 MET 60 -9.739 -16.264 4.230 466 HE1 MET 60 HE1 MET 60 -9.376 -11.765 5.277 467 HE2 MET 60 HE2 MET 60 -10.255 -12.277 3.831 468 HE3 MET 60 HE3 MET 60 -10.870 -12.734 5.442 469 H CYS 61 H CYS 61 -14.156 -15.539 2.065 470 HA CYS 61 HA CYS 61 -13.939 -14.531 -0.629 471 HB2 CYS 61 HB2 CYS 61 -16.187 -15.968 0.896 472 HB3 CYS 61 HB3 CYS 61 -16.226 -15.636 -0.845 473 HG CYS 61 HG CYS 61 -15.650 -18.120 -0.512 474 H GLN 62 H GLN 62 -16.171 -13.816 2.149 475 HA GLN 62 HA GLN 62 -17.629 -11.803 0.689 476 HB2 GLN 62 HB2 GLN 62 -17.264 -12.126 3.700 477 HB3 GLN 62 HB3 GLN 62 -18.587 -11.276 2.865 478 HG2 GLN 62 HG2 GLN 62 -19.436 -13.369 1.956 479 HG3 GLN 62 HG3 GLN 62 -18.048 -14.250 2.596 480 HE21 GLN 62 HE22 GLN 62 -19.715 -15.584 3.581 481 HE22 GLN 62 HE21 GLN 62 -20.415 -15.058 5.079 482 H GLN 63 H GLN 63 -14.403 -11.745 1.692 483 HA GLN 63 HA GLN 63 -14.479 -8.782 1.983 484 HB2 GLN 63 HB2 GLN 63 -12.409 -10.741 3.039 485 HB3 GLN 63 HB3 GLN 63 -12.367 -8.969 3.170 486 HG2 GLN 63 HG2 GLN 63 -14.688 -9.200 4.290 487 HG3 GLN 63 HG3 GLN 63 -14.265 -10.907 4.492 488 HE21 GLN 63 HE22 GLN 63 -12.830 -11.504 6.118 489 HE22 GLN 63 HE21 GLN 63 -12.054 -10.353 7.196 490 H GLY 64 H GLY 64 -13.879 -11.213 -0.185 491 HA2 GLY 64 HA2 GLY 64 -11.755 -9.622 -1.575 492 HA3 GLY 64 HA3 GLY 64 -12.087 -11.337 -1.834 493 H LEU 65 H LEU 65 -15.022 -10.995 -1.766 494 HA LEU 65 HA LEU 65 -15.570 -10.285 -4.492 495 HB2 LEU 65 HB2 LEU 65 -17.189 -10.889 -2.001 496 HB3 LEU 65 HB3 LEU 65 -18.001 -10.427 -3.490 497 HG LEU 65 HG LEU 65 -16.004 -12.737 -3.369 498 HD11 LEU 65 HD11 LEU 65 -19.034 -12.780 -3.180 499 HD12 LEU 65 HD12 LEU 65 -17.976 -14.204 -3.290 500 HD13 LEU 65 HD13 LEU 65 -17.906 -13.159 -1.851 501 HD21 LEU 65 HD21 LEU 65 -18.162 -11.953 -5.372 502 HD22 LEU 65 HD22 LEU 65 -16.403 -11.800 -5.616 503 HD23 LEU 65 HD23 LEU 65 -17.140 -13.406 -5.451 504 H ARG 66 H ARG 66 -14.889 -8.319 -1.827 505 HA ARG 66 HA ARG 66 -16.565 -6.033 -2.551 506 HB2 ARG 66 HB2 ARG 66 -14.086 -6.279 -0.789 507 HB3 ARG 66 HB3 ARG 66 -15.205 -4.908 -0.827 508 HG2 ARG 66 HG2 ARG 66 -17.025 -6.346 0.017 509 HG3 ARG 66 HG3 ARG 66 -15.927 -7.751 0.030 510 HD2 ARG 66 HD2 ARG 66 -14.426 -6.551 1.590 511 HD3 ARG 66 HD3 ARG 66 -15.523 -5.170 1.582 512 HE ARG 66 HE ARG 66 -16.799 -7.692 2.333 513 HH11 ARG 66 HH11 ARG 66 -14.974 -4.915 3.551 514 HH12 ARG 66 HH12 ARG 66 -15.570 -5.094 5.180 515 HH21 ARG 66 HH21 ARG 66 -17.540 -7.906 4.464 516 HH22 ARG 66 HH22 ARG 66 -17.012 -6.792 5.701 517 H TYR 67 H TYR 67 -14.037 -7.488 -4.116 518 HA TYR 67 HA TYR 67 -12.759 -4.960 -5.032 519 HB2 TYR 67 HB2 TYR 67 -11.380 -7.459 -4.033 520 HB3 TYR 67 HB3 TYR 67 -10.557 -6.079 -4.733 521 HD1 TYR 67 HD2 TYR 67 -11.390 -3.706 -3.571 522 HD2 TYR 67 HD1 TYR 67 -11.320 -7.588 -1.724 523 HE1 TYR 67 HE2 TYR 67 -11.358 -2.644 -1.339 524 HE2 TYR 67 HE1 TYR 67 -11.251 -6.536 0.507 525 HH TYR 67 HH TYR 67 -11.257 -4.561 1.695 526 H THR 68 H THR 68 -14.754 -7.091 -6.065 527 HA THR 68 HA THR 68 -13.302 -7.740 -8.591 528 HB THR 68 HB THR 68 -14.935 -9.634 -8.768 529 HG1 THR 68 HG1 THR 68 -16.065 -10.170 -6.882 530 HG21 THR 68 HG21 THR 68 -13.255 -9.637 -6.244 531 HG22 THR 68 HG22 THR 68 -13.800 -11.062 -7.139 532 HG23 THR 68 HG23 THR 68 -12.639 -9.936 -7.882 533 H SER 69 H SER 69 -14.832 -5.291 -7.728 534 HA SER 69 HA SER 69 -17.377 -5.208 -8.998 535 HB2 SER 69 HB2 SER 69 -17.131 -2.782 -8.656 536 HB3 SER 69 HB3 SER 69 -16.612 -3.686 -7.218 537 HG SER 69 HG SER 69 -15.129 -2.037 -7.818 538 H THR 70 H THR 70 -14.627 -5.861 -10.643 539 HA THR 70 HA THR 70 -15.498 -4.387 -13.048 540 HB THR 70 HB THR 70 -14.023 -2.779 -12.081 541 HG1 THR 70 HG1 THR 70 -12.390 -2.737 -13.614 542 HG21 THR 70 HG21 THR 70 -11.686 -3.334 -11.418 543 HG22 THR 70 HG22 THR 70 -12.897 -4.141 -10.396 544 HG23 THR 70 HG23 THR 70 -12.051 -5.058 -11.677 545 H ALA 71 H ALA 71 -14.246 -5.031 -14.967 546 HA ALA 71 HA ALA 71 -14.307 -7.851 -15.263 547 HB1 ALA 71 HB1 ALA 71 -13.152 -5.651 -17.027 548 HB2 ALA 71 HB2 ALA 71 -13.544 -7.313 -17.552 549 HB3 ALA 71 HB3 ALA 71 -14.843 -6.213 -17.031 550 H GLU 72 H GLU 72 -11.781 -5.843 -14.042 551 HA GLU 72 HA GLU 72 -9.504 -7.281 -14.992 552 HB2 GLU 72 HB2 GLU 72 -9.928 -5.737 -12.436 553 HB3 GLU 72 HB3 GLU 72 -8.358 -6.258 -13.056 554 HG2 GLU 72 HG2 GLU 72 -10.272 -4.342 -14.451 555 HG3 GLU 72 HG3 GLU 72 -8.801 -3.897 -13.584 556 H HIS 73 H HIS 73 -12.041 -8.316 -13.022 557 HA HIS 73 HA HIS 73 -10.441 -10.565 -11.930 558 HB2 HIS 73 HB2 HIS 73 -12.449 -9.036 -10.245 559 HB3 HIS 73 HB3 HIS 73 -11.282 -10.239 -9.719 560 HD2 HIS 73 HD2 HIS 73 -11.784 -6.575 -9.950 561 HE1 HIS 73 HE1 HIS 73 -7.595 -7.012 -9.419 562 HE2 HIS 73 HE2 HIS 73 -9.528 -5.352 -9.417 563 H VAL 74 H VAL 74 -12.414 -10.200 -14.150 564 HA VAL 74 HA VAL 74 -15.048 -10.769 -13.519 565 HB VAL 74 HB VAL 74 -14.093 -10.103 -15.703 566 HG11 VAL 74 HG11 VAL 74 -13.394 -13.046 -16.027 567 HG12 VAL 74 HG12 VAL 74 -13.250 -11.783 -17.261 568 HG13 VAL 74 HG13 VAL 74 -12.220 -11.719 -15.813 569 HG21 VAL 74 HG21 VAL 74 -16.422 -10.945 -15.498 570 HG22 VAL 74 HG22 VAL 74 -15.699 -11.318 -17.082 571 HG23 VAL 74 HG23 VAL 74 -15.839 -12.591 -15.855 572 H ALA 75 H ALA 75 -12.345 -13.049 -13.484 573 HA ALA 75 HA ALA 75 -14.234 -15.331 -13.253 574 HB1 ALA 75 HB1 ALA 75 -11.185 -15.226 -13.281 575 HB2 ALA 75 HB2 ALA 75 -12.185 -16.701 -13.315 576 HB3 ALA 75 HB3 ALA 75 -12.232 -15.564 -14.687 577 H ILE 76 H ILE 76 -11.901 -13.459 -11.271 578 HA ILE 76 HA ILE 76 -12.085 -15.173 -8.971 579 HB ILE 76 HB ILE 76 -11.376 -12.230 -9.247 580 HG12 ILE 76 HG12 ILE 76 -9.639 -14.721 -9.025 581 HG13 ILE 76 HG13 ILE 76 -9.888 -13.770 -10.486 582 HG21 ILE 76 HG21 ILE 76 -10.985 -14.143 -6.916 583 HG22 ILE 76 HG22 ILE 76 -10.307 -12.512 -7.024 584 HG23 ILE 76 HG23 ILE 76 -12.051 -12.727 -6.940 585 HD11 ILE 76 HD11 ILE 76 -8.498 -12.824 -7.956 586 HD12 ILE 76 HD12 ILE 76 -7.778 -13.127 -9.547 587 HD13 ILE 76 HD13 ILE 76 -8.908 -11.774 -9.333 588 H ARG 77 H ARG 77 -14.071 -12.620 -10.332 589 HA ARG 77 HA ARG 77 -15.707 -11.902 -8.158 590 HB2 ARG 77 HB2 ARG 77 -15.574 -10.840 -10.426 591 HB3 ARG 77 HB3 ARG 77 -16.393 -12.247 -11.108 592 HG2 ARG 77 HG2 ARG 77 -18.372 -11.783 -9.678 593 HG3 ARG 77 HG3 ARG 77 -17.545 -10.340 -9.026 594 HD2 ARG 77 HD2 ARG 77 -17.400 -9.396 -11.294 595 HD3 ARG 77 HD3 ARG 77 -18.103 -10.882 -11.965 596 HE ARG 77 HE ARG 77 -20.216 -10.198 -11.318 597 HH11 ARG 77 HH11 ARG 77 -17.822 -8.076 -9.808 598 HH12 ARG 77 HH12 ARG 77 -19.032 -6.970 -9.201 599 HH21 ARG 77 HH21 ARG 77 -21.756 -8.727 -10.540 600 HH22 ARG 77 HH22 ARG 77 -21.244 -7.320 -9.635 601 H SER 78 H SER 78 -15.479 -14.896 -9.885 602 HA SER 78 HA SER 78 -18.033 -15.854 -8.654 603 HB2 SER 78 HB2 SER 78 -16.610 -16.721 -11.207 604 HB3 SER 78 HB3 SER 78 -18.062 -17.501 -10.515 605 HG SER 78 HG SER 78 -18.552 -15.917 -12.122 606 H LYS 79 H LYS 79 -14.571 -16.186 -8.572 607 HA LYS 79 HA LYS 79 -14.619 -18.999 -7.849 608 HB2 LYS 79 HB2 LYS 79 -12.542 -16.791 -7.737 609 HB3 LYS 79 HB3 LYS 79 -12.205 -18.394 -7.100 610 HG2 LYS 79 HG2 LYS 79 -13.316 -18.219 -9.884 611 HG3 LYS 79 HG3 LYS 79 -11.638 -17.734 -9.628 612 HD2 LYS 79 HD2 LYS 79 -11.909 -20.139 -10.274 613 HD3 LYS 79 HD3 LYS 79 -11.014 -19.871 -8.772 614 HE2 LYS 79 HE2 LYS 79 -12.965 -20.450 -7.430 615 HE3 LYS 79 HE3 LYS 79 -13.985 -20.561 -8.889 616 HZ1 LYS 79 HZ1 LYS 79 -12.607 -22.380 -9.628 617 HZ2 LYS 79 HZ2 LYS 79 -11.679 -22.299 -8.271 618 HZ3 LYS 79 HZ3 LYS 79 -13.263 -22.727 -8.161 619 H LEU 80 H LEU 80 -14.782 -15.885 -6.068 620 HA LEU 80 HA LEU 80 -14.408 -17.223 -3.488 621 HB2 LEU 80 HB2 LEU 80 -15.150 -14.450 -4.456 622 HB3 LEU 80 HB3 LEU 80 -15.283 -14.889 -2.747 623 HG LEU 80 HG LEU 80 -12.913 -15.356 -2.587 624 HD11 LEU 80 HD11 LEU 80 -12.374 -16.293 -4.768 625 HD12 LEU 80 HD12 LEU 80 -12.820 -14.767 -5.571 626 HD13 LEU 80 HD13 LEU 80 -11.401 -14.834 -4.514 627 HD21 LEU 80 HD21 LEU 80 -12.038 -13.105 -3.088 628 HD22 LEU 80 HD22 LEU 80 -13.457 -12.777 -4.105 629 HD23 LEU 80 HD23 LEU 80 -13.650 -13.025 -2.351 630 H GLN 81 H GLN 81 -17.062 -16.298 -5.673 631 HA GLN 81 HA GLN 81 -19.158 -16.788 -3.733 632 HB2 GLN 81 HB2 GLN 81 -18.884 -16.239 -6.671 633 HB3 GLN 81 HB3 GLN 81 -20.327 -17.101 -6.171 634 HG2 GLN 81 HG2 GLN 81 -19.419 -14.388 -5.155 635 HG3 GLN 81 HG3 GLN 81 -20.827 -14.739 -6.175 636 HE21 GLN 81 HE22 GLN 81 -21.953 -16.998 -4.886 637 HE22 GLN 81 HE21 GLN 81 -22.448 -16.525 -3.270 638 H TYR 82 H TYR 82 -17.565 -18.683 -6.349 639 HA TYR 82 HA TYR 82 -19.284 -20.937 -6.251 640 HB2 TYR 82 HB2 TYR 82 -17.720 -20.628 -8.079 641 HB3 TYR 82 HB3 TYR 82 -16.362 -20.481 -6.967 642 HD1 TYR 82 HD1 TYR 82 -18.765 -22.883 -8.461 643 HD2 TYR 82 HD2 TYR 82 -15.190 -22.372 -6.137 644 HE1 TYR 82 HE1 TYR 82 -18.261 -25.311 -8.717 645 HE2 TYR 82 HE2 TYR 82 -14.683 -24.793 -6.364 646 HH TYR 82 HH TYR 82 -16.823 -27.014 -8.203 647 H ARG 83 H ARG 83 -16.714 -19.946 -3.996 648 HA ARG 83 HA ARG 83 -16.916 -22.658 -2.812 649 HB2 ARG 83 HB2 ARG 83 -14.664 -21.506 -3.435 650 HB3 ARG 83 HB3 ARG 83 -14.912 -20.573 -1.942 651 HG2 ARG 83 HG2 ARG 83 -13.562 -22.524 -1.422 652 HG3 ARG 83 HG3 ARG 83 -15.172 -22.781 -0.716 653 HD2 ARG 83 HD2 ARG 83 -15.783 -24.155 -2.738 654 HD3 ARG 83 HD3 ARG 83 -14.149 -23.902 -3.365 655 HE ARG 83 HE ARG 83 -13.931 -24.995 -0.759 656 HH11 ARG 83 HH11 ARG 83 -15.108 -25.908 -3.966 657 HH12 ARG 83 HH12 ARG 83 -14.780 -27.601 -3.739 658 HH21 ARG 83 HH21 ARG 83 -13.486 -27.233 -0.501 659 HH22 ARG 83 HH22 ARG 83 -13.878 -28.353 -1.786 660 H LEU 84 H LEU 84 -17.808 -19.295 -2.219 661 HA LEU 84 HA LEU 84 -18.571 -19.730 0.523 662 HB2 LEU 84 HB2 LEU 84 -18.249 -17.530 -0.547 663 HB3 LEU 84 HB3 LEU 84 -19.633 -17.810 -1.612 664 HG LEU 84 HG LEU 84 -20.072 -18.070 1.335 665 HD11 LEU 84 HD11 LEU 84 -18.664 -16.035 1.110 666 HD12 LEU 84 HD12 LEU 84 -19.802 -15.385 -0.083 667 HD13 LEU 84 HD13 LEU 84 -20.317 -15.640 1.600 668 HD21 LEU 84 HD21 LEU 84 -21.697 -16.777 -0.881 669 HD22 LEU 84 HD22 LEU 84 -21.939 -18.420 -0.251 670 HD23 LEU 84 HD23 LEU 84 -22.213 -17.026 0.805 671 H GLU 85 H GLU 85 -19.837 -20.476 -2.641 672 HA GLU 85 HA GLU 85 -22.514 -21.261 -1.836 673 HB2 GLU 85 HB2 GLU 85 -20.829 -21.291 -4.346 674 HB3 GLU 85 HB3 GLU 85 -22.339 -22.179 -4.324 675 HG2 GLU 85 HG2 GLU 85 -23.592 -20.168 -3.695 676 HG3 GLU 85 HG3 GLU 85 -22.099 -19.237 -3.561 677 H LEU 86 H LEU 86 -19.577 -22.734 -1.237 678 HA LEU 86 HA LEU 86 -20.871 -25.421 -1.225 679 HB2 LEU 86 HB2 LEU 86 -18.093 -24.722 -2.246 680 HB3 LEU 86 HB3 LEU 86 -18.632 -26.373 -1.897 681 HG LEU 86 HG LEU 86 -19.957 -24.526 -3.928 682 HD11 LEU 86 HD11 LEU 86 -17.663 -25.175 -4.592 683 HD12 LEU 86 HD12 LEU 86 -18.058 -26.885 -4.285 684 HD13 LEU 86 HD13 LEU 86 -18.877 -26.002 -5.596 685 HD21 LEU 86 HD21 LEU 86 -21.029 -26.637 -4.694 686 HD22 LEU 86 HD22 LEU 86 -20.284 -27.502 -3.338 687 HD23 LEU 86 HD23 LEU 86 -21.497 -26.241 -3.033 688 H ALA 87 H ALA 87 -18.743 -23.067 0.313 689 HA ALA 87 HA ALA 87 -17.649 -24.844 2.278 690 HB1 ALA 87 HB1 ALA 87 -16.716 -22.618 1.825 691 HB2 ALA 87 HB2 ALA 87 -18.233 -21.850 2.340 692 HB3 ALA 87 HB3 ALA 87 -17.222 -22.730 3.522 693 H GLN 88 H GLN 88 -20.752 -23.161 1.925 694 HA GLN 88 HA GLN 88 -21.675 -23.637 4.612 695 HB2 GLN 88 HB2 GLN 88 -23.048 -22.969 1.982 696 HB3 GLN 88 HB3 GLN 88 -23.883 -23.024 3.536 697 HG2 GLN 88 HG2 GLN 88 -21.513 -21.201 2.947 698 HG3 GLN 88 HG3 GLN 88 -23.209 -20.717 2.836 699 HE21 GLN 88 HE22 GLN 88 -21.743 -19.210 4.479 700 HE22 GLN 88 HE21 GLN 88 -22.065 -19.588 6.161 701 H GLY 89 H GLY 89 -20.809 -25.853 2.389 702 HA2 GLY 89 HA2 GLY 89 -22.775 -27.837 3.373 703 HA3 GLY 89 HA3 GLY 89 -22.513 -27.669 1.619 704 H ALA 90 H ALA 90 -19.766 -27.013 3.642 705 HA ALA 90 HA ALA 90 -18.757 -29.792 3.410 706 HB1 ALA 90 HB1 ALA 90 -17.277 -27.292 2.502 707 HB2 ALA 90 HB2 ALA 90 -16.618 -28.940 2.520 708 HB3 ALA 90 HB3 ALA 90 -17.968 -28.539 1.430 709 H VAL 91 H VAL 91 -19.063 -26.809 5.139 710 HA VAL 91 HA VAL 91 -16.906 -27.097 6.984 711 HB VAL 91 HB VAL 91 -18.301 -25.072 6.559 712 HG11 VAL 91 HG11 VAL 91 -20.531 -26.143 6.509 713 HG12 VAL 91 HG12 VAL 91 -20.394 -26.486 8.252 714 HG13 VAL 91 HG13 VAL 91 -20.458 -24.804 7.678 715 HG21 VAL 91 HG21 VAL 91 -18.346 -24.269 8.863 716 HG22 VAL 91 HG22 VAL 91 -18.263 -25.935 9.481 717 HG23 VAL 91 HG23 VAL 91 -16.889 -25.242 8.597 718 H GLY 92 H GLY 92 -19.763 -28.882 6.509 719 HA2 GLY 92 HA2 GLY 92 -19.676 -30.082 9.243 720 HA3 GLY 92 HA3 GLY 92 -21.099 -30.048 8.182 721 H SER 93 H SER 93 -17.810 -30.746 7.046 722 HA SER 93 HA SER 93 -18.483 -33.627 6.723 723 HB2 SER 93 HB2 SER 93 -17.553 -31.708 4.557 724 HB3 SER 93 HB3 SER 93 -17.602 -33.472 4.366 725 HG SER 93 HG SER 93 -19.859 -33.376 4.783 726 H VAL 94 H VAL 94 -16.394 -34.618 5.543 727 HA VAL 94 HA VAL 94 -13.959 -33.688 6.876 728 HB VAL 94 HB VAL 94 -15.235 -35.050 8.530 729 HG11 VAL 94 HG11 VAL 94 -14.768 -37.385 6.640 730 HG12 VAL 94 HG12 VAL 94 -15.452 -37.463 8.267 731 HG13 VAL 94 HG13 VAL 94 -16.332 -36.617 6.981 732 HG21 VAL 94 HG21 VAL 94 -13.382 -36.432 9.264 733 HG22 VAL 94 HG22 VAL 94 -12.645 -36.384 7.657 734 HG23 VAL 94 HG23 VAL 94 -12.770 -34.896 8.621 735 H GLN 95 H GLN 95 -14.746 -33.692 4.248 736 HA GLN 95 HA GLN 95 -14.062 -35.764 2.546 737 HB2 GLN 95 HB2 GLN 95 -13.850 -32.763 2.361 738 HB3 GLN 95 HB3 GLN 95 -13.958 -33.772 0.988 739 HG2 GLN 95 HG2 GLN 95 -16.180 -34.105 1.100 740 HG3 GLN 95 HG3 GLN 95 -16.153 -34.270 2.868 741 HE21 GLN 95 HE22 GLN 95 -14.914 -31.959 3.681 742 HE22 GLN 95 HE21 GLN 95 -15.916 -30.617 3.304 743 H ILE 96 H ILE 96 -11.929 -34.273 4.702 744 HA ILE 96 HA ILE 96 -9.569 -35.048 3.098 745 HB ILE 96 HB ILE 96 -8.446 -32.924 3.830 746 HG12 ILE 96 HG12 ILE 96 -11.263 -32.038 4.561 747 HG13 ILE 96 HG13 ILE 96 -9.959 -32.386 5.712 748 HG21 ILE 96 HG21 ILE 96 -10.903 -32.446 2.111 749 HG22 ILE 96 HG22 ILE 96 -9.376 -31.551 2.056 750 HG23 ILE 96 HG23 ILE 96 -9.421 -33.242 1.541 751 HD11 ILE 96 HD11 ILE 96 -9.952 -30.188 3.599 752 HD12 ILE 96 HD12 ILE 96 -10.120 -29.990 5.348 753 HD13 ILE 96 HD13 ILE 96 -8.584 -30.580 4.677 754 HA PRO 97 HA PRO 97 -8.327 -36.717 6.989 755 HB2 PRO 97 HB2 PRO 97 -5.607 -36.664 6.845 756 HB3 PRO 97 HB3 PRO 97 -6.607 -37.713 5.790 757 HG2 PRO 97 HG2 PRO 97 -5.462 -34.981 5.145 758 HG3 PRO 97 HG3 PRO 97 -5.354 -36.483 4.164 759 HD2 PRO 97 HD2 PRO 97 -7.243 -34.585 3.675 760 HD3 PRO 97 HD3 PRO 97 -7.625 -36.325 3.524 761 H VAL 98 H VAL 98 -6.946 -36.305 8.939 762 HA VAL 98 HA VAL 98 -6.453 -33.431 9.453 763 HB VAL 98 HB VAL 98 -7.708 -33.552 11.585 764 HG11 VAL 98 HG11 VAL 98 -9.435 -34.208 9.172 765 HG12 VAL 98 HG12 VAL 98 -9.946 -33.359 10.650 766 HG13 VAL 98 HG13 VAL 98 -8.768 -32.603 9.550 767 HG21 VAL 98 HG21 VAL 98 -9.321 -35.362 11.967 768 HG22 VAL 98 HG22 VAL 98 -8.769 -36.196 10.503 769 HG23 VAL 98 HG23 VAL 98 -7.673 -36.018 11.892 770 H VAL 99 H VAL 99 -5.563 -36.652 9.696 771 HA VAL 99 HA VAL 99 -4.080 -37.855 10.861 772 HB VAL 99 HB VAL 99 -1.817 -36.949 10.705 773 HG11 VAL 99 HG11 VAL 99 -1.863 -36.550 8.280 774 HG12 VAL 99 HG12 VAL 99 -2.995 -37.840 8.722 775 HG13 VAL 99 HG13 VAL 99 -3.606 -36.212 8.347 776 HG21 VAL 99 HG21 VAL 99 -2.290 -34.597 11.423 777 HG22 VAL 99 HG22 VAL 99 -1.392 -34.692 9.894 778 HG23 VAL 99 HG23 VAL 99 -3.131 -34.324 9.873 779 H GLU 100 H GLU 100 -5.838 -36.484 12.769 780 HA GLU 100 HA GLU 100 -4.016 -36.686 15.093 781 HB2 GLU 100 HB2 GLU 100 -4.924 -34.727 16.105 782 HB3 GLU 100 HB3 GLU 100 -4.433 -34.297 14.449 783 HG2 GLU 100 HG2 GLU 100 -6.792 -34.533 13.704 784 HG3 GLU 100 HG3 GLU 100 -7.271 -34.927 15.362 785 H VAL 101 H VAL 101 -5.303 -36.940 17.174 786 HA VAL 101 HA VAL 101 -7.950 -38.156 16.828 787 HB VAL 101 HB VAL 101 -6.094 -39.838 16.522 788 HG11 VAL 101 HG11 VAL 101 -5.654 -39.404 19.499 789 HG12 VAL 101 HG12 VAL 101 -4.908 -40.666 18.487 790 HG13 VAL 101 HG13 VAL 101 -4.520 -38.953 18.203 791 HG21 VAL 101 HG21 VAL 101 -8.401 -40.477 17.213 792 HG22 VAL 101 HG22 VAL 101 -7.165 -41.565 17.882 793 HG23 VAL 101 HG23 VAL 101 -7.905 -40.336 18.924 794 H ASP 102 H ASP 102 -9.046 -38.467 18.914 795 HA ASP 102 HA ASP 102 -8.634 -36.260 20.705 796 HB2 ASP 102 HB2 ASP 102 -10.837 -37.254 20.137 797 HB3 ASP 102 HB3 ASP 102 -10.352 -38.741 20.972 798 H GLU 103 H GLU 103 -8.122 -36.329 22.971 799 HA GLU 103 HA GLU 103 -6.710 -38.738 23.947 800 HB2 GLU 103 HB2 GLU 103 -5.576 -35.943 24.230 801 HB3 GLU 103 HB3 GLU 103 -4.808 -37.490 24.592 802 HG2 GLU 103 HG2 GLU 103 -5.031 -38.042 22.111 803 HG3 GLU 103 HG3 GLU 103 -5.482 -36.350 21.860 804 H LEU 104 H LEU 104 -5.897 -38.017 26.342 805 HA LEU 104 HA LEU 104 -8.210 -36.814 27.772 806 HB2 LEU 104 HB2 LEU 104 -6.506 -39.155 28.672 807 HB3 LEU 104 HB3 LEU 104 -7.945 -38.566 29.433 808 HG LEU 104 HG LEU 104 -7.888 -39.835 26.687 809 HD11 LEU 104 HD11 LEU 104 -8.821 -40.932 29.370 810 HD12 LEU 104 HD12 LEU 104 -8.963 -41.752 27.797 811 HD13 LEU 104 HD13 LEU 104 -7.357 -41.431 28.492 812 HD21 LEU 104 HD21 LEU 104 -10.362 -39.905 26.970 813 HD22 LEU 104 HD22 LEU 104 -10.205 -39.043 28.521 814 HD23 LEU 104 HD23 LEU 104 -9.772 -38.230 27.004 815 HA PRO 105 HA PRO 105 -5.056 -34.491 29.806 816 HB2 PRO 105 HB2 PRO 105 -6.056 -33.984 32.279 817 HB3 PRO 105 HB3 PRO 105 -6.918 -33.451 30.798 818 HG2 PRO 105 HG2 PRO 105 -7.444 -35.901 32.486 819 HG3 PRO 105 HG3 PRO 105 -8.631 -34.722 31.844 820 HD2 PRO 105 HD2 PRO 105 -7.999 -37.137 30.666 821 HD3 PRO 105 HD3 PRO 105 -8.598 -35.750 29.722 822 H GLU 106 H GLU 106 -5.059 -37.654 30.206 823 HA GLU 106 HA GLU 106 -3.831 -39.193 31.336 824 HB2 GLU 106 HB2 GLU 106 -1.979 -36.804 31.571 825 HB3 GLU 106 HB3 GLU 106 -1.499 -38.478 31.904 826 HG2 GLU 106 HG2 GLU 106 -2.570 -37.443 29.244 827 HG3 GLU 106 HG3 GLU 106 -0.870 -37.754 29.620 828 H GLY 107 H GLY 107 -5.769 -37.529 32.885 829 HA2 GLY 107 HA2 GLY 107 -5.036 -38.510 35.548 830 HA3 GLY 107 HA3 GLY 107 -5.236 -36.745 35.390 831 H TYR 108 H TYR 108 -7.054 -38.877 33.319 832 HA TYR 108 HA TYR 108 -9.572 -37.814 34.031 833 HB2 TYR 108 HB2 TYR 108 -10.445 -39.585 32.549 834 HB3 TYR 108 HB3 TYR 108 -9.123 -38.661 31.846 835 HD1 TYR 108 HD2 TYR 108 -6.918 -39.636 31.486 836 HD2 TYR 108 HD1 TYR 108 -10.169 -41.926 33.094 837 HE1 TYR 108 HE2 TYR 108 -5.657 -41.736 31.021 838 HE2 TYR 108 HE1 TYR 108 -8.913 -44.030 32.660 839 HH TYR 108 HH TYR 108 -6.982 -44.968 31.834 840 H ASP 109 H ASP 109 -11.472 -39.419 34.484 841 HA ASP 109 HA ASP 109 -11.129 -40.053 37.265 842 HB2 ASP 109 HB2 ASP 109 -13.500 -40.347 35.412 843 HB3 ASP 109 HB3 ASP 109 -13.578 -40.444 37.179 844 H ARG 110 H ARG 110 -9.765 -41.885 35.292 845 HA ARG 110 HA ARG 110 -10.585 -44.403 36.555 846 HB2 ARG 110 HB2 ARG 110 -12.123 -44.165 34.658 847 HB3 ARG 110 HB3 ARG 110 -10.750 -44.046 33.564 848 HG2 ARG 110 HG2 ARG 110 -10.069 -46.339 34.079 849 HG3 ARG 110 HG3 ARG 110 -11.320 -46.444 35.350 850 HD2 ARG 110 HD2 ARG 110 -13.077 -46.147 33.644 851 HD3 ARG 110 HD3 ARG 110 -11.837 -46.004 32.379 852 HE ARG 110 HE ARG 110 -11.405 -48.437 33.755 853 HH11 ARG 110 HH11 ARG 110 -13.824 -46.964 31.648 854 HH12 ARG 110 HH12 ARG 110 -14.363 -48.489 30.991 855 HH21 ARG 110 HH21 ARG 110 -12.118 -50.420 32.872 856 HH22 ARG 110 HH22 ARG 110 -13.387 -50.443 31.669 857 H SER 111 H SER 111 -9.101 -46.219 35.869 858 HA SER 111 HA SER 111 -6.438 -45.367 34.915 859 HB2 SER 111 HB2 SER 111 -6.917 -46.660 37.640 860 HB3 SER 111 HB3 SER 111 -5.334 -46.355 36.899 861 HG SER 111 HG SER 111 -5.909 -44.105 36.884 Start of MODEL 19 1 H1 SER 2 H1 SER 2 7.521 -1.574 -5.175 2 H2 SER 2 H2 SER 2 8.346 -2.811 -5.875 3 H3 SER 2 H3 SER 2 8.436 -2.585 -4.244 4 HA SER 2 HA SER 2 6.133 -3.095 -3.973 5 HB2 SER 2 HB2 SER 2 6.220 -3.577 -6.977 6 HB3 SER 2 HB3 SER 2 4.840 -3.913 -5.905 7 HG SER 2 HG SER 2 4.685 -1.862 -6.915 8 H GLN 3 H GLN 3 5.769 -5.126 -3.190 9 HA GLN 3 HA GLN 3 7.289 -7.406 -4.337 10 HB2 GLN 3 HB2 GLN 3 7.273 -6.572 -1.405 11 HB3 GLN 3 HB3 GLN 3 7.923 -8.100 -2.018 12 HG2 GLN 3 HG2 GLN 3 8.940 -5.332 -2.782 13 HG3 GLN 3 HG3 GLN 3 9.689 -6.402 -1.602 14 HE21 GLN 3 HE22 GLN 3 11.108 -5.433 -3.839 15 HE22 GLN 3 HE21 GLN 3 11.454 -6.777 -4.908 16 H PHE 4 H PHE 4 4.357 -6.229 -3.842 17 HA PHE 4 HA PHE 4 2.923 -7.896 -2.121 18 HB2 PHE 4 HB2 PHE 4 2.035 -5.898 -3.208 19 HB3 PHE 4 HB3 PHE 4 2.193 -6.644 -4.791 20 HD1 PHE 4 HD1 PHE 4 0.756 -8.692 -5.344 21 HD2 PHE 4 HD2 PHE 4 0.038 -6.165 -1.951 22 HE1 PHE 4 HE1 PHE 4 -1.560 -9.544 -5.218 23 HE2 PHE 4 HE2 PHE 4 -2.306 -6.991 -1.839 24 HZ PHE 4 HZ PHE 4 -3.108 -8.662 -3.489 25 H GLU 5 H GLU 5 3.596 -8.410 -5.639 26 HA GLU 5 HA GLU 5 2.139 -10.929 -5.598 27 HB2 GLU 5 HB2 GLU 5 3.986 -9.703 -7.692 28 HB3 GLU 5 HB3 GLU 5 2.980 -11.150 -7.923 29 HG2 GLU 5 HG2 GLU 5 0.951 -9.801 -7.406 30 HG3 GLU 5 HG3 GLU 5 1.968 -8.348 -7.298 31 H LYS 6 H LYS 6 5.487 -10.007 -5.011 32 HA LYS 6 HA LYS 6 6.824 -12.266 -5.983 33 HB2 LYS 6 HB2 LYS 6 7.794 -10.085 -5.239 34 HB3 LYS 6 HB3 LYS 6 7.524 -10.601 -3.574 35 HG2 LYS 6 HG2 LYS 6 9.833 -11.028 -4.212 36 HG3 LYS 6 HG3 LYS 6 8.998 -12.570 -3.967 37 HD2 LYS 6 HD2 LYS 6 8.755 -12.862 -6.392 38 HD3 LYS 6 HD3 LYS 6 9.417 -11.231 -6.680 39 HE2 LYS 6 HE2 LYS 6 11.553 -11.928 -5.637 40 HE3 LYS 6 HE3 LYS 6 10.901 -13.558 -5.379 41 HZ1 LYS 6 HZ1 LYS 6 11.278 -12.233 -7.992 42 HZ2 LYS 6 HZ2 LYS 6 12.223 -13.431 -7.380 43 HZ3 LYS 6 HZ3 LYS 6 10.652 -13.742 -7.777 44 H GLN 7 H GLN 7 5.314 -11.777 -2.752 45 HA GLN 7 HA GLN 7 6.268 -14.343 -1.802 46 HB2 GLN 7 HB2 GLN 7 5.243 -11.969 -0.695 47 HB3 GLN 7 HB3 GLN 7 3.960 -13.150 -0.409 48 HG2 GLN 7 HG2 GLN 7 6.886 -13.414 0.350 49 HG3 GLN 7 HG3 GLN 7 5.533 -13.117 1.456 50 HE21 GLN 7 HE22 GLN 7 3.633 -14.848 1.062 51 HE22 GLN 7 HE21 GLN 7 4.188 -16.508 1.022 52 H LYS 8 H LYS 8 3.373 -13.067 -3.355 53 HA LYS 8 HA LYS 8 1.601 -15.238 -2.597 54 HB2 LYS 8 HB2 LYS 8 0.983 -12.855 -2.967 55 HB3 LYS 8 HB3 LYS 8 1.437 -13.011 -4.638 56 HG2 LYS 8 HG2 LYS 8 -0.401 -14.980 -4.601 57 HG3 LYS 8 HG3 LYS 8 -0.966 -14.114 -3.190 58 HD2 LYS 8 HD2 LYS 8 -2.121 -13.348 -5.205 59 HD3 LYS 8 HD3 LYS 8 -1.115 -12.029 -4.562 60 HE2 LYS 8 HE2 LYS 8 0.608 -12.421 -6.207 61 HE3 LYS 8 HE3 LYS 8 -0.126 -13.946 -6.718 62 HZ1 LYS 8 HZ1 LYS 8 -1.984 -12.688 -7.573 63 HZ2 LYS 8 HZ2 LYS 8 -1.312 -11.265 -7.085 64 HZ3 LYS 8 HZ3 LYS 8 -0.588 -12.160 -8.259 65 H GLU 9 H GLU 9 3.896 -14.752 -5.231 66 HA GLU 9 HA GLU 9 2.640 -17.037 -6.679 67 HB2 GLU 9 HB2 GLU 9 3.584 -16.228 -8.687 68 HB3 GLU 9 HB3 GLU 9 2.850 -14.827 -7.887 69 HG2 GLU 9 HG2 GLU 9 5.145 -14.250 -6.990 70 HG3 GLU 9 HG3 GLU 9 5.812 -15.567 -7.955 71 H GLN 10 H GLN 10 4.822 -16.679 -4.376 72 HA GLN 10 HA GLN 10 6.574 -18.817 -5.490 73 HB2 GLN 10 HB2 GLN 10 7.181 -16.670 -3.414 74 HB3 GLN 10 HB3 GLN 10 8.220 -18.082 -3.736 75 HG2 GLN 10 HG2 GLN 10 8.306 -17.386 -6.156 76 HG3 GLN 10 HG3 GLN 10 7.484 -15.877 -5.729 77 HE21 GLN 10 HE22 GLN 10 10.314 -16.635 -6.728 78 HE22 GLN 10 HE21 GLN 10 11.386 -15.800 -5.626 79 H GLY 11 H GLY 11 3.895 -18.363 -3.777 80 HA2 GLY 11 HA2 GLY 11 4.404 -20.704 -1.998 81 HA3 GLY 11 HA3 GLY 11 3.250 -19.405 -1.639 82 H ASN 12 H ASN 12 3.058 -19.668 -4.893 83 HA ASN 12 HA ASN 12 0.519 -20.938 -4.996 84 HB2 ASN 12 HB2 ASN 12 0.795 -20.694 -7.388 85 HB3 ASN 12 HB3 ASN 12 1.479 -19.292 -6.612 86 HD21 ASN 12 HD22 ASN 12 2.000 -20.644 -9.277 87 HD22 ASN 12 HD21 ASN 12 3.737 -20.870 -9.319 88 H SER 13 H SER 13 3.794 -22.207 -5.163 89 HA SER 13 HA SER 13 2.806 -24.832 -6.055 90 HB2 SER 13 HB2 SER 13 4.972 -24.059 -6.894 91 HB3 SER 13 HB3 SER 13 5.560 -23.804 -5.233 92 HG SER 13 HG SER 13 6.210 -25.840 -6.205 93 H LEU 14 H LEU 14 3.936 -23.137 -3.137 94 HA LEU 14 HA LEU 14 4.254 -25.346 -1.439 95 HB2 LEU 14 HB2 LEU 14 4.835 -22.820 -1.173 96 HB3 LEU 14 HB3 LEU 14 3.183 -22.639 -0.602 97 HG LEU 14 HG LEU 14 3.688 -24.312 1.212 98 HD11 LEU 14 HD11 LEU 14 5.581 -25.499 0.094 99 HD12 LEU 14 HD12 LEU 14 6.535 -24.000 0.149 100 HD13 LEU 14 HD13 LEU 14 6.079 -24.829 1.657 101 HD21 LEU 14 HD21 LEU 14 5.495 -21.875 0.958 102 HD22 LEU 14 HD22 LEU 14 3.862 -21.918 1.658 103 HD23 LEU 14 HD23 LEU 14 5.208 -22.760 2.469 104 H PHE 15 H PHE 15 1.352 -23.674 -2.543 105 HA PHE 15 HA PHE 15 -0.524 -24.840 -0.695 106 HB2 PHE 15 HB2 PHE 15 -1.015 -22.832 -2.014 107 HB3 PHE 15 HB3 PHE 15 -0.668 -23.684 -3.510 108 HD1 PHE 15 HD1 PHE 15 -2.725 -24.930 -0.649 109 HD2 PHE 15 HD2 PHE 15 -2.646 -23.527 -4.703 110 HE1 PHE 15 HE1 PHE 15 -5.108 -25.569 -0.896 111 HE2 PHE 15 HE2 PHE 15 -5.095 -24.043 -4.926 112 HZ PHE 15 HZ PHE 15 -6.287 -25.120 -3.053 113 H LYS 16 H LYS 16 1.011 -25.962 -3.637 114 HA LYS 16 HA LYS 16 -0.946 -28.173 -3.921 115 HB2 LYS 16 HB2 LYS 16 1.258 -27.150 -5.735 116 HB3 LYS 16 HB3 LYS 16 0.093 -28.433 -6.143 117 HG2 LYS 16 HG2 LYS 16 -1.766 -26.854 -5.926 118 HG3 LYS 16 HG3 LYS 16 -0.670 -25.580 -5.353 119 HD2 LYS 16 HD2 LYS 16 0.533 -25.637 -7.519 120 HD3 LYS 16 HD3 LYS 16 -0.622 -26.857 -8.108 121 HE2 LYS 16 HE2 LYS 16 -2.487 -25.247 -7.625 122 HE3 LYS 16 HE3 LYS 16 -1.272 -24.046 -7.136 123 HZ1 LYS 16 HZ1 LYS 16 -1.483 -25.264 -9.818 124 HZ2 LYS 16 HZ2 LYS 16 -1.969 -23.744 -9.422 125 HZ3 LYS 16 HZ3 LYS 16 -0.371 -24.143 -9.363 126 H GLN 17 H GLN 17 1.979 -27.630 -2.341 127 HA GLN 17 HA GLN 17 3.312 -30.123 -2.949 128 HB2 GLN 17 HB2 GLN 17 3.709 -27.985 -0.883 129 HB3 GLN 17 HB3 GLN 17 4.679 -29.488 -0.924 130 HG2 GLN 17 HG2 GLN 17 5.313 -29.065 -3.276 131 HG3 GLN 17 HG3 GLN 17 4.283 -27.676 -3.330 132 HE21 GLN 17 HE22 GLN 17 5.709 -26.086 -3.707 133 HE22 GLN 17 HE21 GLN 17 6.931 -25.631 -2.540 134 H GLY 18 H GLY 18 0.757 -29.166 -0.678 135 HA2 GLY 18 HA2 GLY 18 -0.621 -30.865 0.294 136 HA3 GLY 18 HA3 GLY 18 0.765 -31.961 0.373 137 H LEU 19 H LEU 19 1.167 -28.622 1.380 138 HA LEU 19 HA LEU 19 0.947 -29.341 4.237 139 HB2 LEU 19 HB2 LEU 19 3.182 -28.104 4.563 140 HB3 LEU 19 HB3 LEU 19 3.185 -29.779 4.000 141 HG LEU 19 HG LEU 19 3.564 -29.062 1.689 142 HD11 LEU 19 HD11 LEU 19 3.741 -26.253 2.840 143 HD12 LEU 19 HD12 LEU 19 4.127 -26.735 1.173 144 HD13 LEU 19 HD13 LEU 19 2.460 -26.843 1.766 145 HD21 LEU 19 HD21 LEU 19 5.473 -29.515 3.170 146 HD22 LEU 19 HD22 LEU 19 5.862 -28.234 2.000 147 HD23 LEU 19 HD23 LEU 19 5.486 -27.816 3.691 148 H TYR 20 H TYR 20 -1.000 -28.119 3.141 149 HA TYR 20 HA TYR 20 -1.056 -25.552 2.299 150 HB2 TYR 20 HB2 TYR 20 -3.110 -26.719 4.170 151 HB3 TYR 20 HB3 TYR 20 -3.399 -25.604 2.853 152 HD1 TYR 20 HD2 TYR 20 -1.934 -26.859 0.599 153 HD2 TYR 20 HD1 TYR 20 -4.281 -28.642 3.728 154 HE1 TYR 20 HE2 TYR 20 -2.415 -28.790 -0.864 155 HE2 TYR 20 HE1 TYR 20 -4.787 -30.568 2.263 156 HH TYR 20 HH TYR 20 -4.418 -31.571 0.226 157 H ARG 21 H ARG 21 -0.559 -26.436 5.717 158 HA ARG 21 HA ARG 21 -1.607 -24.081 6.864 159 HB2 ARG 21 HB2 ARG 21 -0.180 -26.416 7.711 160 HB3 ARG 21 HB3 ARG 21 0.725 -25.019 8.320 161 HG2 ARG 21 HG2 ARG 21 -2.255 -25.529 8.728 162 HG3 ARG 21 HG3 ARG 21 -0.976 -25.795 9.931 163 HD2 ARG 21 HD2 ARG 21 -0.416 -23.391 9.883 164 HD3 ARG 21 HD3 ARG 21 -1.677 -23.103 8.674 165 HE ARG 21 HE ARG 21 -2.049 -23.639 11.547 166 HH11 ARG 21 HH11 ARG 21 -3.560 -23.301 8.365 167 HH12 ARG 21 HH12 ARG 21 -5.175 -23.131 9.029 168 HH21 ARG 21 HH21 ARG 21 -4.170 -23.384 12.360 169 HH22 ARG 21 HH22 ARG 21 -5.516 -23.156 11.256 170 H GLU 22 H GLU 22 1.315 -24.569 5.051 171 HA GLU 22 HA GLU 22 2.555 -22.052 5.963 172 HB2 GLU 22 HB2 GLU 22 3.236 -23.842 3.608 173 HB3 GLU 22 HB3 GLU 22 4.284 -22.643 4.386 174 HG2 GLU 22 HG2 GLU 22 3.213 -25.147 5.768 175 HG3 GLU 22 HG3 GLU 22 4.738 -25.040 4.913 176 H ALA 23 H ALA 23 0.796 -23.440 3.252 177 HA ALA 23 HA ALA 23 1.122 -21.295 1.397 178 HB1 ALA 23 HB1 ALA 23 -0.547 -22.492 0.104 179 HB2 ALA 23 HB2 ALA 23 0.630 -23.631 0.820 180 HB3 ALA 23 HB3 ALA 23 -0.996 -23.467 1.524 181 H VAL 24 H VAL 24 -1.017 -21.594 4.164 182 HA VAL 24 HA VAL 24 -3.095 -19.772 3.155 183 HB VAL 24 HB VAL 24 -2.143 -20.497 5.987 184 HG11 VAL 24 HG11 VAL 24 -3.396 -18.370 5.971 185 HG12 VAL 24 HG12 VAL 24 -4.717 -19.132 5.044 186 HG13 VAL 24 HG13 VAL 24 -4.369 -19.647 6.711 187 HG21 VAL 24 HG21 VAL 24 -3.098 -22.445 4.708 188 HG22 VAL 24 HG22 VAL 24 -4.162 -21.965 6.043 189 HG23 VAL 24 HG23 VAL 24 -4.563 -21.508 4.367 190 H HIS 25 H HIS 25 -0.280 -19.835 5.119 191 HA HIS 25 HA HIS 25 -0.005 -17.112 5.914 192 HB2 HIS 25 HB2 HIS 25 1.094 -19.791 6.262 193 HB3 HIS 25 HB3 HIS 25 2.369 -18.671 6.036 194 HD2 HIS 25 HD2 HIS 25 2.940 -17.155 8.219 195 HE1 HIS 25 HE1 HIS 25 -0.422 -18.277 10.589 196 HE2 HIS 25 HE2 HIS 25 1.794 -16.990 10.578 197 H CYS 26 H CYS 26 0.091 -18.173 2.871 198 HA CYS 26 HA CYS 26 2.413 -16.475 2.096 199 HB2 CYS 26 HB2 CYS 26 1.298 -19.026 0.883 200 HB3 CYS 26 HB3 CYS 26 2.303 -17.900 -0.022 201 HG CYS 26 HG CYS 26 2.931 -19.367 2.876 202 H TYR 27 H TYR 27 -0.909 -16.609 2.153 203 HA TYR 27 HA TYR 27 -1.052 -14.652 -0.092 204 HB2 TYR 27 HB2 TYR 27 -3.292 -16.445 0.811 205 HB3 TYR 27 HB3 TYR 27 -3.279 -15.410 -0.616 206 HD1 TYR 27 HD1 TYR 27 -0.696 -16.114 -1.895 207 HD2 TYR 27 HD2 TYR 27 -3.588 -18.558 0.128 208 HE1 TYR 27 HE1 TYR 27 0.068 -18.078 -3.207 209 HE2 TYR 27 HE2 TYR 27 -2.842 -20.541 -1.198 210 HH TYR 27 HH TYR 27 -0.203 -20.303 -3.608 211 H ASP 28 H ASP 28 -1.215 -15.069 3.218 212 HA ASP 28 HA ASP 28 -3.493 -13.394 3.833 213 HB2 ASP 28 HB2 ASP 28 -2.430 -15.171 5.294 214 HB3 ASP 28 HB3 ASP 28 -1.041 -14.105 5.505 215 H GLN 29 H GLN 29 -0.079 -12.833 3.059 216 HA GLN 29 HA GLN 29 0.042 -10.308 4.441 217 HB2 GLN 29 HB2 GLN 29 2.215 -10.123 3.650 218 HB3 GLN 29 HB3 GLN 29 1.987 -11.845 3.953 219 HG2 GLN 29 HG2 GLN 29 1.697 -10.478 1.279 220 HG3 GLN 29 HG3 GLN 29 3.183 -11.275 1.806 221 HE21 GLN 29 HE22 GLN 29 1.698 -11.874 -0.561 222 HE22 GLN 29 HE21 GLN 29 1.107 -13.509 -0.458 223 H LEU 30 H LEU 30 -1.375 -11.219 1.411 224 HA LEU 30 HA LEU 30 -1.130 -8.604 0.164 225 HB2 LEU 30 HB2 LEU 30 -3.125 -10.871 -0.243 226 HB3 LEU 30 HB3 LEU 30 -2.947 -9.455 -1.286 227 HG LEU 30 HG LEU 30 -1.757 -10.947 -2.504 228 HD11 LEU 30 HD11 LEU 30 -0.048 -9.275 -1.826 229 HD12 LEU 30 HD12 LEU 30 0.413 -10.300 -0.465 230 HD13 LEU 30 HD13 LEU 30 0.650 -10.873 -2.120 231 HD21 LEU 30 HD21 LEU 30 -2.279 -12.835 -1.097 232 HD22 LEU 30 HD22 LEU 30 -0.567 -12.888 -1.546 233 HD23 LEU 30 HD23 LEU 30 -1.028 -12.346 0.074 234 H ILE 31 H ILE 31 -3.409 -10.261 2.292 235 HA ILE 31 HA ILE 31 -5.463 -8.246 2.061 236 HB ILE 31 HB ILE 31 -4.977 -10.471 4.097 237 HG12 ILE 31 HG12 ILE 31 -6.877 -10.579 1.730 238 HG13 ILE 31 HG13 ILE 31 -5.197 -11.050 1.561 239 HG21 ILE 31 HG21 ILE 31 -6.619 -8.834 4.932 240 HG22 ILE 31 HG22 ILE 31 -7.527 -8.948 3.408 241 HG23 ILE 31 HG23 ILE 31 -7.424 -10.346 4.498 242 HD11 ILE 31 HD11 ILE 31 -5.408 -12.650 3.378 243 HD12 ILE 31 HD12 ILE 31 -7.148 -12.285 3.497 244 HD13 ILE 31 HD13 ILE 31 -6.495 -13.005 1.998 245 H THR 32 H THR 32 -2.532 -8.596 3.819 246 HA THR 32 HA THR 32 -3.287 -6.494 5.793 247 HB THR 32 HB THR 32 -0.800 -8.236 5.600 248 HG1 THR 32 HG1 THR 32 -3.102 -8.399 7.258 249 HG21 THR 32 HG21 THR 32 -1.832 -6.402 7.800 250 HG22 THR 32 HG22 THR 32 -0.510 -7.581 7.998 251 HG23 THR 32 HG23 THR 32 -0.317 -6.217 6.883 252 H ALA 33 H ALA 33 -1.556 -6.864 2.771 253 HA ALA 33 HA ALA 33 0.053 -4.442 3.324 254 HB1 ALA 33 HB1 ALA 33 0.060 -6.353 0.961 255 HB2 ALA 33 HB2 ALA 33 1.178 -5.002 1.203 256 HB3 ALA 33 HB3 ALA 33 1.193 -6.376 2.331 257 H GLN 34 H GLN 34 -2.713 -5.546 1.435 258 HA GLN 34 HA GLN 34 -3.736 -2.984 0.926 259 HB2 GLN 34 HB2 GLN 34 -3.379 -2.933 -1.601 260 HB3 GLN 34 HB3 GLN 34 -2.048 -2.425 -0.558 261 HG2 GLN 34 HG2 GLN 34 -1.326 -4.981 -0.844 262 HG3 GLN 34 HG3 GLN 34 -2.303 -4.823 -2.322 263 HE21 GLN 34 HE22 GLN 34 0.309 -3.241 -0.423 264 HE22 GLN 34 HE21 GLN 34 1.199 -2.648 -1.804 265 HA PRO 35 HA PRO 35 -6.365 -6.728 0.518 266 HB2 PRO 35 HB2 PRO 35 -8.465 -5.762 2.030 267 HB3 PRO 35 HB3 PRO 35 -7.011 -6.557 2.713 268 HG2 PRO 35 HG2 PRO 35 -7.569 -3.598 2.413 269 HG3 PRO 35 HG3 PRO 35 -6.944 -4.467 3.855 270 HD2 PRO 35 HD2 PRO 35 -5.307 -3.145 2.142 271 HD3 PRO 35 HD3 PRO 35 -4.800 -4.704 2.882 272 H GLN 36 H GLN 36 -6.455 -3.616 -0.729 273 HA GLN 36 HA GLN 36 -9.106 -3.407 -1.719 274 HB2 GLN 36 HB2 GLN 36 -8.138 -1.729 -3.249 275 HB3 GLN 36 HB3 GLN 36 -7.610 -1.496 -1.572 276 HG2 GLN 36 HG2 GLN 36 -5.487 -2.660 -2.075 277 HG3 GLN 36 HG3 GLN 36 -6.026 -2.938 -3.731 278 HE21 GLN 36 HE22 GLN 36 -3.936 -1.811 -4.227 279 HE22 GLN 36 HE21 GLN 36 -3.954 -0.066 -4.314 280 H ASN 37 H ASN 37 -7.139 -5.930 -2.381 281 HA ASN 37 HA ASN 37 -8.087 -6.142 -5.194 282 HB2 ASN 37 HB2 ASN 37 -5.341 -6.866 -4.092 283 HB3 ASN 37 HB3 ASN 37 -5.907 -7.202 -5.740 284 HD21 ASN 37 HD22 ASN 37 -7.293 -4.647 -6.145 285 HD22 ASN 37 HD21 ASN 37 -6.023 -3.459 -6.333 286 HA PRO 38 HA PRO 38 -9.794 -9.897 -3.516 287 HB2 PRO 38 HB2 PRO 38 -10.782 -10.974 -5.764 288 HB3 PRO 38 HB3 PRO 38 -11.379 -9.406 -5.168 289 HG2 PRO 38 HG2 PRO 38 -9.231 -9.832 -7.269 290 HG3 PRO 38 HG3 PRO 38 -10.742 -8.864 -7.423 291 HD2 PRO 38 HD2 PRO 38 -8.475 -7.608 -6.682 292 HD3 PRO 38 HD3 PRO 38 -9.989 -7.261 -5.889 293 H VAL 39 H VAL 39 -7.122 -9.867 -5.861 294 HA VAL 39 HA VAL 39 -6.887 -12.691 -6.149 295 HB VAL 39 HB VAL 39 -5.824 -10.906 -7.562 296 HG11 VAL 39 HG11 VAL 39 -3.652 -10.017 -6.916 297 HG12 VAL 39 HG12 VAL 39 -4.875 -9.530 -5.725 298 HG13 VAL 39 HG13 VAL 39 -3.739 -10.850 -5.348 299 HG21 VAL 39 HG21 VAL 39 -5.252 -13.300 -7.722 300 HG22 VAL 39 HG22 VAL 39 -3.844 -12.275 -8.043 301 HG23 VAL 39 HG23 VAL 39 -4.004 -13.093 -6.475 302 H GLY 40 H GLY 40 -6.012 -10.465 -3.617 303 HA2 GLY 40 HA2 GLY 40 -4.173 -12.098 -2.147 304 HA3 GLY 40 HA3 GLY 40 -5.160 -10.769 -1.508 305 H TYR 41 H TYR 41 -7.639 -12.270 -2.619 306 HA TYR 41 HA TYR 41 -7.865 -14.183 -0.340 307 HB2 TYR 41 HB2 TYR 41 -10.225 -13.096 -1.925 308 HB3 TYR 41 HB3 TYR 41 -10.198 -13.783 -0.389 309 HD1 TYR 41 HD1 TYR 41 -8.856 -10.713 -2.047 310 HD2 TYR 41 HD2 TYR 41 -10.229 -12.567 1.569 311 HE1 TYR 41 HE1 TYR 41 -8.805 -8.516 -0.916 312 HE2 TYR 41 HE2 TYR 41 -10.173 -10.360 2.716 313 HH TYR 41 HH TYR 41 -9.198 -7.366 1.002 314 H SER 42 H SER 42 -7.781 -13.844 -3.778 315 HA SER 42 HA SER 42 -9.406 -16.044 -4.578 316 HB2 SER 42 HB2 SER 42 -8.681 -14.139 -6.010 317 HB3 SER 42 HB3 SER 42 -7.031 -14.816 -6.017 318 HG SER 42 HG SER 42 -8.208 -15.503 -7.838 319 H ASN 43 H ASN 43 -6.495 -16.182 -2.869 320 HA ASN 43 HA ASN 43 -5.935 -18.919 -3.932 321 HB2 ASN 43 HB2 ASN 43 -3.992 -16.737 -3.060 322 HB3 ASN 43 HB3 ASN 43 -3.538 -18.389 -3.462 323 HD21 ASN 43 HD22 ASN 43 -4.348 -15.257 -4.742 324 HD22 ASN 43 HD21 ASN 43 -4.189 -15.688 -6.433 325 H LYS 44 H LYS 44 -5.988 -16.694 -1.109 326 HA LYS 44 HA LYS 44 -5.427 -18.758 0.843 327 HB2 LYS 44 HB2 LYS 44 -5.279 -16.271 1.127 328 HB3 LYS 44 HB3 LYS 44 -6.996 -16.166 1.041 329 HG2 LYS 44 HG2 LYS 44 -7.214 -17.617 3.056 330 HG3 LYS 44 HG3 LYS 44 -5.442 -17.780 3.112 331 HD2 LYS 44 HD2 LYS 44 -5.221 -15.346 3.457 332 HD3 LYS 44 HD3 LYS 44 -6.985 -15.157 3.355 333 HE2 LYS 44 HE2 LYS 44 -7.240 -16.685 5.304 334 HE3 LYS 44 HE3 LYS 44 -5.474 -16.815 5.431 335 HZ1 LYS 44 HZ1 LYS 44 -5.401 -14.441 5.849 336 HZ2 LYS 44 HZ2 LYS 44 -7.038 -14.329 5.703 337 HZ3 LYS 44 HZ3 LYS 44 -6.379 -15.186 6.943 338 H ALA 45 H ALA 45 -8.293 -17.462 -0.738 339 HA ALA 45 HA ALA 45 -10.269 -18.939 0.695 340 HB1 ALA 45 HB1 ALA 45 -11.746 -18.357 -1.176 341 HB2 ALA 45 HB2 ALA 45 -10.766 -16.947 -0.724 342 HB3 ALA 45 HB3 ALA 45 -10.348 -17.894 -2.170 343 H MET 46 H MET 46 -7.775 -20.258 -1.109 344 HA MET 46 HA MET 46 -9.424 -22.664 -1.745 345 HB2 MET 46 HB2 MET 46 -7.013 -21.577 -3.244 346 HB3 MET 46 HB3 MET 46 -7.792 -23.133 -3.561 347 HG2 MET 46 HG2 MET 46 -9.073 -20.398 -3.857 348 HG3 MET 46 HG3 MET 46 -8.515 -21.466 -5.164 349 HE1 MET 46 HE1 MET 46 -12.446 -21.346 -5.452 350 HE2 MET 46 HE2 MET 46 -11.427 -20.041 -4.810 351 HE3 MET 46 HE3 MET 46 -10.908 -20.959 -6.246 352 H ALA 47 H ALA 47 -6.718 -21.351 -0.008 353 HA ALA 47 HA ALA 47 -5.675 -24.116 0.406 354 HB1 ALA 47 HB1 ALA 47 -4.379 -21.418 0.990 355 HB2 ALA 47 HB2 ALA 47 -3.626 -23.019 1.181 356 HB3 ALA 47 HB3 ALA 47 -4.066 -22.433 -0.434 357 H LEU 48 H LEU 48 -7.452 -21.545 1.950 358 HA LEU 48 HA LEU 48 -6.854 -22.506 4.648 359 HB2 LEU 48 HB2 LEU 48 -7.184 -20.117 4.050 360 HB3 LEU 48 HB3 LEU 48 -8.855 -20.471 3.565 361 HG LEU 48 HG LEU 48 -9.458 -21.020 5.846 362 HD11 LEU 48 HD11 LEU 48 -6.509 -20.581 6.496 363 HD12 LEU 48 HD12 LEU 48 -7.797 -20.744 7.705 364 HD13 LEU 48 HD13 LEU 48 -7.401 -22.107 6.644 365 HD21 LEU 48 HD21 LEU 48 -8.977 -18.795 6.877 366 HD22 LEU 48 HD22 LEU 48 -7.704 -18.531 5.676 367 HD23 LEU 48 HD23 LEU 48 -9.408 -18.637 5.160 368 H ILE 49 H ILE 49 -9.226 -22.985 2.094 369 HA ILE 49 HA ILE 49 -11.175 -24.390 3.681 370 HB ILE 49 HB ILE 49 -11.870 -25.336 1.476 371 HG12 ILE 49 HG12 ILE 49 -9.821 -23.467 0.328 372 HG13 ILE 49 HG13 ILE 49 -9.422 -25.154 0.582 373 HG21 ILE 49 HG21 ILE 49 -12.676 -23.194 0.581 374 HG22 ILE 49 HG22 ILE 49 -12.768 -23.184 2.349 375 HG23 ILE 49 HG23 ILE 49 -11.457 -22.315 1.523 376 HD11 ILE 49 HD11 ILE 49 -11.709 -24.275 -1.161 377 HD12 ILE 49 HD12 ILE 49 -10.128 -24.888 -1.702 378 HD13 ILE 49 HD13 ILE 49 -11.198 -25.958 -0.778 379 H LYS 50 H LYS 50 -8.073 -25.109 2.292 380 HA LYS 50 HA LYS 50 -8.530 -27.862 1.718 381 HB2 LYS 50 HB2 LYS 50 -6.729 -25.953 0.939 382 HB3 LYS 50 HB3 LYS 50 -5.750 -26.846 2.088 383 HG2 LYS 50 HG2 LYS 50 -5.297 -27.932 0.099 384 HG3 LYS 50 HG3 LYS 50 -6.595 -28.964 0.727 385 HD2 LYS 50 HD2 LYS 50 -6.902 -26.648 -1.231 386 HD3 LYS 50 HD3 LYS 50 -6.752 -28.343 -1.723 387 HE2 LYS 50 HE2 LYS 50 -8.961 -27.230 0.041 388 HE3 LYS 50 HE3 LYS 50 -9.094 -27.478 -1.703 389 HZ1 LYS 50 HZ1 LYS 50 -8.550 -29.619 0.254 390 HZ2 LYS 50 HZ2 LYS 50 -9.999 -29.333 -0.473 391 HZ3 LYS 50 HZ3 LYS 50 -8.705 -29.816 -1.370 392 H LEU 51 H LEU 51 -8.275 -26.378 4.660 393 HA LEU 51 HA LEU 51 -6.863 -28.666 5.943 394 HB2 LEU 51 HB2 LEU 51 -6.959 -25.705 6.622 395 HB3 LEU 51 HB3 LEU 51 -6.319 -26.930 7.733 396 HG LEU 51 HG LEU 51 -5.257 -26.600 4.907 397 HD11 LEU 51 HD11 LEU 51 -4.251 -25.379 7.503 398 HD12 LEU 51 HD12 LEU 51 -3.412 -25.327 5.939 399 HD13 LEU 51 HD13 LEU 51 -4.964 -24.489 6.136 400 HD21 LEU 51 HD21 LEU 51 -4.213 -27.902 7.459 401 HD22 LEU 51 HD22 LEU 51 -4.781 -28.758 6.006 402 HD23 LEU 51 HD23 LEU 51 -3.296 -27.784 5.946 403 H GLY 52 H GLY 52 -9.867 -27.305 5.424 404 HA2 GLY 52 HA2 GLY 52 -11.847 -28.162 6.347 405 HA3 GLY 52 HA3 GLY 52 -10.972 -28.638 7.807 406 H GLU 53 H GLU 53 -9.879 -25.565 7.324 407 HA GLU 53 HA GLU 53 -11.710 -24.529 9.342 408 HB2 GLU 53 HB2 GLU 53 -9.433 -22.999 8.046 409 HB3 GLU 53 HB3 GLU 53 -10.205 -22.728 9.587 410 HG2 GLU 53 HG2 GLU 53 -9.336 -24.855 10.469 411 HG3 GLU 53 HG3 GLU 53 -8.559 -25.196 8.908 412 H TYR 54 H TYR 54 -13.189 -24.992 7.078 413 HA TYR 54 HA TYR 54 -13.395 -22.944 5.170 414 HB2 TYR 54 HB2 TYR 54 -15.482 -24.726 6.455 415 HB3 TYR 54 HB3 TYR 54 -15.856 -23.625 5.134 416 HD1 TYR 54 HD1 TYR 54 -14.060 -26.718 6.060 417 HD2 TYR 54 HD2 TYR 54 -15.116 -24.023 2.885 418 HE1 TYR 54 HE1 TYR 54 -13.318 -28.401 4.394 419 HE2 TYR 54 HE2 TYR 54 -14.390 -25.704 1.214 420 HH TYR 54 HH TYR 54 -13.058 -28.892 2.176 421 H THR 55 H THR 55 -14.410 -22.998 8.565 422 HA THR 55 HA THR 55 -16.208 -20.835 8.600 423 HB THR 55 HB THR 55 -14.045 -21.644 10.607 424 HG1 THR 55 HG1 THR 55 -15.766 -22.825 11.527 425 HG21 THR 55 HG21 THR 55 -14.954 -19.411 11.143 426 HG22 THR 55 HG22 THR 55 -16.614 -20.000 10.911 427 HG23 THR 55 HG23 THR 55 -15.631 -20.601 12.274 428 H GLN 56 H GLN 56 -12.714 -20.901 8.178 429 HA GLN 56 HA GLN 56 -12.484 -17.997 8.666 430 HB2 GLN 56 HB2 GLN 56 -10.366 -20.097 8.089 431 HB3 GLN 56 HB3 GLN 56 -10.107 -18.461 8.731 432 HG2 GLN 56 HG2 GLN 56 -11.352 -19.081 10.772 433 HG3 GLN 56 HG3 GLN 56 -11.709 -20.666 10.112 434 HE21 GLN 56 HE22 GLN 56 -10.794 -21.624 11.944 435 HE22 GLN 56 HE21 GLN 56 -9.064 -21.802 12.060 436 H ALA 57 H ALA 57 -12.834 -20.290 6.085 437 HA ALA 57 HA ALA 57 -11.403 -18.694 4.089 438 HB1 ALA 57 HB1 ALA 57 -13.210 -21.142 3.857 439 HB2 ALA 57 HB2 ALA 57 -12.186 -20.459 2.565 440 HB3 ALA 57 HB3 ALA 57 -11.443 -21.173 4.015 441 H ILE 58 H ILE 58 -14.788 -19.400 5.028 442 HA ILE 58 HA ILE 58 -16.116 -17.992 2.883 443 HB ILE 58 HB ILE 58 -16.784 -18.485 5.857 444 HG12 ILE 58 HG12 ILE 58 -17.708 -20.053 3.429 445 HG13 ILE 58 HG13 ILE 58 -16.347 -20.537 4.445 446 HG21 ILE 58 HG21 ILE 58 -19.082 -18.103 5.412 447 HG22 ILE 58 HG22 ILE 58 -18.251 -16.731 4.682 448 HG23 ILE 58 HG23 ILE 58 -18.821 -18.092 3.670 449 HD11 ILE 58 HD11 ILE 58 -19.240 -20.234 5.346 450 HD12 ILE 58 HD12 ILE 58 -18.332 -21.746 5.186 451 HD13 ILE 58 HD13 ILE 58 -17.869 -20.564 6.431 452 H GLN 59 H GLN 59 -14.746 -16.963 6.056 453 HA GLN 59 HA GLN 59 -15.750 -14.273 5.836 454 HB2 GLN 59 HB2 GLN 59 -13.558 -15.507 7.559 455 HB3 GLN 59 HB3 GLN 59 -14.159 -13.845 7.732 456 HG2 GLN 59 HG2 GLN 59 -16.461 -14.742 8.109 457 HG3 GLN 59 HG3 GLN 59 -15.810 -16.386 8.028 458 HE21 GLN 59 HE22 GLN 59 -15.173 -17.301 9.921 459 HE22 GLN 59 HE21 GLN 59 -14.825 -16.413 11.396 460 H MET 60 H MET 60 -13.450 -15.824 3.978 461 HA MET 60 HA MET 60 -12.019 -13.271 3.447 462 HB2 MET 60 HB2 MET 60 -11.217 -16.149 2.862 463 HB3 MET 60 HB3 MET 60 -10.241 -14.731 2.465 464 HG2 MET 60 HG2 MET 60 -11.078 -15.202 5.330 465 HG3 MET 60 HG3 MET 60 -9.783 -16.166 4.628 466 HE1 MET 60 HE1 MET 60 -11.038 -12.549 5.269 467 HE2 MET 60 HE2 MET 60 -9.552 -11.566 5.060 468 HE3 MET 60 HE3 MET 60 -10.321 -12.318 3.660 469 H CYS 61 H CYS 61 -14.107 -15.808 2.183 470 HA CYS 61 HA CYS 61 -13.655 -15.124 -0.584 471 HB2 CYS 61 HB2 CYS 61 -15.953 -16.554 0.853 472 HB3 CYS 61 HB3 CYS 61 -15.823 -16.424 -0.896 473 HG CYS 61 HG CYS 61 -13.575 -17.665 1.173 474 H GLN 62 H GLN 62 -16.203 -14.209 1.862 475 HA GLN 62 HA GLN 62 -17.600 -12.517 -0.007 476 HB2 GLN 62 HB2 GLN 62 -17.559 -12.497 3.041 477 HB3 GLN 62 HB3 GLN 62 -18.774 -11.704 2.003 478 HG2 GLN 62 HG2 GLN 62 -19.372 -13.948 1.058 479 HG3 GLN 62 HG3 GLN 62 -18.152 -14.695 2.090 480 HE21 GLN 62 HE22 GLN 62 -19.475 -15.963 3.230 481 HE22 GLN 62 HE21 GLN 62 -20.806 -15.398 4.181 482 H GLN 63 H GLN 63 -14.797 -11.989 2.129 483 HA GLN 63 HA GLN 63 -15.007 -9.087 1.937 484 HB2 GLN 63 HB2 GLN 63 -12.679 -10.906 2.719 485 HB3 GLN 63 HB3 GLN 63 -12.693 -9.132 2.849 486 HG2 GLN 63 HG2 GLN 63 -14.781 -9.356 4.272 487 HG3 GLN 63 HG3 GLN 63 -14.505 -11.099 4.306 488 HE21 GLN 63 HE22 GLN 63 -14.565 -10.091 6.735 489 HE22 GLN 63 HE21 GLN 63 -12.966 -9.853 7.415 490 H GLY 64 H GLY 64 -13.513 -11.690 0.062 491 HA2 GLY 64 HA2 GLY 64 -11.785 -9.943 -1.471 492 HA3 GLY 64 HA3 GLY 64 -12.217 -11.619 -1.842 493 H LEU 65 H LEU 65 -15.144 -11.098 -1.798 494 HA LEU 65 HA LEU 65 -15.507 -10.280 -4.525 495 HB2 LEU 65 HB2 LEU 65 -17.325 -10.865 -2.172 496 HB3 LEU 65 HB3 LEU 65 -17.984 -10.301 -3.709 497 HG LEU 65 HG LEU 65 -16.187 -12.762 -3.525 498 HD11 LEU 65 HD11 LEU 65 -19.232 -12.549 -3.560 499 HD12 LEU 65 HD12 LEU 65 -18.273 -14.048 -3.591 500 HD13 LEU 65 HD13 LEU 65 -18.254 -13.020 -2.152 501 HD21 LEU 65 HD21 LEU 65 -17.213 -13.271 -5.698 502 HD22 LEU 65 HD22 LEU 65 -18.125 -11.742 -5.639 503 HD23 LEU 65 HD23 LEU 65 -16.354 -11.729 -5.755 504 H ARG 66 H ARG 66 -15.012 -8.380 -1.712 505 HA ARG 66 HA ARG 66 -16.630 -6.095 -2.547 506 HB2 ARG 66 HB2 ARG 66 -14.277 -6.296 -0.620 507 HB3 ARG 66 HB3 ARG 66 -15.404 -4.941 -0.756 508 HG2 ARG 66 HG2 ARG 66 -17.266 -6.397 -0.034 509 HG3 ARG 66 HG3 ARG 66 -16.157 -7.774 0.069 510 HD2 ARG 66 HD2 ARG 66 -16.450 -6.850 2.291 511 HD3 ARG 66 HD3 ARG 66 -14.790 -6.555 1.741 512 HE ARG 66 HE ARG 66 -16.617 -4.351 1.160 513 HH11 ARG 66 HH11 ARG 66 -14.518 -5.778 3.615 514 HH12 ARG 66 HH12 ARG 66 -14.266 -4.266 4.453 515 HH21 ARG 66 HH21 ARG 66 -16.270 -2.395 2.260 516 HH22 ARG 66 HH22 ARG 66 -15.265 -2.349 3.682 517 H TYR 67 H TYR 67 -14.117 -7.510 -4.044 518 HA TYR 67 HA TYR 67 -12.780 -4.991 -4.887 519 HB2 TYR 67 HB2 TYR 67 -11.429 -7.553 -4.002 520 HB3 TYR 67 HB3 TYR 67 -10.607 -6.112 -4.578 521 HD1 TYR 67 HD2 TYR 67 -11.394 -3.859 -3.253 522 HD2 TYR 67 HD1 TYR 67 -11.498 -7.879 -1.731 523 HE1 TYR 67 HE2 TYR 67 -11.439 -2.977 -0.926 524 HE2 TYR 67 HE1 TYR 67 -11.543 -7.011 0.587 525 HH TYR 67 HH TYR 67 -11.538 -5.147 1.930 526 H THR 68 H THR 68 -14.786 -7.169 -5.962 527 HA THR 68 HA THR 68 -13.319 -7.685 -8.507 528 HB THR 68 HB THR 68 -14.873 -9.620 -8.780 529 HG1 THR 68 HG1 THR 68 -16.518 -8.927 -7.376 530 HG21 THR 68 HG21 THR 68 -13.743 -11.074 -7.165 531 HG22 THR 68 HG22 THR 68 -12.599 -9.888 -7.829 532 HG23 THR 68 HG23 THR 68 -13.271 -9.651 -6.199 533 H SER 69 H SER 69 -15.002 -5.354 -7.495 534 HA SER 69 HA SER 69 -17.494 -5.313 -8.869 535 HB2 SER 69 HB2 SER 69 -15.670 -3.051 -7.954 536 HB3 SER 69 HB3 SER 69 -17.384 -2.886 -8.378 537 HG SER 69 HG SER 69 -17.899 -4.301 -6.674 538 H THR 70 H THR 70 -14.730 -5.778 -10.474 539 HA THR 70 HA THR 70 -15.622 -4.204 -12.801 540 HB THR 70 HB THR 70 -14.144 -2.635 -11.779 541 HG1 THR 70 HG1 THR 70 -12.543 -2.511 -13.336 542 HG21 THR 70 HG21 THR 70 -11.789 -3.196 -11.208 543 HG22 THR 70 HG22 THR 70 -12.955 -4.073 -10.205 544 HG23 THR 70 HG23 THR 70 -12.139 -4.906 -11.554 545 H ALA 71 H ALA 71 -14.381 -4.756 -14.765 546 HA ALA 71 HA ALA 71 -14.454 -7.553 -15.180 547 HB1 ALA 71 HB1 ALA 71 -13.286 -5.290 -16.843 548 HB2 ALA 71 HB2 ALA 71 -13.671 -6.924 -17.443 549 HB3 ALA 71 HB3 ALA 71 -14.973 -5.851 -16.873 550 H GLU 72 H GLU 72 -11.907 -5.599 -13.884 551 HA GLU 72 HA GLU 72 -9.644 -7.011 -14.912 552 HB2 GLU 72 HB2 GLU 72 -10.023 -5.524 -12.310 553 HB3 GLU 72 HB3 GLU 72 -8.463 -6.030 -12.969 554 HG2 GLU 72 HG2 GLU 72 -10.420 -4.092 -14.275 555 HG3 GLU 72 HG3 GLU 72 -8.919 -3.656 -13.432 556 H HIS 73 H HIS 73 -12.144 -8.088 -12.897 557 HA HIS 73 HA HIS 73 -10.504 -10.365 -11.933 558 HB2 HIS 73 HB2 HIS 73 -12.467 -8.933 -10.119 559 HB3 HIS 73 HB3 HIS 73 -11.253 -10.138 -9.689 560 HD2 HIS 73 HD2 HIS 73 -11.829 -6.464 -9.827 561 HE1 HIS 73 HE1 HIS 73 -7.618 -6.861 -9.371 562 HE2 HIS 73 HE2 HIS 73 -9.575 -5.228 -9.303 563 H VAL 74 H VAL 74 -12.581 -9.917 -14.059 564 HA VAL 74 HA VAL 74 -15.158 -10.623 -13.312 565 HB VAL 74 HB VAL 74 -14.391 -9.791 -15.509 566 HG11 VAL 74 HG11 VAL 74 -13.573 -11.347 -17.212 567 HG12 VAL 74 HG12 VAL 74 -12.454 -11.294 -15.841 568 HG13 VAL 74 HG13 VAL 74 -13.561 -12.672 -16.027 569 HG21 VAL 74 HG21 VAL 74 -16.657 -10.750 -15.221 570 HG22 VAL 74 HG22 VAL 74 -16.016 -11.015 -16.853 571 HG23 VAL 74 HG23 VAL 74 -16.024 -12.353 -15.686 572 H ALA 75 H ALA 75 -12.350 -12.759 -13.599 573 HA ALA 75 HA ALA 75 -14.034 -15.169 -13.474 574 HB1 ALA 75 HB1 ALA 75 -11.853 -16.335 -13.429 575 HB2 ALA 75 HB2 ALA 75 -11.914 -15.151 -14.749 576 HB3 ALA 75 HB3 ALA 75 -11.018 -14.778 -13.264 577 H ILE 76 H ILE 76 -11.808 -13.347 -11.276 578 HA ILE 76 HA ILE 76 -12.069 -15.169 -9.085 579 HB ILE 76 HB ILE 76 -11.363 -12.209 -9.215 580 HG12 ILE 76 HG12 ILE 76 -9.641 -14.700 -8.884 581 HG13 ILE 76 HG13 ILE 76 -9.870 -13.812 -10.381 582 HG21 ILE 76 HG21 ILE 76 -11.136 -14.185 -6.915 583 HG22 ILE 76 HG22 ILE 76 -10.373 -12.583 -6.951 584 HG23 ILE 76 HG23 ILE 76 -12.131 -12.702 -6.974 585 HD11 ILE 76 HD11 ILE 76 -8.551 -12.729 -7.876 586 HD12 ILE 76 HD12 ILE 76 -7.776 -13.120 -9.418 587 HD13 ILE 76 HD13 ILE 76 -8.917 -11.769 -9.326 588 H ARG 77 H ARG 77 -14.102 -12.581 -10.324 589 HA ARG 77 HA ARG 77 -15.799 -12.092 -8.130 590 HB2 ARG 77 HB2 ARG 77 -15.707 -10.913 -10.356 591 HB3 ARG 77 HB3 ARG 77 -16.499 -12.316 -11.084 592 HG2 ARG 77 HG2 ARG 77 -18.446 -11.976 -9.559 593 HG3 ARG 77 HG3 ARG 77 -17.644 -10.535 -8.897 594 HD2 ARG 77 HD2 ARG 77 -17.593 -9.546 -11.164 595 HD3 ARG 77 HD3 ARG 77 -18.363 -11.001 -11.822 596 HE ARG 77 HE ARG 77 -19.637 -8.831 -10.314 597 HH11 ARG 77 HH11 ARG 77 -19.924 -12.161 -11.453 598 HH12 ARG 77 HH12 ARG 77 -21.666 -12.181 -11.315 599 HH21 ARG 77 HH21 ARG 77 -21.907 -8.883 -10.143 600 HH22 ARG 77 HH22 ARG 77 -22.784 -10.332 -10.582 601 H SER 78 H SER 78 -15.375 -14.925 -10.091 602 HA SER 78 HA SER 78 -17.848 -16.171 -8.981 603 HB2 SER 78 HB2 SER 78 -16.122 -16.892 -11.381 604 HB3 SER 78 HB3 SER 78 -17.532 -17.819 -10.808 605 HG SER 78 HG SER 78 -18.055 -16.322 -12.479 606 H LYS 79 H LYS 79 -14.344 -16.176 -8.704 607 HA LYS 79 HA LYS 79 -14.331 -18.941 -7.725 608 HB2 LYS 79 HB2 LYS 79 -12.111 -16.865 -7.936 609 HB3 LYS 79 HB3 LYS 79 -11.903 -18.533 -7.441 610 HG2 LYS 79 HG2 LYS 79 -12.664 -17.500 -10.178 611 HG3 LYS 79 HG3 LYS 79 -11.266 -18.471 -9.721 612 HD2 LYS 79 HD2 LYS 79 -14.182 -19.343 -9.811 613 HD3 LYS 79 HD3 LYS 79 -12.892 -19.875 -10.890 614 HE2 LYS 79 HE2 LYS 79 -12.776 -20.303 -7.884 615 HE3 LYS 79 HE3 LYS 79 -13.581 -21.455 -8.966 616 HZ1 LYS 79 HZ1 LYS 79 -11.297 -22.074 -8.565 617 HZ2 LYS 79 HZ2 LYS 79 -11.501 -21.695 -10.151 618 HZ3 LYS 79 HZ3 LYS 79 -10.747 -20.633 -9.141 619 H LEU 80 H LEU 80 -15.061 -15.891 -6.372 620 HA LEU 80 HA LEU 80 -14.376 -16.875 -3.660 621 HB2 LEU 80 HB2 LEU 80 -15.092 -14.121 -4.739 622 HB3 LEU 80 HB3 LEU 80 -14.669 -14.487 -3.051 623 HG LEU 80 HG LEU 80 -12.828 -14.938 -5.442 624 HD11 LEU 80 HD11 LEU 80 -13.305 -12.556 -5.133 625 HD12 LEU 80 HD12 LEU 80 -12.889 -12.700 -3.415 626 HD13 LEU 80 HD13 LEU 80 -11.634 -12.950 -4.661 627 HD21 LEU 80 HD21 LEU 80 -12.290 -16.379 -3.523 628 HD22 LEU 80 HD22 LEU 80 -11.075 -15.102 -3.720 629 HD23 LEU 80 HD23 LEU 80 -12.307 -14.963 -2.445 630 H GLN 81 H GLN 81 -16.653 -17.236 -5.885 631 HA GLN 81 HA GLN 81 -18.962 -17.059 -4.009 632 HB2 GLN 81 HB2 GLN 81 -18.568 -16.566 -6.944 633 HB3 GLN 81 HB3 GLN 81 -20.039 -17.390 -6.467 634 HG2 GLN 81 HG2 GLN 81 -19.133 -14.680 -5.432 635 HG3 GLN 81 HG3 GLN 81 -20.412 -14.979 -6.621 636 HE21 GLN 81 HE22 GLN 81 -21.786 -17.178 -5.508 637 HE22 GLN 81 HE21 GLN 81 -22.512 -16.658 -4.004 638 H TYR 82 H TYR 82 -17.290 -18.983 -6.579 639 HA TYR 82 HA TYR 82 -19.038 -21.212 -6.521 640 HB2 TYR 82 HB2 TYR 82 -17.395 -20.922 -8.312 641 HB3 TYR 82 HB3 TYR 82 -16.080 -20.820 -7.150 642 HD1 TYR 82 HD2 TYR 82 -18.599 -23.159 -8.606 643 HD2 TYR 82 HD1 TYR 82 -14.931 -22.731 -6.408 644 HE1 TYR 82 HE2 TYR 82 -18.209 -25.605 -8.792 645 HE2 TYR 82 HE1 TYR 82 -14.526 -25.177 -6.584 646 HH TYR 82 HH TYR 82 -15.303 -27.190 -7.366 647 H ARG 83 H ARG 83 -16.250 -20.403 -4.397 648 HA ARG 83 HA ARG 83 -16.597 -23.054 -3.152 649 HB2 ARG 83 HB2 ARG 83 -14.312 -21.997 -3.746 650 HB3 ARG 83 HB3 ARG 83 -14.568 -20.948 -2.340 651 HG2 ARG 83 HG2 ARG 83 -13.243 -22.875 -1.684 652 HG3 ARG 83 HG3 ARG 83 -14.834 -23.015 -0.919 653 HD2 ARG 83 HD2 ARG 83 -15.530 -24.566 -2.777 654 HD3 ARG 83 HD3 ARG 83 -13.890 -24.447 -3.442 655 HE ARG 83 HE ARG 83 -13.746 -25.256 -0.717 656 HH11 ARG 83 HH11 ARG 83 -14.786 -26.462 -3.866 657 HH12 ARG 83 HH12 ARG 83 -14.514 -28.134 -3.453 658 HH21 ARG 83 HH21 ARG 83 -13.423 -27.486 -0.192 659 HH22 ARG 83 HH22 ARG 83 -13.739 -28.702 -1.398 660 H LEU 84 H LEU 84 -17.396 -19.683 -2.603 661 HA LEU 84 HA LEU 84 -18.121 -19.938 0.164 662 HB2 LEU 84 HB2 LEU 84 -17.785 -17.804 -1.148 663 HB3 LEU 84 HB3 LEU 84 -19.237 -18.182 -2.073 664 HG LEU 84 HG LEU 84 -20.490 -18.223 0.179 665 HD11 LEU 84 HD11 LEU 84 -17.966 -16.811 1.072 666 HD12 LEU 84 HD12 LEU 84 -19.466 -17.035 1.993 667 HD13 LEU 84 HD13 LEU 84 -18.459 -18.438 1.581 668 HD21 LEU 84 HD21 LEU 84 -20.662 -15.768 0.248 669 HD22 LEU 84 HD22 LEU 84 -19.173 -15.636 -0.725 670 HD23 LEU 84 HD23 LEU 84 -20.636 -16.348 -1.431 671 H GLU 85 H GLU 85 -19.561 -20.698 -2.958 672 HA GLU 85 HA GLU 85 -22.233 -21.350 -2.072 673 HB2 GLU 85 HB2 GLU 85 -20.565 -21.566 -4.586 674 HB3 GLU 85 HB3 GLU 85 -22.051 -22.471 -4.514 675 HG2 GLU 85 HG2 GLU 85 -23.353 -20.454 -4.021 676 HG3 GLU 85 HG3 GLU 85 -21.875 -19.490 -3.914 677 H LEU 86 H LEU 86 -19.365 -22.905 -1.404 678 HA LEU 86 HA LEU 86 -20.774 -25.526 -1.188 679 HB2 LEU 86 HB2 LEU 86 -17.913 -25.007 -2.072 680 HB3 LEU 86 HB3 LEU 86 -18.549 -26.605 -1.663 681 HG LEU 86 HG LEU 86 -19.646 -24.842 -3.896 682 HD11 LEU 86 HD11 LEU 86 -17.801 -27.263 -3.985 683 HD12 LEU 86 HD12 LEU 86 -18.498 -26.428 -5.391 684 HD13 LEU 86 HD13 LEU 86 -17.341 -25.583 -4.343 685 HD21 LEU 86 HD21 LEU 86 -21.303 -26.450 -2.999 686 HD22 LEU 86 HD22 LEU 86 -20.754 -26.950 -4.600 687 HD23 LEU 86 HD23 LEU 86 -20.121 -27.766 -3.151 688 H ALA 87 H ALA 87 -18.671 -23.081 0.234 689 HA ALA 87 HA ALA 87 -17.723 -24.657 2.421 690 HB1 ALA 87 HB1 ALA 87 -18.257 -21.658 2.199 691 HB2 ALA 87 HB2 ALA 87 -17.229 -22.456 3.416 692 HB3 ALA 87 HB3 ALA 87 -16.753 -22.480 1.707 693 H GLN 88 H GLN 88 -20.727 -22.890 1.754 694 HA GLN 88 HA GLN 88 -21.755 -22.951 4.438 695 HB2 GLN 88 HB2 GLN 88 -23.016 -22.545 1.699 696 HB3 GLN 88 HB3 GLN 88 -23.880 -22.327 3.233 697 HG2 GLN 88 HG2 GLN 88 -22.262 -20.616 3.937 698 HG3 GLN 88 HG3 GLN 88 -21.370 -20.808 2.427 699 HE21 GLN 88 HE22 GLN 88 -22.365 -18.318 3.213 700 HE22 GLN 88 HE21 GLN 88 -23.657 -17.848 2.130 701 H GLY 89 H GLY 89 -20.958 -25.519 2.656 702 HA2 GLY 89 HA2 GLY 89 -23.162 -27.189 3.735 703 HA3 GLY 89 HA3 GLY 89 -22.686 -27.331 2.028 704 H ALA 90 H ALA 90 -20.049 -26.506 4.060 705 HA ALA 90 HA ALA 90 -19.349 -29.318 4.650 706 HB1 ALA 90 HB1 ALA 90 -17.598 -27.463 2.984 707 HB2 ALA 90 HB2 ALA 90 -17.158 -29.098 3.545 708 HB3 ALA 90 HB3 ALA 90 -18.483 -28.890 2.374 709 H VAL 91 H VAL 91 -19.363 -26.001 5.503 710 HA VAL 91 HA VAL 91 -17.066 -25.960 7.223 711 HB VAL 91 HB VAL 91 -18.313 -23.987 6.379 712 HG11 VAL 91 HG11 VAL 91 -20.420 -24.753 8.440 713 HG12 VAL 91 HG12 VAL 91 -20.387 -23.263 7.474 714 HG13 VAL 91 HG13 VAL 91 -20.630 -24.824 6.678 715 HG21 VAL 91 HG21 VAL 91 -18.129 -22.649 8.401 716 HG22 VAL 91 HG22 VAL 91 -18.205 -24.106 9.412 717 HG23 VAL 91 HG23 VAL 91 -16.814 -23.838 8.340 718 H GLY 92 H GLY 92 -20.127 -27.466 7.387 719 HA2 GLY 92 HA2 GLY 92 -19.444 -28.738 9.944 720 HA3 GLY 92 HA3 GLY 92 -20.954 -27.802 9.923 721 H SER 93 H SER 93 -20.482 -28.904 6.825 722 HA SER 93 HA SER 93 -21.726 -30.271 5.513 723 HB2 SER 93 HB2 SER 93 -20.659 -32.247 7.537 724 HB3 SER 93 HB3 SER 93 -21.239 -32.637 5.895 725 HG SER 93 HG SER 93 -18.962 -32.374 5.981 726 H VAL 94 H VAL 94 -23.077 -32.672 6.008 727 HA VAL 94 HA VAL 94 -25.325 -31.840 7.746 728 HB VAL 94 HB VAL 94 -25.769 -33.076 5.033 729 HG11 VAL 94 HG11 VAL 94 -27.624 -33.212 6.690 730 HG12 VAL 94 HG12 VAL 94 -27.509 -31.460 6.950 731 HG13 VAL 94 HG13 VAL 94 -28.038 -32.095 5.377 732 HG21 VAL 94 HG21 VAL 94 -25.729 -30.131 5.786 733 HG22 VAL 94 HG22 VAL 94 -24.639 -30.934 4.637 734 HG23 VAL 94 HG23 VAL 94 -26.368 -30.782 4.259 735 H GLN 95 H GLN 95 -23.181 -33.533 8.303 736 HA GLN 95 HA GLN 95 -23.982 -36.306 8.157 737 HB2 GLN 95 HB2 GLN 95 -21.840 -34.798 9.657 738 HB3 GLN 95 HB3 GLN 95 -21.910 -36.532 9.490 739 HG2 GLN 95 HG2 GLN 95 -21.463 -34.501 7.293 740 HG3 GLN 95 HG3 GLN 95 -20.264 -35.616 7.958 741 HE21 GLN 95 HE21 GLN 95 -23.377 -35.438 6.212 742 HE22 GLN 95 HE22 GLN 95 -23.193 -36.959 5.391 743 H ILE 96 H ILE 96 -26.061 -34.807 9.317 744 HA ILE 96 HA ILE 96 -25.821 -35.407 12.224 745 HB ILE 96 HB ILE 96 -27.231 -33.416 12.611 746 HG12 ILE 96 HG12 ILE 96 -26.700 -32.862 9.656 747 HG13 ILE 96 HG13 ILE 96 -28.267 -33.296 10.360 748 HG21 ILE 96 HG21 ILE 96 -24.643 -32.858 11.097 749 HG22 ILE 96 HG22 ILE 96 -25.384 -31.827 12.337 750 HG23 ILE 96 HG23 ILE 96 -24.740 -33.413 12.787 751 HD11 ILE 96 HD11 ILE 96 -26.676 -30.775 10.962 752 HD12 ILE 96 HD12 ILE 96 -28.193 -30.900 10.050 753 HD13 ILE 96 HD13 ILE 96 -28.180 -31.253 11.789 754 HA PRO 97 HA PRO 97 -30.347 -36.551 10.693 755 HB2 PRO 97 HB2 PRO 97 -29.170 -38.384 8.616 756 HB3 PRO 97 HB3 PRO 97 -30.786 -37.602 8.644 757 HG2 PRO 97 HG2 PRO 97 -28.829 -36.611 7.068 758 HG3 PRO 97 HG3 PRO 97 -29.844 -35.491 8.036 759 HD2 PRO 97 HD2 PRO 97 -27.077 -36.533 8.663 760 HD3 PRO 97 HD3 PRO 97 -27.716 -34.859 8.790 761 H VAL 98 H VAL 98 -31.230 -38.773 11.086 762 HA VAL 98 HA VAL 98 -29.238 -40.627 12.277 763 HB VAL 98 HB VAL 98 -30.663 -40.904 14.278 764 HG11 VAL 98 HG11 VAL 98 -29.766 -38.027 13.837 765 HG12 VAL 98 HG12 VAL 98 -30.023 -38.832 15.399 766 HG13 VAL 98 HG13 VAL 98 -28.715 -39.378 14.330 767 HG21 VAL 98 HG21 VAL 98 -32.810 -40.104 13.318 768 HG22 VAL 98 HG22 VAL 98 -32.386 -39.237 14.808 769 HG23 VAL 98 HG23 VAL 98 -32.148 -38.451 13.234 770 H VAL 99 H VAL 99 -32.014 -40.082 10.419 771 HA VAL 99 HA VAL 99 -33.693 -41.368 9.602 772 HB VAL 99 HB VAL 99 -32.820 -43.159 8.170 773 HG11 VAL 99 HG11 VAL 99 -31.010 -40.722 8.337 774 HG12 VAL 99 HG12 VAL 99 -31.257 -41.762 6.909 775 HG13 VAL 99 HG13 VAL 99 -32.598 -40.783 7.540 776 HG21 VAL 99 HG21 VAL 99 -30.149 -42.691 9.556 777 HG22 VAL 99 HG22 VAL 99 -31.155 -44.143 9.768 778 HG23 VAL 99 HG23 VAL 99 -30.465 -43.762 8.177 779 H GLU 100 H GLU 100 -33.526 -41.851 12.456 780 HA GLU 100 HA GLU 100 -33.603 -44.532 13.181 781 HB2 GLU 100 HB2 GLU 100 -33.842 -42.078 14.386 782 HB3 GLU 100 HB3 GLU 100 -35.498 -42.696 14.550 783 HG2 GLU 100 HG2 GLU 100 -34.551 -44.801 15.519 784 HG3 GLU 100 HG3 GLU 100 -32.926 -44.109 15.318 785 H VAL 101 H VAL 101 -35.599 -45.673 14.055 786 HA VAL 101 HA VAL 101 -37.968 -45.352 12.336 787 HB VAL 101 HB VAL 101 -36.232 -46.856 11.317 788 HG11 VAL 101 HG11 VAL 101 -35.918 -49.103 12.233 789 HG12 VAL 101 HG12 VAL 101 -35.375 -47.877 13.391 790 HG13 VAL 101 HG13 VAL 101 -36.930 -48.698 13.636 791 HG21 VAL 101 HG21 VAL 101 -38.675 -47.035 10.788 792 HG22 VAL 101 HG22 VAL 101 -37.807 -48.577 10.636 793 HG23 VAL 101 HG23 VAL 101 -38.821 -48.277 12.053 794 H ASP 102 H ASP 102 -39.774 -46.800 13.111 795 HA ASP 102 HA ASP 102 -39.633 -47.558 15.965 796 HB2 ASP 102 HB2 ASP 102 -41.584 -45.568 14.739 797 HB3 ASP 102 HB3 ASP 102 -41.768 -46.301 16.338 798 H GLU 103 H GLU 103 -41.924 -48.475 16.562 799 HA GLU 103 HA GLU 103 -43.022 -50.042 14.286 800 HB2 GLU 103 HB2 GLU 103 -42.508 -51.177 17.049 801 HB3 GLU 103 HB3 GLU 103 -42.987 -52.032 15.576 802 HG2 GLU 103 HG2 GLU 103 -40.783 -51.255 14.551 803 HG3 GLU 103 HG3 GLU 103 -40.307 -50.710 16.167 804 H LEU 104 H LEU 104 -44.976 -51.396 15.420 805 HA LEU 104 HA LEU 104 -47.010 -49.450 15.879 806 HB2 LEU 104 HB2 LEU 104 -47.004 -52.439 16.377 807 HB3 LEU 104 HB3 LEU 104 -48.425 -51.447 16.367 808 HG LEU 104 HG LEU 104 -48.362 -52.600 14.317 809 HD11 LEU 104 HD11 LEU 104 -47.494 -49.731 13.798 810 HD12 LEU 104 HD12 LEU 104 -48.456 -50.768 12.724 811 HD13 LEU 104 HD13 LEU 104 -49.133 -50.244 14.270 812 HD21 LEU 104 HD21 LEU 104 -45.688 -51.354 13.609 813 HD22 LEU 104 HD22 LEU 104 -45.888 -53.028 14.212 814 HD23 LEU 104 HD23 LEU 104 -46.630 -52.523 12.679 815 HA PRO 105 HA PRO 105 -46.831 -48.990 20.240 816 HB2 PRO 105 HB2 PRO 105 -49.330 -48.123 20.830 817 HB3 PRO 105 HB3 PRO 105 -48.311 -47.237 19.655 818 HG2 PRO 105 HG2 PRO 105 -50.520 -49.221 19.085 819 HG3 PRO 105 HG3 PRO 105 -50.218 -47.634 18.310 820 HD2 PRO 105 HD2 PRO 105 -49.399 -50.106 17.345 821 HD3 PRO 105 HD3 PRO 105 -48.596 -48.595 16.872 822 H GLU 106 H GLU 106 -47.613 -51.804 19.164 823 HA GLU 106 HA GLU 106 -48.292 -53.799 20.005 824 HB2 GLU 106 HB2 GLU 106 -47.659 -52.396 22.630 825 HB3 GLU 106 HB3 GLU 106 -47.912 -54.143 22.450 826 HG2 GLU 106 HG2 GLU 106 -46.044 -54.236 20.823 827 HG3 GLU 106 HG3 GLU 106 -45.765 -52.502 21.043 828 H GLY 107 H GLY 107 -50.330 -51.644 19.582 829 HA2 GLY 107 HA2 GLY 107 -52.573 -53.052 20.832 830 HA3 GLY 107 HA3 GLY 107 -52.378 -51.339 21.269 831 H TYR 108 H TYR 108 -51.285 -52.220 18.099 832 HA TYR 108 HA TYR 108 -53.151 -50.499 16.802 833 HB2 TYR 108 HB2 TYR 108 -52.064 -51.069 14.792 834 HB3 TYR 108 HB3 TYR 108 -50.847 -50.921 16.051 835 HD1 TYR 108 HD2 TYR 108 -50.211 -53.258 17.244 836 HD2 TYR 108 HD1 TYR 108 -51.964 -52.828 13.354 837 HE1 TYR 108 HE2 TYR 108 -49.339 -55.495 16.610 838 HE2 TYR 108 HE1 TYR 108 -51.095 -55.063 12.699 839 HH TYR 108 HH TYR 108 -49.870 -56.900 13.342 840 H ASP 109 H ASP 109 -54.101 -51.592 14.546 841 HA ASP 109 HA ASP 109 -55.998 -53.669 15.528 842 HB2 ASP 109 HB2 ASP 109 -56.667 -51.102 14.081 843 HB3 ASP 109 HB3 ASP 109 -57.818 -52.376 14.490 844 H ARG 110 H ARG 110 -53.660 -53.991 13.762 845 HA ARG 110 HA ARG 110 -55.124 -55.013 11.388 846 HB2 ARG 110 HB2 ARG 110 -52.414 -53.641 11.350 847 HB3 ARG 110 HB3 ARG 110 -53.213 -54.417 9.968 848 HG2 ARG 110 HG2 ARG 110 -55.129 -52.845 10.209 849 HG3 ARG 110 HG3 ARG 110 -54.258 -52.007 11.509 850 HD2 ARG 110 HD2 ARG 110 -53.241 -52.380 8.663 851 HD3 ARG 110 HD3 ARG 110 -54.003 -50.898 9.292 852 HE ARG 110 HE ARG 110 -51.892 -51.458 11.033 853 HH11 ARG 110 HH11 ARG 110 -52.261 -50.762 7.591 854 HH12 ARG 110 HH12 ARG 110 -50.675 -50.028 7.454 855 HH21 ARG 110 HH21 ARG 110 -49.847 -50.487 10.831 856 HH22 ARG 110 HH22 ARG 110 -49.327 -49.855 9.288 857 H SER 111 H SER 111 -53.868 -56.044 14.071 858 HA SER 111 HA SER 111 -51.818 -57.891 13.377 859 HB2 SER 111 HB2 SER 111 -52.457 -58.994 15.503 860 HB3 SER 111 HB3 SER 111 -52.238 -57.236 15.675 861 HG SER 111 HG SER 111 -54.163 -58.005 16.678 Start of MODEL 20 1 H1 SER 2 H1 SER 2 10.324 -7.371 0.427 2 H2 SER 2 H2 SER 2 11.016 -7.896 -0.969 3 H3 SER 2 H3 SER 2 11.087 -8.827 0.386 4 HA SER 2 HA SER 2 9.477 -9.696 -1.144 5 HB2 SER 2 HB2 SER 2 8.252 -8.472 1.353 6 HB3 SER 2 HB3 SER 2 7.599 -9.842 0.428 7 HG SER 2 HG SER 2 8.857 -10.510 2.243 8 H GLN 3 H GLN 3 7.301 -9.444 -2.068 9 HA GLN 3 HA GLN 3 6.253 -6.719 -2.339 10 HB2 GLN 3 HB2 GLN 3 8.077 -6.862 -4.037 11 HB3 GLN 3 HB3 GLN 3 7.311 -8.299 -4.730 12 HG2 GLN 3 HG2 GLN 3 6.811 -6.278 -6.045 13 HG3 GLN 3 HG3 GLN 3 5.339 -6.965 -5.369 14 HE21 GLN 3 HE22 GLN 3 7.583 -4.238 -5.304 15 HE22 GLN 3 HE21 GLN 3 6.615 -3.211 -4.276 16 H PHE 4 H PHE 4 4.153 -6.698 -3.377 17 HA PHE 4 HA PHE 4 2.423 -8.647 -2.383 18 HB2 PHE 4 HB2 PHE 4 1.926 -6.309 -3.061 19 HB3 PHE 4 HB3 PHE 4 2.044 -6.763 -4.745 20 HD1 PHE 4 HD2 PHE 4 0.433 -8.758 -5.505 21 HD2 PHE 4 HD1 PHE 4 -0.163 -6.287 -2.042 22 HE1 PHE 4 HE2 PHE 4 -1.962 -9.404 -5.455 23 HE2 PHE 4 HE1 PHE 4 -2.572 -6.867 -2.034 24 HZ PHE 4 HZ PHE 4 -3.473 -8.441 -3.739 25 H GLU 5 H GLU 5 3.924 -8.438 -5.616 26 HA GLU 5 HA GLU 5 2.316 -10.755 -6.528 27 HB2 GLU 5 HB2 GLU 5 4.158 -8.814 -7.973 28 HB3 GLU 5 HB3 GLU 5 3.322 -10.184 -8.747 29 HG2 GLU 5 HG2 GLU 5 1.138 -9.290 -7.982 30 HG3 GLU 5 HG3 GLU 5 1.964 -7.894 -7.272 31 H LYS 6 H LYS 6 5.045 -10.582 -4.735 32 HA LYS 6 HA LYS 6 6.378 -12.835 -6.204 33 HB2 LYS 6 HB2 LYS 6 7.376 -10.564 -4.479 34 HB3 LYS 6 HB3 LYS 6 8.217 -12.116 -4.440 35 HG2 LYS 6 HG2 LYS 6 9.270 -10.630 -6.030 36 HG3 LYS 6 HG3 LYS 6 8.595 -12.040 -6.852 37 HD2 LYS 6 HD2 LYS 6 6.677 -10.732 -7.601 38 HD3 LYS 6 HD3 LYS 6 7.248 -9.305 -6.724 39 HE2 LYS 6 HE2 LYS 6 8.711 -10.723 -8.995 40 HE3 LYS 6 HE3 LYS 6 7.764 -9.238 -9.164 41 HZ1 LYS 6 HZ1 LYS 6 10.171 -9.544 -7.496 42 HZ2 LYS 6 HZ2 LYS 6 10.088 -8.765 -8.942 43 HZ3 LYS 6 HZ3 LYS 6 9.282 -8.171 -7.639 44 H GLN 7 H GLN 7 5.750 -11.614 -2.836 45 HA GLN 7 HA GLN 7 6.315 -14.095 -1.602 46 HB2 GLN 7 HB2 GLN 7 5.559 -11.519 -0.799 47 HB3 GLN 7 HB3 GLN 7 4.190 -12.506 -0.308 48 HG2 GLN 7 HG2 GLN 7 7.114 -13.005 0.401 49 HG3 GLN 7 HG3 GLN 7 5.861 -12.390 1.490 50 HE21 GLN 7 HE22 GLN 7 3.747 -13.917 1.415 51 HE22 GLN 7 HE21 GLN 7 4.107 -15.616 1.618 52 H LYS 8 H LYS 8 3.403 -12.814 -3.097 53 HA LYS 8 HA LYS 8 1.495 -14.697 -2.102 54 HB2 LYS 8 HB2 LYS 8 1.091 -12.413 -2.962 55 HB3 LYS 8 HB3 LYS 8 1.603 -12.946 -4.533 56 HG2 LYS 8 HG2 LYS 8 -0.386 -14.682 -4.263 57 HG3 LYS 8 HG3 LYS 8 -0.947 -13.585 -3.034 58 HD2 LYS 8 HD2 LYS 8 -1.971 -13.024 -5.169 59 HD3 LYS 8 HD3 LYS 8 -0.874 -11.723 -4.710 60 HE2 LYS 8 HE2 LYS 8 0.823 -12.474 -6.230 61 HE3 LYS 8 HE3 LYS 8 0.028 -14.037 -6.470 62 HZ1 LYS 8 HZ1 LYS 8 -0.318 -12.535 -8.330 63 HZ2 LYS 8 HZ2 LYS 8 -1.755 -12.865 -7.601 64 HZ3 LYS 8 HZ3 LYS 8 -1.021 -11.412 -7.352 65 H GLU 9 H GLU 9 3.932 -14.960 -4.633 66 HA GLU 9 HA GLU 9 2.511 -17.297 -5.810 67 HB2 GLU 9 HB2 GLU 9 2.971 -15.465 -7.349 68 HB3 GLU 9 HB3 GLU 9 4.679 -15.436 -6.864 69 HG2 GLU 9 HG2 GLU 9 5.003 -17.673 -7.743 70 HG3 GLU 9 HG3 GLU 9 3.275 -17.812 -8.119 71 H GLN 10 H GLN 10 5.366 -16.260 -4.013 72 HA GLN 10 HA GLN 10 6.984 -18.565 -4.560 73 HB2 GLN 10 HB2 GLN 10 6.935 -16.456 -2.384 74 HB3 GLN 10 HB3 GLN 10 8.121 -17.773 -2.380 75 HG2 GLN 10 HG2 GLN 10 8.940 -17.130 -4.583 76 HG3 GLN 10 HG3 GLN 10 7.716 -15.880 -4.733 77 HE21 GLN 10 HE22 GLN 10 10.123 -14.917 -5.140 78 HE22 GLN 10 HE21 GLN 10 10.762 -14.084 -3.739 79 H GLY 11 H GLY 11 4.002 -18.587 -3.188 80 HA2 GLY 11 HA2 GLY 11 4.687 -20.978 -1.540 81 HA3 GLY 11 HA3 GLY 11 3.485 -19.808 -1.016 82 H ASN 12 H ASN 12 3.227 -19.951 -4.380 83 HA ASN 12 HA ASN 12 0.744 -21.366 -4.260 84 HB2 ASN 12 HB2 ASN 12 0.537 -20.819 -6.461 85 HB3 ASN 12 HB3 ASN 12 1.808 -19.673 -6.049 86 HD21 ASN 12 HD22 ASN 12 4.000 -20.208 -6.682 87 HD22 ASN 12 HD21 ASN 12 4.265 -21.306 -8.017 88 H SER 13 H SER 13 4.068 -22.362 -4.717 89 HA SER 13 HA SER 13 3.378 -25.026 -5.690 90 HB2 SER 13 HB2 SER 13 5.960 -23.949 -4.478 91 HB3 SER 13 HB3 SER 13 5.786 -25.490 -5.343 92 HG SER 13 HG SER 13 5.197 -24.323 -7.198 93 H LEU 14 H LEU 14 4.123 -23.508 -2.528 94 HA LEU 14 HA LEU 14 4.305 -25.904 -1.002 95 HB2 LEU 14 HB2 LEU 14 3.699 -22.988 -0.474 96 HB3 LEU 14 HB3 LEU 14 3.480 -24.167 0.802 97 HG LEU 14 HG LEU 14 5.808 -24.878 0.648 98 HD11 LEU 14 HD11 LEU 14 7.429 -23.574 -0.710 99 HD12 LEU 14 HD12 LEU 14 6.292 -24.476 -1.724 100 HD13 LEU 14 HD13 LEU 14 6.080 -22.721 -1.493 101 HD21 LEU 14 HD21 LEU 14 5.158 -23.012 2.124 102 HD22 LEU 14 HD22 LEU 14 6.815 -22.803 1.513 103 HD23 LEU 14 HD23 LEU 14 5.477 -21.860 0.806 104 H PHE 15 H PHE 15 1.571 -23.948 -2.159 105 HA PHE 15 HA PHE 15 -0.495 -25.193 -0.633 106 HB2 PHE 15 HB2 PHE 15 -0.815 -23.103 -1.862 107 HB3 PHE 15 HB3 PHE 15 -0.368 -23.882 -3.366 108 HD1 PHE 15 HD1 PHE 15 -2.828 -24.600 -0.617 109 HD2 PHE 15 HD2 PHE 15 -2.049 -24.244 -4.822 110 HE1 PHE 15 HE1 PHE 15 -5.199 -25.168 -1.080 111 HE2 PHE 15 HE2 PHE 15 -4.450 -24.724 -5.304 112 HZ PHE 15 HZ PHE 15 -6.012 -25.177 -3.455 113 H LYS 16 H LYS 16 1.463 -26.360 -3.217 114 HA LYS 16 HA LYS 16 -0.492 -28.492 -3.878 115 HB2 LYS 16 HB2 LYS 16 1.863 -27.431 -5.466 116 HB3 LYS 16 HB3 LYS 16 0.696 -28.650 -6.023 117 HG2 LYS 16 HG2 LYS 16 -1.124 -27.037 -5.920 118 HG3 LYS 16 HG3 LYS 16 -0.087 -25.835 -5.137 119 HD2 LYS 16 HD2 LYS 16 1.381 -25.827 -7.171 120 HD3 LYS 16 HD3 LYS 16 0.148 -26.831 -7.981 121 HE2 LYS 16 HE2 LYS 16 -1.564 -25.078 -7.399 122 HE3 LYS 16 HE3 LYS 16 -0.257 -24.083 -6.723 123 HZ1 LYS 16 HZ1 LYS 16 0.772 -24.034 -8.875 124 HZ2 LYS 16 HZ2 LYS 16 -0.410 -24.974 -9.526 125 HZ3 LYS 16 HZ3 LYS 16 -0.767 -23.460 -8.980 126 H GLN 17 H GLN 17 2.350 -27.945 -2.097 127 HA GLN 17 HA GLN 17 3.592 -30.546 -2.541 128 HB2 GLN 17 HB2 GLN 17 4.009 -28.422 -0.436 129 HB3 GLN 17 HB3 GLN 17 4.897 -29.956 -0.514 130 HG2 GLN 17 HG2 GLN 17 5.471 -29.359 -2.944 131 HG3 GLN 17 HG3 GLN 17 4.901 -27.737 -2.555 132 HE21 GLN 17 HE22 GLN 17 5.731 -27.280 -0.012 133 HE22 GLN 17 HE21 GLN 17 7.472 -27.362 0.079 134 H GLY 18 H GLY 18 0.910 -29.402 -0.592 135 HA2 GLY 18 HA2 GLY 18 -0.579 -30.927 0.444 136 HA3 GLY 18 HA3 GLY 18 0.717 -32.114 0.611 137 H LEU 19 H LEU 19 1.326 -28.762 1.485 138 HA LEU 19 HA LEU 19 0.961 -29.353 4.364 139 HB2 LEU 19 HB2 LEU 19 3.140 -28.122 4.755 140 HB3 LEU 19 HB3 LEU 19 3.211 -29.787 4.179 141 HG LEU 19 HG LEU 19 3.667 -29.001 1.885 142 HD11 LEU 19 HD11 LEU 19 3.819 -26.249 3.183 143 HD12 LEU 19 HD12 LEU 19 4.319 -26.649 1.527 144 HD13 LEU 19 HD13 LEU 19 2.616 -26.776 1.988 145 HD21 LEU 19 HD21 LEU 19 5.475 -29.558 3.472 146 HD22 LEU 19 HD22 LEU 19 5.965 -28.267 2.351 147 HD23 LEU 19 HD23 LEU 19 5.503 -27.866 4.026 148 H TYR 20 H TYR 20 -0.956 -28.205 3.123 149 HA TYR 20 HA TYR 20 -0.943 -25.676 2.144 150 HB2 TYR 20 HB2 TYR 20 -3.144 -26.777 3.878 151 HB3 TYR 20 HB3 TYR 20 -3.306 -25.668 2.528 152 HD1 TYR 20 HD2 TYR 20 -2.817 -26.554 0.185 153 HD2 TYR 20 HD1 TYR 20 -3.203 -29.128 3.605 154 HE1 TYR 20 HE2 TYR 20 -3.302 -28.463 -1.316 155 HE2 TYR 20 HE1 TYR 20 -3.654 -31.048 2.126 156 HH TYR 20 HH TYR 20 -3.877 -31.778 -0.034 157 H ARG 21 H ARG 21 -0.555 -26.419 5.577 158 HA ARG 21 HA ARG 21 -1.706 -24.088 6.697 159 HB2 ARG 21 HB2 ARG 21 -0.940 -26.120 7.892 160 HB3 ARG 21 HB3 ARG 21 0.738 -25.686 7.588 161 HG2 ARG 21 HG2 ARG 21 -1.133 -23.787 9.053 162 HG3 ARG 21 HG3 ARG 21 -0.294 -25.111 9.886 163 HD2 ARG 21 HD2 ARG 21 1.875 -24.254 9.044 164 HD3 ARG 21 HD3 ARG 21 1.037 -22.858 8.353 165 HE ARG 21 HE ARG 21 0.275 -22.941 11.036 166 HH11 ARG 21 HH11 ARG 21 3.283 -22.608 9.191 167 HH12 ARG 21 HH12 ARG 21 4.042 -21.601 10.408 168 HH21 ARG 21 HH21 ARG 21 1.305 -21.625 12.602 169 HH22 ARG 21 HH22 ARG 21 2.931 -21.049 12.320 170 H GLU 22 H GLU 22 1.529 -24.625 5.279 171 HA GLU 22 HA GLU 22 2.529 -21.987 5.886 172 HB2 GLU 22 HB2 GLU 22 3.260 -23.844 3.585 173 HB3 GLU 22 HB3 GLU 22 4.284 -22.590 4.292 174 HG2 GLU 22 HG2 GLU 22 3.277 -25.065 5.774 175 HG3 GLU 22 HG3 GLU 22 4.818 -24.922 4.957 176 H ALA 23 H ALA 23 0.769 -23.521 3.290 177 HA ALA 23 HA ALA 23 0.935 -21.381 1.388 178 HB1 ALA 23 HB1 ALA 23 -0.586 -22.728 0.102 179 HB2 ALA 23 HB2 ALA 23 0.657 -23.776 0.830 180 HB3 ALA 23 HB3 ALA 23 -0.998 -23.715 1.517 181 H VAL 24 H VAL 24 -0.864 -21.491 4.261 182 HA VAL 24 HA VAL 24 -3.105 -19.827 3.216 183 HB VAL 24 HB VAL 24 -2.077 -20.574 5.998 184 HG11 VAL 24 HG11 VAL 24 -4.642 -19.116 5.164 185 HG12 VAL 24 HG12 VAL 24 -4.284 -19.685 6.814 186 HG13 VAL 24 HG13 VAL 24 -3.284 -18.423 6.078 187 HG21 VAL 24 HG21 VAL 24 -3.097 -22.496 4.787 188 HG22 VAL 24 HG22 VAL 24 -4.154 -21.986 6.110 189 HG23 VAL 24 HG23 VAL 24 -4.540 -21.536 4.434 190 H HIS 25 H HIS 25 -0.226 -19.842 5.118 191 HA HIS 25 HA HIS 25 -0.024 -17.126 5.923 192 HB2 HIS 25 HB2 HIS 25 1.223 -19.768 6.180 193 HB3 HIS 25 HB3 HIS 25 2.405 -18.541 6.032 194 HD2 HIS 25 HD2 HIS 25 2.626 -16.807 8.143 195 HE1 HIS 25 HE1 HIS 25 -0.210 -18.743 10.664 196 HE2 HIS 25 HE2 HIS 25 1.609 -16.946 10.554 197 H CYS 26 H CYS 26 0.118 -18.175 2.861 198 HA CYS 26 HA CYS 26 2.388 -16.401 2.112 199 HB2 CYS 26 HB2 CYS 26 2.807 -17.803 0.262 200 HB3 CYS 26 HB3 CYS 26 2.655 -18.870 1.689 201 HG CYS 26 HG CYS 26 0.367 -18.085 -0.575 202 H TYR 27 H TYR 27 -0.841 -16.725 2.135 203 HA TYR 27 HA TYR 27 -1.163 -14.784 -0.125 204 HB2 TYR 27 HB2 TYR 27 -3.347 -16.583 0.935 205 HB3 TYR 27 HB3 TYR 27 -3.402 -15.549 -0.498 206 HD1 TYR 27 HD2 TYR 27 -1.015 -16.169 -2.007 207 HD2 TYR 27 HD1 TYR 27 -3.532 -18.771 0.306 208 HE1 TYR 27 HE2 TYR 27 -0.355 -18.102 -3.441 209 HE2 TYR 27 HE1 TYR 27 -2.885 -20.691 -1.123 210 HH TYR 27 HH TYR 27 -1.670 -21.385 -2.915 211 H ASP 28 H ASP 28 -0.897 -14.739 3.119 212 HA ASP 28 HA ASP 28 -3.355 -13.253 3.759 213 HB2 ASP 28 HB2 ASP 28 -2.168 -14.946 5.251 214 HB3 ASP 28 HB3 ASP 28 -0.880 -13.762 5.464 215 H GLN 29 H GLN 29 0.004 -12.549 2.954 216 HA GLN 29 HA GLN 29 0.365 -10.019 4.115 217 HB2 GLN 29 HB2 GLN 29 1.300 -10.326 1.332 218 HB3 GLN 29 HB3 GLN 29 2.099 -9.684 2.761 219 HG2 GLN 29 HG2 GLN 29 3.180 -11.615 2.276 220 HG3 GLN 29 HG3 GLN 29 2.161 -12.125 3.610 221 HE21 GLN 29 HE22 GLN 29 2.164 -11.935 -0.058 222 HE22 GLN 29 HE21 GLN 29 1.302 -13.427 -0.294 223 H LEU 30 H LEU 30 -1.226 -11.030 1.180 224 HA LEU 30 HA LEU 30 -1.533 -8.500 -0.088 225 HB2 LEU 30 HB2 LEU 30 -3.086 -11.071 -0.521 226 HB3 LEU 30 HB3 LEU 30 -2.933 -9.729 -1.658 227 HG LEU 30 HG LEU 30 -1.431 -11.186 -2.550 228 HD11 LEU 30 HD11 LEU 30 -0.069 -9.228 -1.991 229 HD12 LEU 30 HD12 LEU 30 0.345 -9.911 -0.421 230 HD13 LEU 30 HD13 LEU 30 0.904 -10.695 -1.890 231 HD21 LEU 30 HD21 LEU 30 -1.889 -12.929 -0.934 232 HD22 LEU 30 HD22 LEU 30 -0.154 -12.843 -1.254 233 HD23 LEU 30 HD23 LEU 30 -0.793 -12.188 0.248 234 H ILE 31 H ILE 31 -3.020 -9.517 2.684 235 HA ILE 31 HA ILE 31 -5.543 -8.070 2.079 236 HB ILE 31 HB ILE 31 -4.904 -10.273 4.068 237 HG12 ILE 31 HG12 ILE 31 -6.956 -10.485 1.848 238 HG13 ILE 31 HG13 ILE 31 -5.274 -10.733 1.477 239 HG21 ILE 31 HG21 ILE 31 -6.568 -8.825 5.062 240 HG22 ILE 31 HG22 ILE 31 -7.520 -8.799 3.559 241 HG23 ILE 31 HG23 ILE 31 -7.369 -10.300 4.506 242 HD11 ILE 31 HD11 ILE 31 -6.255 -12.857 2.006 243 HD12 ILE 31 HD12 ILE 31 -5.063 -12.377 3.248 244 HD13 ILE 31 HD13 ILE 31 -6.805 -12.244 3.582 245 H THR 32 H THR 32 -2.591 -8.065 3.664 246 HA THR 32 HA THR 32 -3.459 -5.985 5.639 247 HB THR 32 HB THR 32 -1.090 -7.886 5.702 248 HG1 THR 32 HG1 THR 32 -2.279 -8.790 7.417 249 HG21 THR 32 HG21 THR 32 -0.485 -5.833 6.865 250 HG22 THR 32 HG22 THR 32 -2.049 -5.818 7.724 251 HG23 THR 32 HG23 THR 32 -0.848 -7.090 8.054 252 H ALA 33 H ALA 33 -1.527 -6.565 2.786 253 HA ALA 33 HA ALA 33 0.138 -4.159 3.283 254 HB1 ALA 33 HB1 ALA 33 0.150 -6.215 1.035 255 HB2 ALA 33 HB2 ALA 33 1.347 -4.918 1.271 256 HB3 ALA 33 HB3 ALA 33 1.216 -6.232 2.457 257 H GLN 34 H GLN 34 -2.694 -5.178 1.542 258 HA GLN 34 HA GLN 34 -3.617 -2.713 0.754 259 HB2 GLN 34 HB2 GLN 34 -3.182 -2.739 -1.734 260 HB3 GLN 34 HB3 GLN 34 -1.850 -2.232 -0.696 261 HG2 GLN 34 HG2 GLN 34 -1.213 -4.831 -0.880 262 HG3 GLN 34 HG3 GLN 34 -2.144 -4.682 -2.385 263 HE21 GLN 34 HE22 GLN 34 0.427 -3.022 -0.488 264 HE22 GLN 34 HE21 GLN 34 1.394 -2.563 -1.873 265 HA PRO 35 HA PRO 35 -6.213 -6.493 0.438 266 HB2 PRO 35 HB2 PRO 35 -8.343 -5.478 1.875 267 HB3 PRO 35 HB3 PRO 35 -6.900 -6.242 2.614 268 HG2 PRO 35 HG2 PRO 35 -7.458 -3.297 2.186 269 HG3 PRO 35 HG3 PRO 35 -6.870 -4.108 3.683 270 HD2 PRO 35 HD2 PRO 35 -5.168 -2.870 1.983 271 HD3 PRO 35 HD3 PRO 35 -4.717 -4.418 2.767 272 H GLN 36 H GLN 36 -6.305 -3.401 -0.890 273 HA GLN 36 HA GLN 36 -8.936 -3.258 -1.930 274 HB2 GLN 36 HB2 GLN 36 -8.023 -1.519 -3.370 275 HB3 GLN 36 HB3 GLN 36 -7.418 -1.342 -1.713 276 HG2 GLN 36 HG2 GLN 36 -5.328 -2.527 -2.393 277 HG3 GLN 36 HG3 GLN 36 -5.935 -2.605 -4.050 278 HE21 GLN 36 HE22 GLN 36 -3.524 -1.436 -3.737 279 HE22 GLN 36 HE21 GLN 36 -3.641 0.304 -3.881 280 H ASN 37 H ASN 37 -7.181 -5.843 -2.448 281 HA ASN 37 HA ASN 37 -7.922 -6.091 -5.314 282 HB2 ASN 37 HB2 ASN 37 -5.255 -6.732 -4.003 283 HB3 ASN 37 HB3 ASN 37 -5.739 -7.352 -5.596 284 HD21 ASN 37 HD22 ASN 37 -3.997 -4.959 -4.090 285 HD22 ASN 37 HD21 ASN 37 -4.046 -3.744 -5.347 286 HA PRO 38 HA PRO 38 -9.825 -9.711 -3.503 287 HB2 PRO 38 HB2 PRO 38 -10.874 -10.796 -5.734 288 HB3 PRO 38 HB3 PRO 38 -11.401 -9.192 -5.160 289 HG2 PRO 38 HG2 PRO 38 -9.288 -9.730 -7.265 290 HG3 PRO 38 HG3 PRO 38 -10.773 -8.722 -7.423 291 HD2 PRO 38 HD2 PRO 38 -8.457 -7.528 -6.719 292 HD3 PRO 38 HD3 PRO 38 -9.950 -7.119 -5.921 293 H VAL 39 H VAL 39 -7.202 -9.859 -5.908 294 HA VAL 39 HA VAL 39 -7.037 -12.708 -6.054 295 HB VAL 39 HB VAL 39 -5.956 -11.042 -7.583 296 HG11 VAL 39 HG11 VAL 39 -3.866 -10.818 -5.389 297 HG12 VAL 39 HG12 VAL 39 -3.775 -10.124 -7.023 298 HG13 VAL 39 HG13 VAL 39 -4.997 -9.532 -5.875 299 HG21 VAL 39 HG21 VAL 39 -4.082 -13.108 -6.362 300 HG22 VAL 39 HG22 VAL 39 -5.354 -13.449 -7.553 301 HG23 VAL 39 HG23 VAL 39 -3.972 -12.423 -7.998 302 H GLY 40 H GLY 40 -6.062 -10.358 -3.669 303 HA2 GLY 40 HA2 GLY 40 -4.269 -11.924 -2.119 304 HA3 GLY 40 HA3 GLY 40 -5.256 -10.565 -1.544 305 H TYR 41 H TYR 41 -7.743 -12.114 -2.544 306 HA TYR 41 HA TYR 41 -7.964 -13.868 -0.149 307 HB2 TYR 41 HB2 TYR 41 -10.272 -12.811 -1.821 308 HB3 TYR 41 HB3 TYR 41 -10.319 -13.477 -0.267 309 HD1 TYR 41 HD1 TYR 41 -8.918 -10.470 -1.976 310 HD2 TYR 41 HD2 TYR 41 -10.238 -12.257 1.688 311 HE1 TYR 41 HE1 TYR 41 -8.778 -8.266 -0.873 312 HE2 TYR 41 HE2 TYR 41 -10.069 -10.047 2.829 313 HH TYR 41 HH TYR 41 -9.068 -7.094 1.066 314 H SER 42 H SER 42 -8.060 -13.729 -3.628 315 HA SER 42 HA SER 42 -9.663 -16.039 -4.125 316 HB2 SER 42 HB2 SER 42 -9.177 -14.133 -5.702 317 HB3 SER 42 HB3 SER 42 -7.551 -14.830 -5.940 318 HG SER 42 HG SER 42 -8.609 -16.771 -6.608 319 H ASN 43 H ASN 43 -6.750 -16.095 -2.566 320 HA ASN 43 HA ASN 43 -6.150 -18.786 -3.709 321 HB2 ASN 43 HB2 ASN 43 -4.231 -16.612 -2.797 322 HB3 ASN 43 HB3 ASN 43 -3.766 -18.278 -3.150 323 HD21 ASN 43 HD22 ASN 43 -4.586 -15.172 -4.537 324 HD22 ASN 43 HD21 ASN 43 -4.348 -15.657 -6.200 325 H LYS 44 H LYS 44 -6.326 -16.743 -0.720 326 HA LYS 44 HA LYS 44 -5.888 -19.148 0.891 327 HB2 LYS 44 HB2 LYS 44 -6.795 -17.730 2.716 328 HB3 LYS 44 HB3 LYS 44 -5.311 -17.117 1.960 329 HG2 LYS 44 HG2 LYS 44 -6.484 -15.339 0.929 330 HG3 LYS 44 HG3 LYS 44 -8.065 -16.127 1.158 331 HD2 LYS 44 HD2 LYS 44 -7.704 -14.298 2.797 332 HD3 LYS 44 HD3 LYS 44 -7.930 -15.880 3.557 333 HE2 LYS 44 HE2 LYS 44 -5.455 -16.112 3.801 334 HE3 LYS 44 HE3 LYS 44 -5.255 -14.503 3.098 335 HZ1 LYS 44 HZ1 LYS 44 -6.686 -15.148 5.596 336 HZ2 LYS 44 HZ2 LYS 44 -5.217 -14.400 5.486 337 HZ3 LYS 44 HZ3 LYS 44 -6.567 -13.639 4.947 338 H ALA 45 H ALA 45 -8.583 -17.366 -0.496 339 HA ALA 45 HA ALA 45 -10.748 -18.816 0.649 340 HB1 ALA 45 HB1 ALA 45 -10.492 -17.489 -2.086 341 HB2 ALA 45 HB2 ALA 45 -12.006 -17.946 -1.302 342 HB3 ALA 45 HB3 ALA 45 -10.992 -16.665 -0.589 343 H MET 46 H MET 46 -8.214 -20.078 -1.086 344 HA MET 46 HA MET 46 -9.834 -22.390 -1.968 345 HB2 MET 46 HB2 MET 46 -9.039 -20.654 -3.821 346 HB3 MET 46 HB3 MET 46 -7.473 -21.454 -3.604 347 HG2 MET 46 HG2 MET 46 -8.716 -22.481 -5.439 348 HG3 MET 46 HG3 MET 46 -8.520 -23.633 -4.115 349 HE1 MET 46 HE1 MET 46 -11.131 -20.620 -4.373 350 HE2 MET 46 HE2 MET 46 -10.919 -21.219 -6.031 351 HE3 MET 46 HE3 MET 46 -12.470 -21.441 -5.195 352 H ALA 47 H ALA 47 -7.489 -21.286 0.074 353 HA ALA 47 HA ALA 47 -6.158 -23.946 0.055 354 HB1 ALA 47 HB1 ALA 47 -4.174 -22.862 1.025 355 HB2 ALA 47 HB2 ALA 47 -4.592 -22.133 -0.545 356 HB3 ALA 47 HB3 ALA 47 -4.987 -21.286 0.980 357 H LEU 48 H LEU 48 -7.916 -21.544 1.970 358 HA LEU 48 HA LEU 48 -7.420 -22.857 4.514 359 HB2 LEU 48 HB2 LEU 48 -9.514 -20.920 3.458 360 HB3 LEU 48 HB3 LEU 48 -9.553 -21.545 5.112 361 HG LEU 48 HG LEU 48 -7.113 -20.145 3.962 362 HD11 LEU 48 HD11 LEU 48 -9.390 -19.006 5.628 363 HD12 LEU 48 HD12 LEU 48 -7.891 -18.150 5.199 364 HD13 LEU 48 HD13 LEU 48 -9.060 -18.612 3.927 365 HD21 LEU 48 HD21 LEU 48 -6.685 -21.544 5.941 366 HD22 LEU 48 HD22 LEU 48 -6.620 -19.832 6.392 367 HD23 LEU 48 HD23 LEU 48 -8.050 -20.790 6.796 368 H ILE 49 H ILE 49 -9.679 -23.256 1.805 369 HA ILE 49 HA ILE 49 -11.429 -25.107 3.111 370 HB ILE 49 HB ILE 49 -12.022 -25.799 0.835 371 HG12 ILE 49 HG12 ILE 49 -10.152 -23.638 -0.121 372 HG13 ILE 49 HG13 ILE 49 -9.574 -25.277 -0.007 373 HG21 ILE 49 HG21 ILE 49 -11.854 -22.773 1.221 374 HG22 ILE 49 HG22 ILE 49 -12.991 -23.631 0.159 375 HG23 ILE 49 HG23 ILE 49 -13.097 -23.831 1.920 376 HD11 ILE 49 HD11 ILE 49 -11.245 -26.164 -1.419 377 HD12 ILE 49 HD12 ILE 49 -11.953 -24.534 -1.664 378 HD13 ILE 49 HD13 ILE 49 -10.310 -24.913 -2.254 379 H LYS 50 H LYS 50 -8.263 -25.294 1.685 380 HA LYS 50 HA LYS 50 -8.392 -28.070 0.909 381 HB2 LYS 50 HB2 LYS 50 -6.932 -25.839 0.190 382 HB3 LYS 50 HB3 LYS 50 -5.755 -26.713 1.173 383 HG2 LYS 50 HG2 LYS 50 -5.317 -27.565 -0.904 384 HG3 LYS 50 HG3 LYS 50 -6.488 -28.776 -0.355 385 HD2 LYS 50 HD2 LYS 50 -7.064 -26.286 -2.025 386 HD3 LYS 50 HD3 LYS 50 -6.856 -27.910 -2.709 387 HE2 LYS 50 HE2 LYS 50 -8.965 -27.144 -0.679 388 HE3 LYS 50 HE3 LYS 50 -9.232 -27.132 -2.425 389 HZ1 LYS 50 HZ1 LYS 50 -8.461 -29.512 -0.854 390 HZ2 LYS 50 HZ2 LYS 50 -9.977 -29.205 -1.439 391 HZ3 LYS 50 HZ3 LYS 50 -8.725 -29.480 -2.475 392 H LEU 51 H LEU 51 -8.344 -26.751 3.877 393 HA LEU 51 HA LEU 51 -6.332 -28.584 5.043 394 HB2 LEU 51 HB2 LEU 51 -5.411 -26.330 4.467 395 HB3 LEU 51 HB3 LEU 51 -6.605 -25.587 5.529 396 HG LEU 51 HG LEU 51 -5.544 -26.615 7.485 397 HD11 LEU 51 HD11 LEU 51 -3.425 -27.917 7.182 398 HD12 LEU 51 HD12 LEU 51 -4.844 -28.772 6.549 399 HD13 LEU 51 HD13 LEU 51 -3.732 -27.948 5.433 400 HD21 LEU 51 HD21 LEU 51 -3.332 -25.479 7.256 401 HD22 LEU 51 HD22 LEU 51 -3.596 -25.381 5.493 402 HD23 LEU 51 HD23 LEU 51 -4.663 -24.499 6.600 403 H GLY 52 H GLY 52 -9.516 -27.394 5.081 404 HA2 GLY 52 HA2 GLY 52 -11.141 -28.328 6.497 405 HA3 GLY 52 HA3 GLY 52 -9.910 -28.669 7.725 406 H GLU 53 H GLU 53 -10.037 -25.443 6.263 407 HA GLU 53 HA GLU 53 -11.320 -24.467 8.770 408 HB2 GLU 53 HB2 GLU 53 -9.183 -22.861 7.347 409 HB3 GLU 53 HB3 GLU 53 -9.855 -22.676 8.955 410 HG2 GLU 53 HG2 GLU 53 -8.859 -24.862 9.619 411 HG3 GLU 53 HG3 GLU 53 -8.084 -24.976 8.027 412 H TYR 54 H TYR 54 -12.869 -25.091 6.616 413 HA TYR 54 HA TYR 54 -13.396 -23.120 4.706 414 HB2 TYR 54 HB2 TYR 54 -15.347 -24.853 6.263 415 HB3 TYR 54 HB3 TYR 54 -15.722 -23.981 4.781 416 HD1 TYR 54 HD2 TYR 54 -13.758 -26.804 6.192 417 HD2 TYR 54 HD1 TYR 54 -15.108 -24.794 2.632 418 HE1 TYR 54 HE2 TYR 54 -13.050 -28.752 4.826 419 HE2 TYR 54 HE1 TYR 54 -14.393 -26.738 1.260 420 HH TYR 54 HH TYR 54 -13.472 -28.830 1.257 421 H THR 55 H THR 55 -14.098 -23.148 8.186 422 HA THR 55 HA THR 55 -15.993 -21.071 8.338 423 HB THR 55 HB THR 55 -13.660 -21.791 10.186 424 HG1 THR 55 HG1 THR 55 -16.384 -22.617 10.210 425 HG21 THR 55 HG21 THR 55 -14.597 -19.611 10.814 426 HG22 THR 55 HG22 THR 55 -16.257 -20.255 10.700 427 HG23 THR 55 HG23 THR 55 -15.157 -20.835 11.976 428 H GLN 56 H GLN 56 -12.529 -21.003 7.727 429 HA GLN 56 HA GLN 56 -12.372 -18.088 8.171 430 HB2 GLN 56 HB2 GLN 56 -10.273 -20.176 7.461 431 HB3 GLN 56 HB3 GLN 56 -9.951 -18.489 7.924 432 HG2 GLN 56 HG2 GLN 56 -10.885 -18.886 10.136 433 HG3 GLN 56 HG3 GLN 56 -11.431 -20.492 9.685 434 HE21 GLN 56 HE22 GLN 56 -10.319 -21.461 11.393 435 HE22 GLN 56 HE21 GLN 56 -8.593 -21.715 11.297 436 H ALA 57 H ALA 57 -12.768 -20.429 5.615 437 HA ALA 57 HA ALA 57 -11.583 -18.851 3.499 438 HB1 ALA 57 HB1 ALA 57 -12.715 -20.507 2.053 439 HB2 ALA 57 HB2 ALA 57 -11.891 -21.315 3.408 440 HB3 ALA 57 HB3 ALA 57 -13.654 -21.100 3.443 441 H ILE 58 H ILE 58 -14.936 -19.339 4.740 442 HA ILE 58 HA ILE 58 -16.228 -17.751 2.697 443 HB ILE 58 HB ILE 58 -17.070 -18.302 5.598 444 HG12 ILE 58 HG12 ILE 58 -17.718 -20.023 3.189 445 HG13 ILE 58 HG13 ILE 58 -16.402 -20.401 4.290 446 HG21 ILE 58 HG21 ILE 58 -19.341 -18.107 4.798 447 HG22 ILE 58 HG22 ILE 58 -18.457 -16.694 4.194 448 HG23 ILE 58 HG23 ILE 58 -18.797 -18.075 3.116 449 HD11 ILE 58 HD11 ILE 58 -19.335 -20.183 5.052 450 HD12 ILE 58 HD12 ILE 58 -18.358 -21.653 5.001 451 HD13 ILE 58 HD13 ILE 58 -17.998 -20.409 6.208 452 H GLN 59 H GLN 59 -14.716 -16.986 5.855 453 HA GLN 59 HA GLN 59 -15.805 -14.309 5.967 454 HB2 GLN 59 HB2 GLN 59 -13.524 -15.697 7.438 455 HB3 GLN 59 HB3 GLN 59 -14.118 -14.055 7.812 456 HG2 GLN 59 HG2 GLN 59 -16.367 -14.958 8.266 457 HG3 GLN 59 HG3 GLN 59 -15.811 -16.592 7.879 458 HE21 GLN 59 HE22 GLN 59 -16.795 -16.773 10.198 459 HE22 GLN 59 HE21 GLN 59 -15.637 -16.604 11.505 460 H MET 60 H MET 60 -13.531 -15.668 3.928 461 HA MET 60 HA MET 60 -12.157 -13.065 3.524 462 HB2 MET 60 HB2 MET 60 -11.264 -15.892 2.854 463 HB3 MET 60 HB3 MET 60 -10.312 -14.435 2.536 464 HG2 MET 60 HG2 MET 60 -11.232 -15.031 5.353 465 HG3 MET 60 HG3 MET 60 -9.908 -15.957 4.668 466 HE1 MET 60 HE1 MET 60 -10.372 -12.149 3.685 467 HE2 MET 60 HE2 MET 60 -11.181 -12.323 5.263 468 HE3 MET 60 HE3 MET 60 -9.668 -11.359 5.098 469 H CYS 61 H CYS 61 -14.170 -15.610 2.123 470 HA CYS 61 HA CYS 61 -13.749 -14.818 -0.610 471 HB2 CYS 61 HB2 CYS 61 -16.095 -16.226 0.806 472 HB3 CYS 61 HB3 CYS 61 -15.985 -16.011 -0.943 473 HG CYS 61 HG CYS 61 -13.729 -17.440 0.994 474 H GLN 62 H GLN 62 -16.173 -13.908 1.938 475 HA GLN 62 HA GLN 62 -17.664 -12.132 0.263 476 HB2 GLN 62 HB2 GLN 62 -17.185 -12.134 3.276 477 HB3 GLN 62 HB3 GLN 62 -18.466 -11.229 2.438 478 HG2 GLN 62 HG2 GLN 62 -19.528 -13.289 1.702 479 HG3 GLN 62 HG3 GLN 62 -18.178 -14.256 2.292 480 HE21 GLN 62 HE22 GLN 62 -19.793 -15.440 3.456 481 HE22 GLN 62 HE21 GLN 62 -20.413 -14.804 4.950 482 H GLN 63 H GLN 63 -14.591 -11.783 1.981 483 HA GLN 63 HA GLN 63 -14.661 -8.865 1.919 484 HB2 GLN 63 HB2 GLN 63 -12.433 -10.865 2.476 485 HB3 GLN 63 HB3 GLN 63 -12.298 -9.106 2.710 486 HG2 GLN 63 HG2 GLN 63 -14.375 -10.820 4.143 487 HG3 GLN 63 HG3 GLN 63 -12.772 -10.476 4.787 488 HE21 GLN 63 HE22 GLN 63 -14.113 -9.584 6.582 489 HE22 GLN 63 HE21 GLN 63 -14.590 -7.904 6.473 490 H GLY 64 H GLY 64 -13.354 -11.504 -0.115 491 HA2 GLY 64 HA2 GLY 64 -11.681 -9.720 -1.680 492 HA3 GLY 64 HA3 GLY 64 -12.122 -11.389 -2.066 493 H LEU 65 H LEU 65 -15.019 -10.948 -1.879 494 HA LEU 65 HA LEU 65 -15.530 -10.071 -4.553 495 HB2 LEU 65 HB2 LEU 65 -17.223 -10.750 -2.139 496 HB3 LEU 65 HB3 LEU 65 -17.968 -10.226 -3.650 497 HG LEU 65 HG LEU 65 -15.981 -12.548 -3.573 498 HD11 LEU 65 HD11 LEU 65 -19.021 -12.623 -3.368 499 HD12 LEU 65 HD12 LEU 65 -17.936 -14.025 -3.516 500 HD13 LEU 65 HD13 LEU 65 -17.887 -13.021 -2.051 501 HD21 LEU 65 HD21 LEU 65 -16.411 -11.536 -5.778 502 HD22 LEU 65 HD22 LEU 65 -17.128 -13.149 -5.668 503 HD23 LEU 65 HD23 LEU 65 -18.166 -11.714 -5.524 504 H ARG 66 H ARG 66 -14.831 -8.186 -1.836 505 HA ARG 66 HA ARG 66 -16.512 -5.889 -2.554 506 HB2 ARG 66 HB2 ARG 66 -14.118 -6.141 -0.680 507 HB3 ARG 66 HB3 ARG 66 -15.247 -4.787 -0.756 508 HG2 ARG 66 HG2 ARG 66 -17.085 -6.235 0.018 509 HG3 ARG 66 HG3 ARG 66 -15.997 -7.636 -0.001 510 HD2 ARG 66 HD2 ARG 66 -16.203 -6.810 2.270 511 HD3 ARG 66 HD3 ARG 66 -14.547 -6.550 1.677 512 HE ARG 66 HE ARG 66 -16.211 -4.231 1.204 513 HH11 ARG 66 HH11 ARG 66 -14.443 -5.964 3.737 514 HH12 ARG 66 HH12 ARG 66 -14.160 -4.517 4.686 515 HH21 ARG 66 HH21 ARG 66 -15.842 -2.374 2.472 516 HH22 ARG 66 HH22 ARG 66 -14.966 -2.498 3.974 517 H TYR 67 H TYR 67 -13.992 -7.319 -4.078 518 HA TYR 67 HA TYR 67 -12.678 -4.782 -4.906 519 HB2 TYR 67 HB2 TYR 67 -11.321 -7.327 -3.989 520 HB3 TYR 67 HB3 TYR 67 -10.493 -5.904 -4.622 521 HD1 TYR 67 HD1 TYR 67 -11.295 -3.603 -3.361 522 HD2 TYR 67 HD2 TYR 67 -11.347 -7.570 -1.699 523 HE1 TYR 67 HE1 TYR 67 -11.303 -2.640 -1.075 524 HE2 TYR 67 HE2 TYR 67 -11.348 -6.620 0.582 525 HH TYR 67 HH TYR 67 -11.340 -3.071 1.171 526 H THR 68 H THR 68 -14.554 -7.201 -5.916 527 HA THR 68 HA THR 68 -13.108 -7.649 -8.479 528 HB THR 68 HB THR 68 -14.832 -9.447 -8.791 529 HG1 THR 68 HG1 THR 68 -16.416 -8.641 -7.391 530 HG21 THR 68 HG21 THR 68 -12.575 -9.888 -7.840 531 HG22 THR 68 HG22 THR 68 -13.251 -9.646 -6.216 532 HG23 THR 68 HG23 THR 68 -13.827 -10.994 -7.211 533 H SER 69 H SER 69 -14.560 -5.168 -7.582 534 HA SER 69 HA SER 69 -17.054 -4.926 -8.925 535 HB2 SER 69 HB2 SER 69 -15.015 -2.835 -8.075 536 HB3 SER 69 HB3 SER 69 -16.701 -2.509 -8.526 537 HG SER 69 HG SER 69 -16.431 -2.730 -6.254 538 H THR 70 H THR 70 -14.336 -5.679 -10.543 539 HA THR 70 HA THR 70 -15.146 -4.154 -12.923 540 HB THR 70 HB THR 70 -13.560 -2.635 -11.979 541 HG1 THR 70 HG1 THR 70 -11.981 -2.681 -13.580 542 HG21 THR 70 HG21 THR 70 -11.685 -5.017 -11.716 543 HG22 THR 70 HG22 THR 70 -11.224 -3.326 -11.451 544 HG23 THR 70 HG23 THR 70 -12.414 -4.094 -10.377 545 H ALA 71 H ALA 71 -13.988 -4.869 -14.868 546 HA ALA 71 HA ALA 71 -14.231 -7.666 -15.158 547 HB1 ALA 71 HB1 ALA 71 -12.934 -5.568 -16.935 548 HB2 ALA 71 HB2 ALA 71 -13.458 -7.193 -17.465 549 HB3 ALA 71 HB3 ALA 71 -14.659 -5.998 -16.922 550 H GLU 72 H GLU 72 -11.534 -5.833 -14.000 551 HA GLU 72 HA GLU 72 -9.390 -7.456 -14.958 552 HB2 GLU 72 HB2 GLU 72 -9.656 -5.855 -12.412 553 HB3 GLU 72 HB3 GLU 72 -8.137 -6.492 -13.059 554 HG2 GLU 72 HG2 GLU 72 -9.953 -4.464 -14.427 555 HG3 GLU 72 HG3 GLU 72 -8.429 -4.110 -13.604 556 H HIS 73 H HIS 73 -11.960 -8.267 -12.897 557 HA HIS 73 HA HIS 73 -10.489 -10.615 -11.856 558 HB2 HIS 73 HB2 HIS 73 -12.361 -8.999 -10.101 559 HB3 HIS 73 HB3 HIS 73 -11.225 -10.259 -9.627 560 HD2 HIS 73 HD2 HIS 73 -11.579 -6.572 -9.890 561 HE1 HIS 73 HE1 HIS 73 -7.410 -7.203 -9.379 562 HE2 HIS 73 HE2 HIS 73 -9.266 -5.453 -9.382 563 H VAL 74 H VAL 74 -12.507 -10.121 -14.014 564 HA VAL 74 HA VAL 74 -15.143 -10.588 -13.289 565 HB VAL 74 HB VAL 74 -14.239 -9.941 -15.510 566 HG11 VAL 74 HG11 VAL 74 -13.726 -12.919 -15.869 567 HG12 VAL 74 HG12 VAL 74 -13.566 -11.658 -17.114 568 HG13 VAL 74 HG13 VAL 74 -12.468 -11.667 -15.713 569 HG21 VAL 74 HG21 VAL 74 -15.975 -11.070 -16.821 570 HG22 VAL 74 HG22 VAL 74 -16.136 -12.317 -15.571 571 HG23 VAL 74 HG23 VAL 74 -16.598 -10.634 -15.215 572 H ALA 75 H ALA 75 -12.519 -12.958 -13.380 573 HA ALA 75 HA ALA 75 -14.421 -15.207 -13.155 574 HB1 ALA 75 HB1 ALA 75 -11.376 -15.079 -12.997 575 HB2 ALA 75 HB2 ALA 75 -12.360 -16.565 -13.052 576 HB3 ALA 75 HB3 ALA 75 -12.335 -15.473 -14.449 577 H ILE 76 H ILE 76 -12.052 -13.448 -11.055 578 HA ILE 76 HA ILE 76 -12.452 -15.126 -8.768 579 HB ILE 76 HB ILE 76 -11.635 -12.201 -8.995 580 HG12 ILE 76 HG12 ILE 76 -9.974 -14.738 -8.674 581 HG13 ILE 76 HG13 ILE 76 -10.182 -13.837 -10.170 582 HG21 ILE 76 HG21 ILE 76 -11.396 -14.148 -6.672 583 HG22 ILE 76 HG22 ILE 76 -10.645 -12.545 -6.735 584 HG23 ILE 76 HG23 ILE 76 -12.404 -12.678 -6.728 585 HD11 ILE 76 HD11 ILE 76 -8.070 -13.197 -9.218 586 HD12 ILE 76 HD12 ILE 76 -9.176 -11.820 -9.113 587 HD13 ILE 76 HD13 ILE 76 -8.826 -12.802 -7.666 588 H ARG 77 H ARG 77 -14.280 -12.465 -10.177 589 HA ARG 77 HA ARG 77 -15.995 -11.738 -8.066 590 HB2 ARG 77 HB2 ARG 77 -15.705 -10.677 -10.348 591 HB3 ARG 77 HB3 ARG 77 -16.603 -12.034 -11.038 592 HG2 ARG 77 HG2 ARG 77 -18.579 -11.410 -9.636 593 HG3 ARG 77 HG3 ARG 77 -17.659 -10.012 -9.015 594 HD2 ARG 77 HD2 ARG 77 -17.394 -9.182 -11.334 595 HD3 ARG 77 HD3 ARG 77 -18.229 -10.624 -11.937 596 HE ARG 77 HE ARG 77 -20.286 -9.737 -11.253 597 HH11 ARG 77 HH11 ARG 77 -17.640 -7.682 -10.082 598 HH12 ARG 77 HH12 ARG 77 -18.725 -6.392 -9.612 599 HH21 ARG 77 HH21 ARG 77 -21.646 -8.018 -10.638 600 HH22 ARG 77 HH22 ARG 77 -20.966 -6.566 -9.934 601 H SER 78 H SER 78 -15.755 -14.715 -9.788 602 HA SER 78 HA SER 78 -18.341 -15.654 -8.611 603 HB2 SER 78 HB2 SER 78 -17.000 -16.420 -11.238 604 HB3 SER 78 HB3 SER 78 -18.463 -17.190 -10.573 605 HG SER 78 HG SER 78 -19.493 -15.160 -10.687 606 H LYS 79 H LYS 79 -14.859 -16.164 -8.821 607 HA LYS 79 HA LYS 79 -15.077 -18.958 -7.995 608 HB2 LYS 79 HB2 LYS 79 -12.761 -16.999 -8.171 609 HB3 LYS 79 HB3 LYS 79 -12.596 -18.636 -7.560 610 HG2 LYS 79 HG2 LYS 79 -13.446 -17.856 -10.366 611 HG3 LYS 79 HG3 LYS 79 -11.930 -18.609 -9.880 612 HD2 LYS 79 HD2 LYS 79 -14.714 -19.823 -9.931 613 HD3 LYS 79 HD3 LYS 79 -13.263 -20.338 -10.805 614 HE2 LYS 79 HE2 LYS 79 -12.199 -20.860 -8.551 615 HE3 LYS 79 HE3 LYS 79 -13.780 -20.523 -7.806 616 HZ1 LYS 79 HZ1 LYS 79 -14.721 -22.267 -9.168 617 HZ2 LYS 79 HZ2 LYS 79 -13.255 -22.589 -9.845 618 HZ3 LYS 79 HZ3 LYS 79 -13.500 -22.861 -8.239 619 H LEU 80 H LEU 80 -14.830 -15.774 -6.306 620 HA LEU 80 HA LEU 80 -14.221 -17.036 -3.769 621 HB2 LEU 80 HB2 LEU 80 -15.452 -14.356 -4.512 622 HB3 LEU 80 HB3 LEU 80 -14.862 -14.786 -2.897 623 HG LEU 80 HG LEU 80 -13.146 -14.708 -5.420 624 HD11 LEU 80 HD11 LEU 80 -13.426 -12.723 -3.142 625 HD12 LEU 80 HD12 LEU 80 -12.194 -12.641 -4.423 626 HD13 LEU 80 HD13 LEU 80 -13.912 -12.464 -4.835 627 HD21 LEU 80 HD21 LEU 80 -12.427 -14.989 -2.480 628 HD22 LEU 80 HD22 LEU 80 -12.225 -16.224 -3.747 629 HD23 LEU 80 HD23 LEU 80 -11.266 -14.732 -3.808 630 H GLN 81 H GLN 81 -17.105 -16.115 -5.652 631 HA GLN 81 HA GLN 81 -19.031 -16.708 -3.616 632 HB2 GLN 81 HB2 GLN 81 -18.955 -16.216 -6.576 633 HB3 GLN 81 HB3 GLN 81 -20.342 -17.089 -5.969 634 HG2 GLN 81 HG2 GLN 81 -19.444 -14.333 -5.106 635 HG3 GLN 81 HG3 GLN 81 -20.917 -14.761 -5.993 636 HE21 GLN 81 HE22 GLN 81 -21.841 -17.005 -4.529 637 HE22 GLN 81 HE21 GLN 81 -22.211 -16.488 -2.891 638 H TYR 82 H TYR 82 -17.426 -18.634 -6.182 639 HA TYR 82 HA TYR 82 -19.150 -20.883 -6.144 640 HB2 TYR 82 HB2 TYR 82 -17.551 -20.628 -7.920 641 HB3 TYR 82 HB3 TYR 82 -16.240 -20.340 -6.800 642 HD1 TYR 82 HD1 TYR 82 -18.411 -22.986 -8.245 643 HD2 TYR 82 HD2 TYR 82 -14.986 -22.064 -5.820 644 HE1 TYR 82 HE1 TYR 82 -17.725 -25.378 -8.330 645 HE2 TYR 82 HE2 TYR 82 -14.274 -24.459 -5.913 646 HH TYR 82 HH TYR 82 -16.176 -26.934 -7.698 647 H ARG 83 H ARG 83 -16.286 -20.149 -4.043 648 HA ARG 83 HA ARG 83 -16.725 -22.762 -2.725 649 HB2 ARG 83 HB2 ARG 83 -14.598 -20.644 -2.659 650 HB3 ARG 83 HB3 ARG 83 -14.786 -21.696 -1.233 651 HG2 ARG 83 HG2 ARG 83 -14.200 -22.568 -4.076 652 HG3 ARG 83 HG3 ARG 83 -13.088 -22.588 -2.709 653 HD2 ARG 83 HD2 ARG 83 -14.512 -24.260 -1.567 654 HD3 ARG 83 HD3 ARG 83 -15.616 -24.269 -2.956 655 HE ARG 83 HE ARG 83 -12.949 -24.798 -3.834 656 HH11 ARG 83 HH11 ARG 83 -15.669 -26.301 -2.152 657 HH12 ARG 83 HH12 ARG 83 -15.240 -27.921 -2.649 658 HH21 ARG 83 HH21 ARG 83 -12.403 -26.916 -4.459 659 HH22 ARG 83 HH22 ARG 83 -13.394 -28.260 -3.963 660 H LEU 84 H LEU 84 -17.593 -19.406 -2.240 661 HA LEU 84 HA LEU 84 -18.345 -19.667 0.524 662 HB2 LEU 84 HB2 LEU 84 -18.105 -17.615 -1.091 663 HB3 LEU 84 HB3 LEU 84 -19.767 -17.961 -1.555 664 HG LEU 84 HG LEU 84 -18.693 -17.285 1.186 665 HD11 LEU 84 HD11 LEU 84 -20.467 -15.761 -0.745 666 HD12 LEU 84 HD12 LEU 84 -20.039 -15.230 0.894 667 HD13 LEU 84 HD13 LEU 84 -18.770 -15.393 -0.333 668 HD21 LEU 84 HD21 LEU 84 -20.564 -18.736 1.585 669 HD22 LEU 84 HD22 LEU 84 -21.109 -17.081 1.857 670 HD23 LEU 84 HD23 LEU 84 -21.538 -17.898 0.341 671 H GLU 85 H GLU 85 -19.788 -20.334 -2.587 672 HA GLU 85 HA GLU 85 -22.406 -21.196 -1.741 673 HB2 GLU 85 HB2 GLU 85 -20.742 -21.190 -4.252 674 HB3 GLU 85 HB3 GLU 85 -22.230 -22.108 -4.241 675 HG2 GLU 85 HG2 GLU 85 -23.530 -20.147 -3.591 676 HG3 GLU 85 HG3 GLU 85 -22.060 -19.192 -3.399 677 H LEU 86 H LEU 86 -19.503 -22.714 -1.144 678 HA LEU 86 HA LEU 86 -20.853 -25.370 -1.127 679 HB2 LEU 86 HB2 LEU 86 -18.056 -24.740 -2.145 680 HB3 LEU 86 HB3 LEU 86 -18.632 -26.375 -1.809 681 HG LEU 86 HG LEU 86 -19.918 -24.504 -3.829 682 HD11 LEU 86 HD11 LEU 86 -17.647 -25.162 -4.509 683 HD12 LEU 86 HD12 LEU 86 -18.038 -26.874 -4.209 684 HD13 LEU 86 HD13 LEU 86 -18.863 -25.984 -5.505 685 HD21 LEU 86 HD21 LEU 86 -21.479 -26.209 -2.932 686 HD22 LEU 86 HD22 LEU 86 -21.035 -26.570 -4.612 687 HD23 LEU 86 HD23 LEU 86 -20.283 -27.484 -3.281 688 H ALA 87 H ALA 87 -18.779 -23.036 0.451 689 HA ALA 87 HA ALA 87 -17.590 -24.838 2.344 690 HB1 ALA 87 HB1 ALA 87 -18.192 -21.853 2.449 691 HB2 ALA 87 HB2 ALA 87 -17.125 -22.720 3.576 692 HB3 ALA 87 HB3 ALA 87 -16.687 -22.601 1.865 693 H GLN 88 H GLN 88 -20.750 -23.281 2.091 694 HA GLN 88 HA GLN 88 -21.475 -23.516 4.863 695 HB2 GLN 88 HB2 GLN 88 -23.123 -23.196 2.328 696 HB3 GLN 88 HB3 GLN 88 -23.718 -22.971 3.978 697 HG2 GLN 88 HG2 GLN 88 -22.071 -21.124 4.324 698 HG3 GLN 88 HG3 GLN 88 -21.484 -21.366 2.675 699 HE21 GLN 88 HE22 GLN 88 -22.363 -20.107 1.120 700 HE22 GLN 88 HE21 GLN 88 -23.918 -19.291 1.244 701 H GLY 89 H GLY 89 -20.736 -25.932 2.784 702 HA2 GLY 89 HA2 GLY 89 -22.613 -27.834 4.081 703 HA3 GLY 89 HA3 GLY 89 -22.420 -27.839 2.312 704 H ALA 90 H ALA 90 -19.586 -26.929 4.061 705 HA ALA 90 HA ALA 90 -18.539 -29.705 4.133 706 HB1 ALA 90 HB1 ALA 90 -17.191 -27.358 2.739 707 HB2 ALA 90 HB2 ALA 90 -16.502 -28.983 2.952 708 HB3 ALA 90 HB3 ALA 90 -17.937 -28.757 1.927 709 H VAL 91 H VAL 91 -18.880 -26.622 5.572 710 HA VAL 91 HA VAL 91 -16.484 -26.515 7.108 711 HB VAL 91 HB VAL 91 -18.098 -24.666 6.673 712 HG11 VAL 91 HG11 VAL 91 -19.799 -26.031 8.801 713 HG12 VAL 91 HG12 VAL 91 -20.104 -24.441 8.063 714 HG13 VAL 91 HG13 VAL 91 -20.203 -25.907 7.069 715 HG21 VAL 91 HG21 VAL 91 -17.881 -23.604 8.848 716 HG22 VAL 91 HG22 VAL 91 -17.583 -25.172 9.625 717 HG23 VAL 91 HG23 VAL 91 -16.406 -24.516 8.476 718 H GLY 92 H GLY 92 -19.248 -28.530 7.270 719 HA2 GLY 92 HA2 GLY 92 -18.129 -29.983 9.558 720 HA3 GLY 92 HA3 GLY 92 -19.710 -29.238 9.848 721 H SER 93 H SER 93 -19.709 -29.898 6.632 722 HA SER 93 HA SER 93 -20.966 -31.287 5.362 723 HB2 SER 93 HB2 SER 93 -20.068 -33.537 5.189 724 HB3 SER 93 HB3 SER 93 -18.773 -32.344 5.366 725 HG SER 93 HG SER 93 -18.505 -34.208 6.701 726 H VAL 94 H VAL 94 -21.949 -33.828 5.479 727 HA VAL 94 HA VAL 94 -23.620 -34.028 7.857 728 HB VAL 94 HB VAL 94 -24.784 -32.449 6.451 729 HG11 VAL 94 HG11 VAL 94 -23.952 -33.188 4.218 730 HG12 VAL 94 HG12 VAL 94 -25.040 -34.593 4.319 731 HG13 VAL 94 HG13 VAL 94 -25.709 -32.964 4.294 732 HG21 VAL 94 HG21 VAL 94 -26.063 -34.041 7.850 733 HG22 VAL 94 HG22 VAL 94 -26.962 -33.606 6.379 734 HG23 VAL 94 HG23 VAL 94 -26.142 -35.174 6.482 735 H GLN 95 H GLN 95 -23.147 -36.010 8.427 736 HA GLN 95 HA GLN 95 -23.800 -38.211 6.605 737 HB2 GLN 95 HB2 GLN 95 -21.716 -39.403 7.113 738 HB3 GLN 95 HB3 GLN 95 -21.413 -37.847 6.302 739 HG2 GLN 95 HG2 GLN 95 -21.329 -37.839 9.284 740 HG3 GLN 95 HG3 GLN 95 -20.003 -38.631 8.422 741 HE21 GLN 95 HE22 GLN 95 -21.074 -35.634 9.589 742 HE22 GLN 95 HE21 GLN 95 -20.102 -34.606 8.552 743 H ILE 96 H ILE 96 -24.855 -36.856 9.126 744 HA ILE 96 HA ILE 96 -25.223 -39.341 10.690 745 HB ILE 96 HB ILE 96 -25.011 -38.020 12.796 746 HG12 ILE 96 HG12 ILE 96 -23.786 -35.884 10.986 747 HG13 ILE 96 HG13 ILE 96 -25.375 -35.766 11.750 748 HG21 ILE 96 HG21 ILE 96 -22.603 -38.106 12.874 749 HG22 ILE 96 HG22 ILE 96 -23.177 -39.442 11.867 750 HG23 ILE 96 HG23 ILE 96 -22.486 -37.994 11.111 751 HD11 ILE 96 HD11 ILE 96 -23.742 -34.544 13.073 752 HD12 ILE 96 HD12 ILE 96 -24.288 -35.968 13.990 753 HD13 ILE 96 HD13 ILE 96 -22.699 -35.974 13.189 754 HA PRO 97 HA PRO 97 -29.069 -36.549 10.149 755 HB2 PRO 97 HB2 PRO 97 -30.380 -37.653 8.043 756 HB3 PRO 97 HB3 PRO 97 -29.088 -36.429 7.818 757 HG2 PRO 97 HG2 PRO 97 -28.824 -39.452 7.685 758 HG3 PRO 97 HG3 PRO 97 -28.276 -38.245 6.468 759 HD2 PRO 97 HD2 PRO 97 -26.570 -39.236 8.335 760 HD3 PRO 97 HD3 PRO 97 -26.518 -37.508 7.865 761 H VAL 98 H VAL 98 -31.339 -37.303 10.376 762 HA VAL 98 HA VAL 98 -32.952 -38.564 11.282 763 HB VAL 98 HB VAL 98 -31.290 -41.058 10.762 764 HG11 VAL 98 HG11 VAL 98 -33.553 -42.062 10.425 765 HG12 VAL 98 HG12 VAL 98 -33.325 -41.479 12.074 766 HG13 VAL 98 HG13 VAL 98 -34.292 -40.523 10.929 767 HG21 VAL 98 HG21 VAL 98 -32.491 -41.137 8.576 768 HG22 VAL 98 HG22 VAL 98 -33.155 -39.519 8.898 769 HG23 VAL 98 HG23 VAL 98 -31.405 -39.746 8.676 770 H VAL 99 H VAL 99 -30.280 -37.752 12.597 771 HA VAL 99 HA VAL 99 -29.917 -39.252 14.979 772 HB VAL 99 HB VAL 99 -28.292 -37.711 14.078 773 HG11 VAL 99 HG11 VAL 99 -30.317 -35.502 14.621 774 HG12 VAL 99 HG12 VAL 99 -28.651 -35.272 14.044 775 HG13 VAL 99 HG13 VAL 99 -29.836 -36.102 13.010 776 HG21 VAL 99 HG21 VAL 99 -28.323 -38.007 16.549 777 HG22 VAL 99 HG22 VAL 99 -27.644 -36.450 16.017 778 HG23 VAL 99 HG23 VAL 99 -29.290 -36.511 16.679 779 H GLU 100 H GLU 100 -32.665 -37.399 14.003 780 HA GLU 100 HA GLU 100 -33.453 -36.084 16.308 781 HB2 GLU 100 HB2 GLU 100 -34.915 -37.462 14.014 782 HB3 GLU 100 HB3 GLU 100 -35.651 -36.364 15.161 783 HG2 GLU 100 HG2 GLU 100 -33.378 -35.660 13.285 784 HG3 GLU 100 HG3 GLU 100 -35.074 -35.202 13.071 785 H VAL 101 H VAL 101 -35.215 -36.637 17.761 786 HA VAL 101 HA VAL 101 -35.634 -39.485 18.263 787 HB VAL 101 HB VAL 101 -33.596 -38.608 19.451 788 HG11 VAL 101 HG11 VAL 101 -35.562 -37.070 21.174 789 HG12 VAL 101 HG12 VAL 101 -33.819 -37.217 21.422 790 HG13 VAL 101 HG13 VAL 101 -34.436 -36.355 19.996 791 HG21 VAL 101 HG21 VAL 101 -34.803 -40.621 20.252 792 HG22 VAL 101 HG22 VAL 101 -34.078 -39.706 21.587 793 HG23 VAL 101 HG23 VAL 101 -35.820 -39.593 21.289 794 H ASP 102 H ASP 102 -37.292 -37.583 17.136 795 HA ASP 102 HA ASP 102 -39.491 -37.459 19.123 796 HB2 ASP 102 HB2 ASP 102 -38.254 -35.300 19.144 797 HB3 ASP 102 HB3 ASP 102 -38.593 -35.124 17.418 798 H GLU 103 H GLU 103 -41.587 -36.844 18.045 799 HA GLU 103 HA GLU 103 -42.064 -38.631 15.842 800 HB2 GLU 103 HB2 GLU 103 -43.892 -36.523 17.029 801 HB3 GLU 103 HB3 GLU 103 -44.366 -37.932 16.069 802 HG2 GLU 103 HG2 GLU 103 -43.383 -39.424 17.825 803 HG3 GLU 103 HG3 GLU 103 -43.078 -37.996 18.828 804 H LEU 104 H LEU 104 -43.853 -37.535 14.233 805 HA LEU 104 HA LEU 104 -42.307 -36.241 12.245 806 HB2 LEU 104 HB2 LEU 104 -45.321 -36.340 12.563 807 HB3 LEU 104 HB3 LEU 104 -44.482 -35.959 11.089 808 HG LEU 104 HG LEU 104 -45.205 -38.135 10.816 809 HD11 LEU 104 HD11 LEU 104 -43.152 -39.417 10.539 810 HD12 LEU 104 HD12 LEU 104 -42.855 -37.720 10.109 811 HD13 LEU 104 HD13 LEU 104 -42.288 -38.361 11.671 812 HD21 LEU 104 HD21 LEU 104 -44.911 -39.977 12.306 813 HD22 LEU 104 HD22 LEU 104 -43.882 -39.047 13.395 814 HD23 LEU 104 HD23 LEU 104 -45.616 -38.654 13.243 815 HA PRO 105 HA PRO 105 -42.420 -32.084 13.358 816 HB2 PRO 105 HB2 PRO 105 -42.206 -30.748 11.007 817 HB3 PRO 105 HB3 PRO 105 -40.959 -31.933 11.530 818 HG2 PRO 105 HG2 PRO 105 -43.238 -32.347 9.585 819 HG3 PRO 105 HG3 PRO 105 -41.526 -32.848 9.420 820 HD2 PRO 105 HD2 PRO 105 -43.591 -34.463 10.304 821 HD3 PRO 105 HD3 PRO 105 -41.899 -34.750 10.764 822 H GLU 106 H GLU 106 -45.178 -33.264 11.866 823 HA GLU 106 HA GLU 106 -47.165 -32.535 13.026 824 HB2 GLU 106 HB2 GLU 106 -47.975 -30.348 13.053 825 HB3 GLU 106 HB3 GLU 106 -46.284 -30.228 13.520 826 HG2 GLU 106 HG2 GLU 106 -45.799 -29.633 11.046 827 HG3 GLU 106 HG3 GLU 106 -47.541 -29.599 10.800 828 H GLY 107 H GLY 107 -45.986 -33.237 10.209 829 HA2 GLY 107 HA2 GLY 107 -48.481 -33.852 8.992 830 HA3 GLY 107 HA3 GLY 107 -47.873 -32.348 8.284 831 H TYR 108 H TYR 108 -45.008 -33.537 8.790 832 HA TYR 108 HA TYR 108 -43.439 -34.358 7.382 833 HB2 TYR 108 HB2 TYR 108 -43.497 -36.761 7.124 834 HB3 TYR 108 HB3 TYR 108 -43.887 -36.210 8.737 835 HD1 TYR 108 HD1 TYR 108 -46.329 -36.157 9.475 836 HD2 TYR 108 HD2 TYR 108 -44.942 -38.239 5.984 837 HE1 TYR 108 HE1 TYR 108 -48.383 -37.564 9.506 838 HE2 TYR 108 HE2 TYR 108 -46.999 -39.638 5.991 839 HH TYR 108 HH TYR 108 -49.552 -39.247 8.498 840 H ASP 109 H ASP 109 -43.650 -36.371 5.333 841 HA ASP 109 HA ASP 109 -44.860 -34.725 3.175 842 HB2 ASP 109 HB2 ASP 109 -42.437 -34.220 3.523 843 HB3 ASP 109 HB3 ASP 109 -42.067 -35.906 3.150 844 H ARG 110 H ARG 110 -45.768 -37.215 4.451 845 HA ARG 110 HA ARG 110 -46.017 -38.818 1.977 846 HB2 ARG 110 HB2 ARG 110 -44.128 -39.645 3.505 847 HB3 ARG 110 HB3 ARG 110 -45.430 -40.224 4.555 848 HG2 ARG 110 HG2 ARG 110 -46.376 -41.510 2.635 849 HG3 ARG 110 HG3 ARG 110 -45.081 -40.890 1.590 850 HD2 ARG 110 HD2 ARG 110 -44.697 -42.565 4.098 851 HD3 ARG 110 HD3 ARG 110 -44.647 -43.184 2.436 852 HE ARG 110 HE ARG 110 -42.789 -41.095 2.528 853 HH11 ARG 110 HH11 ARG 110 -43.240 -44.222 4.118 854 HH12 ARG 110 HH12 ARG 110 -41.532 -44.474 4.357 855 HH21 ARG 110 HH21 ARG 110 -40.562 -41.458 2.865 856 HH22 ARG 110 HH22 ARG 110 -40.023 -42.924 3.643 857 H SER 111 H SER 111 -47.604 -37.023 4.065 858 HA SER 111 HA SER 111 -49.636 -38.647 5.190 859 HB2 SER 111 HB2 SER 111 -50.878 -36.502 5.377 860 HB3 SER 111 HB3 SER 111 -49.195 -36.364 5.934 861 HG SER 111 HG SER 111 -49.807 -34.630 4.553
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