NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
634888 | 6hkc | 27581 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 7.126 1.389 -4.197 2 H2 GLY 1 HT2 GLY 1 5.455 1.659 -4.170 3 H3 GLY 1 HT3 GLY 1 6.272 1.553 -5.648 4 HA2 GLY 1 HA2 GLY 1 5.053 -0.483 -5.194 5 HA3 GLY 1 HA3 GLY 1 6.789 -0.760 -5.256 6 HA PRO 2 HA PRO 2 5.033 -2.322 -1.187 7 HB2 PRO 2 HB3 PRO 2 5.463 -4.960 -1.542 8 HB3 PRO 2 HB2 PRO 2 3.991 -4.161 -2.108 9 HG2 PRO 2 HG3 PRO 2 6.429 -4.951 -3.645 10 HG3 PRO 2 HG2 PRO 2 4.721 -5.089 -4.102 11 HD2 PRO 2 HD3 PRO 2 6.365 -3.086 -4.980 12 HD3 PRO 2 HD2 PRO 2 4.608 -2.911 -4.811 13 H THR 3 H THR 3 6.328 -2.606 0.559 14 HA THR 3 HA THR 3 9.180 -3.059 0.043 15 HB THR 3 HB THR 3 9.502 -2.179 2.373 16 HG1 THR 3 HG1 THR 3 7.802 -1.830 3.581 17 HG21 THR 3 HG21 THR 3 9.786 -0.700 0.462 18 HG22 THR 3 HG22 THR 3 9.041 0.174 1.802 19 HG23 THR 3 HG23 THR 3 8.056 -0.364 0.440 20 H SER 4 H SER 4 9.800 -5.114 0.280 21 HA SER 4 HA SER 4 8.355 -6.921 1.998 22 HB2 SER 4 HB3 SER 4 10.941 -7.337 0.472 23 HB3 SER 4 HB2 SER 4 9.983 -8.601 1.245 24 HG SER 4 HG SER 4 9.574 -7.261 -1.139 25 H GLU 5 H GLU 5 8.568 -6.402 4.090 26 HA GLU 5 HA GLU 5 11.294 -6.051 5.134 27 HB2 GLU 5 HB3 GLU 5 8.685 -5.034 6.290 28 HB3 GLU 5 HB2 GLU 5 10.295 -4.723 6.929 29 HG2 GLU 5 HG3 GLU 5 10.887 -3.442 4.999 30 HG3 GLU 5 HG2 GLU 5 9.386 -3.882 4.190 31 H GLY 6 H GLY 6 11.825 -8.093 5.686 32 HA2 GLY 6 HA3 GLY 6 10.543 -9.212 7.991 33 HA3 GLY 6 HA2 GLY 6 10.274 -10.156 6.533 34 H CYS 7 H CYS 7 11.522 -11.342 8.562 35 HA CYS 7 HA CYS 7 14.374 -11.347 7.867 36 HB2 CYS 7 HB3 CYS 7 13.017 -12.768 10.163 37 HB3 CYS 7 HB2 CYS 7 14.742 -12.487 9.949 38 H GLN 8 H GLN 8 15.406 -13.389 7.431 39 HA GLN 8 HA GLN 8 13.646 -15.194 5.981 40 HB2 GLN 8 HB3 GLN 8 15.682 -16.165 5.080 41 HB3 GLN 8 HB2 GLN 8 15.710 -14.418 4.897 42 HG2 GLN 8 HG3 GLN 8 17.283 -14.163 6.631 43 HG3 GLN 8 HG2 GLN 8 17.057 -15.821 7.183 44 HE21 GLN 8 HE21 GLN 8 17.088 -16.940 4.498 45 HE22 GLN 8 HE22 GLN 8 18.723 -16.872 3.960 46 H ILE 9 H ILE 9 14.596 -17.595 6.059 47 HA ILE 9 HA ILE 9 14.255 -18.465 8.813 48 HB ILE 9 HB ILE 9 14.355 -19.936 6.186 49 HG12 ILE 9 HG13 ILE 9 12.224 -19.583 8.297 50 HG13 ILE 9 HG12 ILE 9 12.246 -18.868 6.688 51 HG21 ILE 9 HG21 ILE 9 13.959 -22.020 7.422 52 HG22 ILE 9 HG22 ILE 9 14.233 -21.157 8.937 53 HG23 ILE 9 HG23 ILE 9 15.544 -21.323 7.766 54 HD11 ILE 9 HD11 ILE 9 10.718 -20.792 6.894 55 HD12 ILE 9 HD12 ILE 9 12.105 -21.821 7.246 56 HD13 ILE 9 HD13 ILE 9 11.970 -21.029 5.676 57 H ILE 10 H ILE 10 15.883 -18.837 10.082 58 HA ILE 10 HA ILE 10 18.593 -18.719 9.185 59 HB ILE 10 HB ILE 10 17.508 -19.414 11.922 60 HG12 ILE 10 HG13 ILE 10 18.445 -16.745 10.841 61 HG13 ILE 10 HG12 ILE 10 16.761 -17.199 11.076 62 HG21 ILE 10 HG21 ILE 10 19.821 -20.108 11.660 63 HG22 ILE 10 HG22 ILE 10 19.725 -18.707 12.728 64 HG23 ILE 10 HG23 ILE 10 20.253 -18.508 11.058 65 HD11 ILE 10 HD11 ILE 10 17.137 -17.388 13.469 66 HD12 ILE 10 HD12 ILE 10 17.581 -15.786 12.879 67 HD13 ILE 10 HD13 ILE 10 18.835 -16.971 13.243 68 H HIS 11 H HIS 11 20.058 -20.338 8.980 69 HA HIS 11 HA HIS 11 19.014 -23.022 8.714 70 HB2 HIS 11 HB3 HIS 11 21.789 -21.885 8.283 71 HB3 HIS 11 HB2 HIS 11 21.349 -23.562 7.977 72 HD1 HIS 11 HD1 HIS 11 20.122 -24.083 5.832 73 HD2 HIS 11 HD2 HIS 11 20.681 -20.010 6.444 74 HE1 HIS 11 HE1 HIS 11 19.505 -22.980 3.657 75 HE2 HIS 11 HE2 HIS 11 19.650 -20.508 4.120 76 HA PRO 12 HA PRO 12 19.743 -24.356 12.870 77 HB2 PRO 12 HB3 PRO 12 20.439 -26.919 11.507 78 HB3 PRO 12 HB2 PRO 12 19.324 -26.621 12.848 79 HG2 PRO 12 HG3 PRO 12 18.396 -27.053 10.394 80 HG3 PRO 12 HG2 PRO 12 17.644 -25.840 11.446 81 HD2 PRO 12 HD3 PRO 12 19.462 -25.462 9.111 82 HD3 PRO 12 HD2 PRO 12 18.096 -24.466 9.652 83 HA PRO 13 HA PRO 13 24.230 -23.929 12.742 84 HB2 PRO 13 HB3 PRO 13 24.061 -23.143 15.520 85 HB3 PRO 13 HB2 PRO 13 24.461 -22.152 14.117 86 HG2 PRO 13 HG3 PRO 13 22.157 -21.881 15.574 87 HG3 PRO 13 HG2 PRO 13 22.313 -21.416 13.871 88 HD2 PRO 13 HD3 PRO 13 21.085 -23.873 15.065 89 HD3 PRO 13 HD2 PRO 13 20.556 -22.903 13.672 90 H TRP 14 H TRP 14 23.361 -24.662 16.078 91 HA TRP 14 HA TRP 14 25.022 -27.068 15.909 92 HB2 TRP 14 HB3 TRP 14 25.315 -25.078 17.639 93 HB3 TRP 14 HB2 TRP 14 24.062 -25.952 18.513 94 HD1 TRP 14 HD1 TRP 14 25.028 -27.565 20.238 95 HE1 TRP 14 HE1 TRP 14 27.180 -28.963 20.473 96 HE3 TRP 14 HE3 TRP 14 27.287 -26.315 15.825 97 HZ2 TRP 14 HZ2 TRP 14 29.519 -29.472 18.971 98 HZ3 TRP 14 HZ3 TRP 14 29.478 -27.301 15.299 99 HH2 TRP 14 HH2 TRP 14 30.570 -28.845 16.840 100 H GLU 15 H GLU 15 24.173 -28.684 17.812 101 HA GLU 15 HA GLU 15 21.838 -29.862 16.839 102 HB2 GLU 15 HB3 GLU 15 23.194 -30.200 19.515 103 HB3 GLU 15 HB2 GLU 15 21.874 -31.211 18.948 104 HG2 GLU 15 HG3 GLU 15 23.297 -31.840 16.996 105 HG3 GLU 15 HG2 GLU 15 24.623 -30.964 17.758 106 H GLY 16 H GLY 16 20.012 -28.687 16.780 107 HA2 GLY 16 HA3 GLY 16 18.414 -28.415 19.040 108 HA3 GLY 16 HA2 GLY 16 19.196 -26.864 18.769 109 H GLY 17 H GLY 17 17.068 -26.020 18.422 110 HA2 GLY 17 HA3 GLY 17 16.410 -26.021 15.611 111 HA3 GLY 17 HA2 GLY 17 15.163 -26.738 16.625 112 H ILE 18 H ILE 18 14.002 -24.810 15.590 113 HA ILE 18 HA ILE 18 14.381 -22.519 17.383 114 HB ILE 18 HB ILE 18 13.916 -22.461 14.421 115 HG12 ILE 18 HG13 ILE 18 15.854 -21.154 16.328 116 HG13 ILE 18 HG12 ILE 18 16.213 -22.449 15.187 117 HG21 ILE 18 HG21 ILE 18 13.467 -20.180 16.346 118 HG22 ILE 18 HG22 ILE 18 12.218 -21.007 15.415 119 HG23 ILE 18 HG23 ILE 18 13.457 -20.065 14.585 120 HD11 ILE 18 HD11 ILE 18 15.810 -20.949 13.321 121 HD12 ILE 18 HD12 ILE 18 17.041 -20.293 14.400 122 HD13 ILE 18 HD13 ILE 18 15.400 -19.647 14.437 123 H ARG 19 H ARG 19 12.737 -21.788 18.397 124 HA ARG 19 HA ARG 19 10.157 -23.107 18.087 125 HB2 ARG 19 HB3 ARG 19 11.401 -22.875 20.283 126 HB3 ARG 19 HB2 ARG 19 11.075 -21.153 20.196 127 HG2 ARG 19 HG3 ARG 19 9.415 -22.048 21.611 128 HG3 ARG 19 HG2 ARG 19 8.626 -21.721 20.068 129 HD2 ARG 19 HD3 ARG 19 7.853 -23.843 20.726 130 HD3 ARG 19 HD2 ARG 19 9.069 -24.150 19.488 131 HE ARG 19 HE ARG 19 10.238 -24.197 22.072 132 HH11 ARG 19 HH11 ARG 19 8.197 -26.092 19.950 133 HH12 ARG 19 HH12 ARG 19 8.661 -27.617 20.646 134 HH21 ARG 19 HH21 ARG 19 10.833 -26.184 23.010 135 HH22 ARG 19 HH22 ARG 19 10.170 -27.668 22.393 136 H TYR 20 H TYR 20 8.823 -22.126 16.661 137 HA TYR 20 HA TYR 20 8.893 -19.231 16.364 138 HB2 TYR 20 HB3 TYR 20 7.368 -21.387 14.893 139 HB3 TYR 20 HB2 TYR 20 7.186 -19.668 14.562 140 HD1 TYR 20 HD1 TYR 20 9.417 -22.567 14.281 141 HD2 TYR 20 HD2 TYR 20 8.916 -18.436 13.413 142 HE1 TYR 20 HE1 TYR 20 11.315 -22.667 12.720 143 HE2 TYR 20 HE2 TYR 20 10.813 -18.525 11.854 144 HH TYR 20 HH TYR 20 12.786 -19.875 11.429 145 H ARG 21 H ARG 21 6.330 -18.559 15.815 146 HA ARG 21 HA ARG 21 4.986 -19.059 18.386 147 HB2 ARG 21 HB3 ARG 21 4.968 -16.663 16.564 148 HB3 ARG 21 HB2 ARG 21 3.748 -16.893 17.806 149 HG2 ARG 21 HG3 ARG 21 5.472 -16.876 19.521 150 HG3 ARG 21 HG2 ARG 21 6.715 -16.681 18.280 151 HD2 ARG 21 HD3 ARG 21 5.881 -14.542 17.669 152 HD3 ARG 21 HD2 ARG 21 4.424 -14.765 18.637 153 HE ARG 21 HE ARG 21 6.537 -14.952 20.397 154 HH11 ARG 21 HH11 ARG 21 5.318 -12.543 18.164 155 HH12 ARG 21 HH12 ARG 21 5.803 -11.199 19.157 156 HH21 ARG 21 HH21 ARG 21 7.167 -13.221 21.697 157 HH22 ARG 21 HH22 ARG 21 6.909 -11.585 21.159 158 H GLY 22 H GLY 22 3.622 -17.622 15.482 159 HA2 GLY 22 HA3 GLY 22 1.358 -19.430 15.700 160 HA3 GLY 22 HA2 GLY 22 1.461 -18.003 14.681 161 H LEU 23 H LEU 23 3.511 -20.888 14.915 162 HA LEU 23 HA LEU 23 2.730 -21.637 12.192 163 HB2 LEU 23 HB3 LEU 23 5.564 -21.284 13.177 164 HB3 LEU 23 HB2 LEU 23 5.153 -22.175 11.726 165 HG LEU 23 HG LEU 23 4.560 -19.246 12.159 166 HD11 LEU 23 HD11 LEU 23 6.379 -18.862 10.561 167 HD12 LEU 23 HD12 LEU 23 6.742 -20.588 10.566 168 HD13 LEU 23 HD13 LEU 23 6.955 -19.636 12.036 169 HD21 LEU 23 HD21 LEU 23 3.006 -20.327 10.622 170 HD22 LEU 23 HD22 LEU 23 4.359 -20.990 9.704 171 HD23 LEU 23 HD23 LEU 23 4.096 -19.246 9.754 172 H THR 24 H THR 24 2.376 -23.760 12.000 173 HA THR 24 HA THR 24 3.172 -25.516 14.198 174 HB THR 24 HB THR 24 0.809 -25.585 13.400 175 HG1 THR 24 HG1 THR 24 1.116 -27.512 14.247 176 HG21 THR 24 HG21 THR 24 0.297 -26.676 11.265 177 HG22 THR 24 HG22 THR 24 2.018 -26.725 10.878 178 HG23 THR 24 HG23 THR 24 1.190 -25.174 11.025 179 H ARG 25 H ARG 25 3.600 -27.897 13.180 180 HA ARG 25 HA ARG 25 6.156 -27.566 11.887 181 HB2 ARG 25 HB3 ARG 25 4.689 -29.972 12.954 182 HB3 ARG 25 HB2 ARG 25 6.265 -30.071 12.177 183 HG2 ARG 25 HG3 ARG 25 7.266 -28.723 13.875 184 HG3 ARG 25 HG2 ARG 25 5.692 -28.362 14.585 185 HD2 ARG 25 HD3 ARG 25 6.926 -31.104 14.415 186 HD3 ARG 25 HD2 ARG 25 6.966 -30.064 15.838 187 HE ARG 25 HE ARG 25 4.603 -31.405 14.719 188 HH11 ARG 25 HH11 ARG 25 6.050 -29.408 17.202 189 HH12 ARG 25 HH12 ARG 25 4.748 -29.634 18.333 190 HH21 ARG 25 HH21 ARG 25 2.884 -31.729 16.217 191 HH22 ARG 25 HH22 ARG 25 2.977 -30.986 17.788 192 H ASP 26 H ASP 26 6.398 -29.873 10.376 193 HA ASP 26 HA ASP 26 6.288 -30.516 8.209 194 HB2 ASP 26 HB3 ASP 26 3.955 -31.113 8.629 195 HB3 ASP 26 HB2 ASP 26 3.452 -29.456 8.307 196 H GLN 27 H GLN 27 5.336 -27.302 9.014 197 HA GLN 27 HA GLN 27 6.112 -26.197 6.444 198 HB2 GLN 27 HB3 GLN 27 5.234 -24.904 9.030 199 HB3 GLN 27 HB2 GLN 27 5.535 -24.039 7.531 200 HG2 GLN 27 HG3 GLN 27 3.704 -25.099 6.457 201 HG3 GLN 27 HG2 GLN 27 3.489 -26.220 7.802 202 HE21 GLN 27 HE21 GLN 27 3.871 -24.218 9.852 203 HE22 GLN 27 HE22 GLN 27 2.438 -23.245 9.855 204 H VAL 28 H VAL 28 7.129 -23.787 7.843 205 HA VAL 28 HA VAL 28 9.070 -22.791 8.339 206 HB VAL 28 HB VAL 28 10.239 -23.427 10.286 207 HG11 VAL 28 HG11 VAL 28 8.433 -23.816 11.889 208 HG12 VAL 28 HG12 VAL 28 7.362 -24.257 10.558 209 HG13 VAL 28 HG13 VAL 28 8.007 -22.619 10.666 210 HG21 VAL 28 HG21 VAL 28 9.976 -25.611 11.405 211 HG22 VAL 28 HG22 VAL 28 10.768 -25.736 9.836 212 HG23 VAL 28 HG23 VAL 28 9.074 -26.196 10.005 213 H LYS 29 H LYS 29 9.076 -24.941 6.191 214 HA LYS 29 HA LYS 29 11.974 -25.363 6.070 215 HB2 LYS 29 HB3 LYS 29 9.767 -26.489 4.330 216 HB3 LYS 29 HB2 LYS 29 11.480 -26.845 4.150 217 HG2 LYS 29 HG3 LYS 29 11.522 -27.899 6.328 218 HG3 LYS 29 HG2 LYS 29 9.829 -27.476 6.587 219 HD2 LYS 29 HD3 LYS 29 10.897 -29.305 4.436 220 HD3 LYS 29 HD2 LYS 29 10.062 -29.811 5.907 221 HE2 LYS 29 HE3 LYS 29 8.080 -28.531 5.173 222 HE3 LYS 29 HE2 LYS 29 8.921 -28.135 3.677 223 HZ1 LYS 29 HZ1 LYS 29 7.469 -29.970 3.299 224 HZ2 LYS 29 HZ2 LYS 29 8.115 -30.840 4.603 225 HZ3 LYS 29 HZ3 LYS 29 9.061 -30.545 3.223 226 H ALA 30 H ALA 30 9.568 -24.741 3.525 227 HA ALA 30 HA ALA 30 11.382 -22.719 2.442 228 HB1 ALA 30 HB1 ALA 30 8.998 -23.998 1.117 229 HB2 ALA 30 HB2 ALA 30 10.668 -24.541 0.952 230 HB3 ALA 30 HB3 ALA 30 10.197 -22.949 0.358 231 H ILE 31 H ILE 31 10.915 -21.049 3.828 232 HA ILE 31 HA ILE 31 8.352 -19.706 3.269 233 HB ILE 31 HB ILE 31 9.942 -19.552 5.845 234 HG12 ILE 31 HG13 ILE 31 7.225 -20.771 5.298 235 HG13 ILE 31 HG12 ILE 31 8.704 -21.670 5.616 236 HG21 ILE 31 HG21 ILE 31 8.887 -17.429 5.282 237 HG22 ILE 31 HG22 ILE 31 8.120 -18.171 6.686 238 HG23 ILE 31 HG23 ILE 31 7.330 -18.239 5.110 239 HD11 ILE 31 HD11 ILE 31 7.290 -21.571 7.585 240 HD12 ILE 31 HD12 ILE 31 7.326 -19.808 7.539 241 HD13 ILE 31 HD13 ILE 31 8.806 -20.713 7.855 242 H ASN 32 H ASN 32 8.516 -17.558 2.680 243 HA ASN 32 HA ASN 32 11.079 -16.760 1.679 244 HB2 ASN 32 HB3 ASN 32 8.369 -15.442 1.685 245 HB3 ASN 32 HB2 ASN 32 9.799 -14.630 1.059 246 HD21 ASN 32 HD21 ASN 32 7.547 -17.240 0.590 247 HD22 ASN 32 HD22 ASN 32 7.982 -17.578 -1.051 248 H PHE 33 H PHE 33 8.816 -14.946 3.759 249 HA PHE 33 HA PHE 33 11.078 -14.108 5.407 250 HB2 PHE 33 HB3 PHE 33 9.216 -12.201 3.978 251 HB3 PHE 33 HB2 PHE 33 10.276 -11.727 5.299 252 HD1 PHE 33 HD1 PHE 33 10.002 -12.289 1.772 253 HD2 PHE 33 HD2 PHE 33 12.771 -12.006 4.991 254 HE1 PHE 33 HE1 PHE 33 11.825 -11.899 0.164 255 HE2 PHE 33 HE2 PHE 33 14.597 -11.618 3.388 256 HZ PHE 33 HZ PHE 33 14.124 -11.561 0.971 257 H LEU 34 H LEU 34 10.592 -13.825 7.493 258 HA LEU 34 HA LEU 34 7.928 -14.364 8.459 259 HB2 LEU 34 HB3 LEU 34 10.508 -13.586 9.819 260 HB3 LEU 34 HB2 LEU 34 9.009 -13.777 10.698 261 HG LEU 34 HG LEU 34 10.301 -15.758 10.996 262 HD11 LEU 34 HD11 LEU 34 7.926 -16.110 10.762 263 HD12 LEU 34 HD12 LEU 34 8.821 -17.473 10.089 264 HD13 LEU 34 HD13 LEU 34 8.098 -16.275 9.015 265 HD21 LEU 34 HD21 LEU 34 10.471 -15.944 7.992 266 HD22 LEU 34 HD22 LEU 34 11.033 -17.169 9.130 267 HD23 LEU 34 HD23 LEU 34 11.796 -15.580 9.098 268 HA PRO 35 HA PRO 35 6.409 -10.195 8.502 269 HB2 PRO 35 HB3 PRO 35 4.934 -10.263 10.826 270 HB3 PRO 35 HB2 PRO 35 4.379 -10.903 9.276 271 HG2 PRO 35 HG3 PRO 35 5.594 -12.345 11.597 272 HG3 PRO 35 HG2 PRO 35 4.227 -12.825 10.571 273 HD2 PRO 35 HD3 PRO 35 6.667 -13.884 10.241 274 HD3 PRO 35 HD2 PRO 35 5.615 -13.540 8.852 275 H VAL 36 H VAL 36 6.792 -8.189 9.471 276 HA VAL 36 HA VAL 36 9.110 -7.937 11.033 277 HB VAL 36 HB VAL 36 8.312 -6.140 9.554 278 HG11 VAL 36 HG11 VAL 36 5.922 -6.307 9.970 279 HG12 VAL 36 HG12 VAL 36 6.493 -4.661 10.244 280 HG13 VAL 36 HG13 VAL 36 6.154 -5.717 11.615 281 HG21 VAL 36 HG21 VAL 36 9.889 -5.598 11.322 282 HG22 VAL 36 HG22 VAL 36 8.557 -5.302 12.440 283 HG23 VAL 36 HG23 VAL 36 8.785 -4.252 11.042 284 H ASP 37 H ASP 37 9.451 -7.577 13.167 285 HA ASP 37 HA ASP 37 9.216 -7.978 15.366 286 HB2 ASP 37 HB3 ASP 37 7.668 -6.011 15.254 287 HB3 ASP 37 HB2 ASP 37 6.326 -7.140 15.078 288 H TYR 38 H TYR 38 9.535 -10.158 14.690 289 HA TYR 38 HA TYR 38 7.350 -11.859 15.671 290 HB2 TYR 38 HB3 TYR 38 7.662 -12.000 13.133 291 HB3 TYR 38 HB2 TYR 38 9.252 -12.679 13.457 292 HD1 TYR 38 HD1 TYR 38 9.466 -14.918 14.445 293 HD2 TYR 38 HD2 TYR 38 5.664 -13.284 13.467 294 HE1 TYR 38 HE1 TYR 38 8.471 -17.161 14.595 295 HE2 TYR 38 HE2 TYR 38 4.655 -15.520 13.614 296 HH TYR 38 HH TYR 38 5.406 -17.896 13.414 297 H GLU 39 H GLU 39 8.053 -13.091 17.361 298 HA GLU 39 HA GLU 39 10.947 -13.010 17.839 299 HB2 GLU 39 HB3 GLU 39 8.696 -12.995 19.843 300 HB3 GLU 39 HB2 GLU 39 10.409 -13.057 20.249 301 HG2 GLU 39 HG3 GLU 39 10.777 -10.903 19.252 302 HG3 GLU 39 HG2 GLU 39 9.118 -10.852 18.663 303 H ILE 40 H ILE 40 12.009 -14.806 17.956 304 HA ILE 40 HA ILE 40 10.526 -17.333 18.257 305 HB ILE 40 HB ILE 40 12.336 -18.387 16.939 306 HG12 ILE 40 HG13 ILE 40 13.234 -15.531 16.478 307 HG13 ILE 40 HG12 ILE 40 14.093 -16.727 17.440 308 HG21 ILE 40 HG21 ILE 40 10.273 -17.720 15.850 309 HG22 ILE 40 HG22 ILE 40 11.643 -17.501 14.761 310 HG23 ILE 40 HG23 ILE 40 10.924 -16.106 15.567 311 HD11 ILE 40 HD11 ILE 40 13.576 -16.869 14.482 312 HD12 ILE 40 HD12 ILE 40 14.421 -18.089 15.437 313 HD13 ILE 40 HD13 ILE 40 15.105 -16.471 15.263 314 H GLU 41 H GLU 41 11.921 -19.146 19.050 315 HA GLU 41 HA GLU 41 13.845 -18.213 21.080 316 HB2 GLU 41 HB3 GLU 41 11.749 -18.815 22.160 317 HB3 GLU 41 HB2 GLU 41 11.736 -20.367 21.336 318 HG2 GLU 41 HG3 GLU 41 13.739 -21.034 22.562 319 HG3 GLU 41 HG2 GLU 41 13.754 -19.472 23.381 320 H TYR 42 H TYR 42 15.627 -19.528 21.457 321 HA TYR 42 HA TYR 42 16.191 -21.519 19.390 322 HB2 TYR 42 HB3 TYR 42 17.893 -19.818 21.162 323 HB3 TYR 42 HB2 TYR 42 18.552 -21.329 20.547 324 HD1 TYR 42 HD1 TYR 42 19.280 -21.525 18.306 325 HD2 TYR 42 HD2 TYR 42 17.174 -18.043 19.548 326 HE1 TYR 42 HE1 TYR 42 19.889 -20.414 16.199 327 HE2 TYR 42 HE2 TYR 42 17.771 -16.925 17.442 328 HH TYR 42 HH TYR 42 19.083 -18.594 14.784 329 H VAL 43 H VAL 43 15.441 -23.468 19.995 330 HA VAL 43 HA VAL 43 15.841 -24.326 22.767 331 HB VAL 43 HB VAL 43 14.362 -26.218 22.232 332 HG11 VAL 43 HG11 VAL 43 13.209 -23.534 21.484 333 HG12 VAL 43 HG12 VAL 43 13.430 -24.147 23.123 334 HG13 VAL 43 HG13 VAL 43 12.295 -24.941 22.031 335 HG21 VAL 43 HG21 VAL 43 14.866 -26.463 19.863 336 HG22 VAL 43 HG22 VAL 43 14.103 -24.909 19.524 337 HG23 VAL 43 HG23 VAL 43 13.132 -26.260 20.111 338 H CYS 44 H CYS 44 16.672 -26.463 23.197 339 HA CYS 44 HA CYS 44 18.890 -27.145 21.422 340 HB2 CYS 44 HB3 CYS 44 19.272 -26.865 23.876 341 HB3 CYS 44 HB2 CYS 44 18.201 -28.228 24.164 342 H ARG 45 H ARG 45 19.358 -29.375 21.021 343 HA ARG 45 HA ARG 45 17.342 -30.298 19.352 344 HB2 ARG 45 HB3 ARG 45 19.652 -30.704 18.870 345 HB3 ARG 45 HB2 ARG 45 19.858 -31.614 20.364 346 HG2 ARG 45 HG3 ARG 45 18.172 -33.202 19.493 347 HG3 ARG 45 HG2 ARG 45 18.286 -32.388 17.936 348 HD2 ARG 45 HD3 ARG 45 20.655 -32.893 17.814 349 HD3 ARG 45 HD2 ARG 45 20.603 -33.641 19.411 350 HE ARG 45 HE ARG 45 18.994 -34.716 17.195 351 HH11 ARG 45 HH11 ARG 45 21.545 -35.091 19.560 352 HH12 ARG 45 HH12 ARG 45 21.600 -36.822 19.417 353 HH21 ARG 45 HH21 ARG 45 19.077 -36.959 16.958 354 HH22 ARG 45 HH22 ARG 45 20.201 -37.892 17.906 355 H GLY 46 H GLY 46 15.598 -31.447 19.712 356 HA2 GLY 46 HA3 GLY 46 14.333 -33.244 20.564 357 HA3 GLY 46 HA2 GLY 46 15.522 -33.439 21.849 358 H GLU 47 H GLU 47 14.434 -33.161 23.704 359 HA GLU 47 HA GLU 47 12.960 -30.624 23.967 360 HB2 GLU 47 HB3 GLU 47 12.619 -33.221 25.456 361 HB3 GLU 47 HB2 GLU 47 11.923 -31.706 26.016 362 HG2 GLU 47 HG3 GLU 47 10.844 -31.565 23.705 363 HG3 GLU 47 HG2 GLU 47 11.275 -33.268 23.550 364 H ARG 48 H ARG 48 15.738 -30.758 24.041 365 HA ARG 48 HA ARG 48 16.504 -30.602 26.846 366 HB2 ARG 48 HB3 ARG 48 18.159 -30.009 24.385 367 HB3 ARG 48 HB2 ARG 48 18.757 -30.208 26.023 368 HG2 ARG 48 HG3 ARG 48 17.494 -32.354 24.337 369 HG3 ARG 48 HG2 ARG 48 19.217 -32.158 24.657 370 HD2 ARG 48 HD3 ARG 48 18.625 -32.349 27.116 371 HD3 ARG 48 HD2 ARG 48 17.034 -32.894 26.583 372 HE ARG 48 HE ARG 48 19.366 -34.304 25.532 373 HH11 ARG 48 HH11 ARG 48 16.609 -34.273 27.694 374 HH12 ARG 48 HH12 ARG 48 16.734 -35.965 28.087 375 HH21 ARG 48 HH21 ARG 48 19.547 -36.525 26.062 376 HH22 ARG 48 HH22 ARG 48 18.393 -37.246 27.142 377 H GLU 49 H GLU 49 17.208 -28.664 27.835 378 HA GLU 49 HA GLU 49 16.093 -26.274 26.554 379 HB2 GLU 49 HB3 GLU 49 16.723 -26.766 29.468 380 HB3 GLU 49 HB2 GLU 49 15.977 -25.316 28.808 381 HG2 GLU 49 HG3 GLU 49 14.110 -26.759 27.986 382 HG3 GLU 49 HG2 GLU 49 14.830 -28.092 28.889 383 H VAL 50 H VAL 50 17.203 -24.210 27.108 384 HA VAL 50 HA VAL 50 20.110 -24.517 27.419 385 HB VAL 50 HB VAL 50 20.506 -22.769 25.736 386 HG11 VAL 50 HG11 VAL 50 18.940 -25.123 24.694 387 HG12 VAL 50 HG12 VAL 50 20.678 -25.046 24.987 388 HG13 VAL 50 HG13 VAL 50 19.955 -24.069 23.710 389 HG21 VAL 50 HG21 VAL 50 18.709 -22.064 24.213 390 HG22 VAL 50 HG22 VAL 50 18.395 -21.580 25.880 391 HG23 VAL 50 HG23 VAL 50 17.544 -22.961 25.188 392 H VAL 51 H VAL 51 21.103 -22.858 28.585 393 HA VAL 51 HA VAL 51 19.272 -20.773 29.555 394 HB VAL 51 HB VAL 51 20.136 -21.996 31.419 395 HG11 VAL 51 HG11 VAL 51 22.513 -22.225 31.902 396 HG12 VAL 51 HG12 VAL 51 22.903 -21.437 30.373 397 HG13 VAL 51 HG13 VAL 51 22.087 -23.000 30.376 398 HG21 VAL 51 HG21 VAL 51 21.583 -19.364 31.162 399 HG22 VAL 51 HG22 VAL 51 21.322 -20.244 32.668 400 HG23 VAL 51 HG23 VAL 51 19.945 -19.609 31.768 401 H GLY 52 H GLY 52 19.391 -19.309 28.031 402 HA2 GLY 52 HA3 GLY 52 21.828 -17.766 27.769 403 HA3 GLY 52 HA2 GLY 52 21.256 -18.530 26.290 404 HA PRO 53 HA PRO 53 18.800 -14.589 26.897 405 HB2 PRO 53 HB3 PRO 53 20.000 -13.031 25.029 406 HB3 PRO 53 HB2 PRO 53 20.485 -13.027 26.728 407 HG2 PRO 53 HG3 PRO 53 21.776 -14.340 24.385 408 HG3 PRO 53 HG2 PRO 53 22.522 -13.584 25.803 409 HD2 PRO 53 HD3 PRO 53 22.209 -16.304 25.443 410 HD3 PRO 53 HD2 PRO 53 22.414 -15.511 27.019 411 H LYS 54 H LYS 54 17.691 -16.568 25.892 412 HA LYS 54 HA LYS 54 17.785 -16.740 23.010 413 HB2 LYS 54 HB3 LYS 54 16.070 -18.584 23.398 414 HB3 LYS 54 HB2 LYS 54 17.675 -18.844 24.063 415 HG2 LYS 54 HG3 LYS 54 16.949 -18.450 26.261 416 HG3 LYS 54 HG2 LYS 54 15.438 -17.720 25.720 417 HD2 LYS 54 HD3 LYS 54 14.736 -19.911 24.822 418 HD3 LYS 54 HD2 LYS 54 16.223 -20.620 25.457 419 HE2 LYS 54 HE3 LYS 54 15.562 -20.284 27.682 420 HE3 LYS 54 HE2 LYS 54 14.306 -19.134 27.224 421 HZ1 LYS 54 HZ1 LYS 54 13.058 -20.911 26.216 422 HZ2 LYS 54 HZ2 LYS 54 13.383 -21.289 27.839 423 HZ3 LYS 54 HZ3 LYS 54 14.269 -22.038 26.598 424 H VAL 55 H VAL 55 16.943 -14.732 22.440 425 HA VAL 55 HA VAL 55 14.127 -14.881 21.940 426 HB VAL 55 HB VAL 55 14.041 -13.779 24.121 427 HG11 VAL 55 HG11 VAL 55 15.041 -11.550 24.460 428 HG12 VAL 55 HG12 VAL 55 15.862 -11.704 22.907 429 HG13 VAL 55 HG13 VAL 55 16.252 -12.810 24.224 430 HG21 VAL 55 HG21 VAL 55 12.820 -11.746 23.480 431 HG22 VAL 55 HG22 VAL 55 12.390 -13.125 22.469 432 HG23 VAL 55 HG23 VAL 55 13.472 -11.880 21.847 433 H ARG 56 H ARG 56 13.753 -14.087 19.964 434 HA ARG 56 HA ARG 56 15.719 -12.233 18.808 435 HB2 ARG 56 HB3 ARG 56 14.685 -14.789 17.571 436 HB3 ARG 56 HB2 ARG 56 15.533 -13.543 16.665 437 HG2 ARG 56 HG3 ARG 56 16.687 -14.984 19.037 438 HG3 ARG 56 HG2 ARG 56 16.949 -15.461 17.357 439 HD2 ARG 56 HD3 ARG 56 17.925 -13.261 16.898 440 HD3 ARG 56 HD2 ARG 56 17.681 -12.806 18.584 441 HE ARG 56 HE ARG 56 19.513 -14.049 19.168 442 HH11 ARG 56 HH11 ARG 56 18.558 -14.827 15.900 443 HH12 ARG 56 HH12 ARG 56 20.001 -15.713 15.536 444 HH21 ARG 56 HH21 ARG 56 21.447 -15.186 18.702 445 HH22 ARG 56 HH22 ARG 56 21.652 -15.917 17.138 446 H LYS 57 H LYS 57 14.583 -10.454 18.409 447 HA LYS 57 HA LYS 57 11.831 -10.718 17.448 448 HB2 LYS 57 HB3 LYS 57 12.205 -9.160 19.306 449 HB3 LYS 57 HB2 LYS 57 13.382 -8.275 18.346 450 HG2 LYS 57 HG3 LYS 57 11.584 -7.716 16.737 451 HG3 LYS 57 HG2 LYS 57 10.428 -8.504 17.810 452 HD2 LYS 57 HD3 LYS 57 12.206 -6.232 18.669 453 HD3 LYS 57 HD2 LYS 57 10.583 -5.996 18.026 454 HE2 LYS 57 HE3 LYS 57 11.245 -7.654 20.456 455 HE3 LYS 57 HE2 LYS 57 10.690 -5.983 20.508 456 HZ1 LYS 57 HZ1 LYS 57 9.198 -8.363 19.578 457 HZ2 LYS 57 HZ2 LYS 57 8.682 -6.788 19.244 458 HZ3 LYS 57 HZ3 LYS 57 8.806 -7.323 20.854 459 H CYS 58 H CYS 58 11.516 -10.764 15.349 460 HA CYS 58 HA CYS 58 13.436 -10.156 13.400 461 HB2 CYS 58 HB3 CYS 58 11.511 -11.653 13.014 462 HB3 CYS 58 HB2 CYS 58 10.427 -10.268 13.092 463 H LEU 59 H LEU 59 13.959 -8.366 12.314 464 HA LEU 59 HA LEU 59 12.741 -5.860 13.218 465 HB2 LEU 59 HB3 LEU 59 15.314 -6.355 11.709 466 HB3 LEU 59 HB2 LEU 59 14.757 -4.796 12.284 467 HG LEU 59 HG LEU 59 15.509 -7.138 14.034 468 HD11 LEU 59 HD11 LEU 59 16.934 -4.546 13.470 469 HD12 LEU 59 HD12 LEU 59 17.445 -6.156 12.963 470 HD13 LEU 59 HD13 LEU 59 17.416 -5.739 14.676 471 HD21 LEU 59 HD21 LEU 59 13.760 -5.795 15.052 472 HD22 LEU 59 HD22 LEU 59 14.683 -4.324 14.743 473 HD23 LEU 59 HD23 LEU 59 15.295 -5.527 15.877 474 H ALA 60 H ALA 60 13.059 -4.096 11.335 475 HA ALA 60 HA ALA 60 11.238 -4.887 9.257 476 HB1 ALA 60 HB1 ALA 60 11.097 -2.675 10.274 477 HB2 ALA 60 HB2 ALA 60 11.385 -2.553 8.539 478 HB3 ALA 60 HB3 ALA 60 12.709 -2.286 9.672 479 H ASN 61 H ASN 61 14.464 -5.324 9.616 480 HA ASN 61 HA ASN 61 14.914 -5.332 6.707 481 HB2 ASN 61 HB3 ASN 61 17.288 -4.968 7.111 482 HB3 ASN 61 HB2 ASN 61 16.358 -3.679 7.865 483 HD21 ASN 61 HD21 ASN 61 18.537 -6.286 8.345 484 HD22 ASN 61 HD22 ASN 61 18.753 -6.068 10.055 485 H GLY 62 H GLY 62 16.715 -7.007 6.159 486 HA2 GLY 62 HA3 GLY 62 15.610 -9.523 6.963 487 HA3 GLY 62 HA2 GLY 62 16.921 -9.275 5.822 488 H SER 63 H SER 63 16.370 -8.827 9.316 489 HA SER 63 HA SER 63 18.221 -10.842 10.046 490 HB2 SER 63 HB3 SER 63 19.850 -9.105 9.328 491 HB3 SER 63 HB2 SER 63 19.161 -7.999 10.516 492 HG SER 63 HG SER 63 20.793 -8.894 11.605 493 H TRP 64 H TRP 64 18.483 -10.927 12.418 494 HA TRP 64 HA TRP 64 15.995 -10.024 13.667 495 HB2 TRP 64 HB3 TRP 64 17.970 -12.141 14.566 496 HB3 TRP 64 HB2 TRP 64 16.415 -11.797 15.316 497 HD1 TRP 64 HD1 TRP 64 17.858 -13.193 12.009 498 HE1 TRP 64 HE1 TRP 64 16.089 -14.726 10.932 499 HE3 TRP 64 HE3 TRP 64 14.000 -12.406 15.277 500 HZ2 TRP 64 HZ2 TRP 64 13.416 -15.505 11.411 501 HZ3 TRP 64 HZ3 TRP 64 11.876 -13.585 14.894 502 HH2 TRP 64 HH2 TRP 64 11.592 -15.101 13.002 503 H THR 65 H THR 65 16.358 -9.713 16.197 504 HA THR 65 HA THR 65 17.523 -7.262 16.532 505 HB THR 65 HB THR 65 17.626 -8.126 19.064 506 HG1 THR 65 HG1 THR 65 16.979 -10.138 19.144 507 HG21 THR 65 HG21 THR 65 15.229 -7.537 19.237 508 HG22 THR 65 HG22 THR 65 15.116 -7.575 17.477 509 HG23 THR 65 HG23 THR 65 16.144 -6.381 18.270 510 H ASP 66 H ASP 66 18.894 -10.020 18.320 511 HA ASP 66 HA ASP 66 21.582 -8.990 17.655 512 HB2 ASP 66 HB3 ASP 66 21.078 -8.834 20.075 513 HB3 ASP 66 HB2 ASP 66 20.713 -10.552 20.106 514 H MET 67 H MET 67 22.013 -10.271 15.826 515 HA MET 67 HA MET 67 21.445 -13.133 16.102 516 HB2 MET 67 HB3 MET 67 20.750 -12.082 14.031 517 HB3 MET 67 HB2 MET 67 22.360 -11.437 13.767 518 HG2 MET 67 HG3 MET 67 22.020 -13.265 12.292 519 HG3 MET 67 HG2 MET 67 23.196 -13.745 13.509 520 HE1 MET 67 HE1 MET 67 21.526 -15.617 11.478 521 HE2 MET 67 HE2 MET 67 21.152 -16.994 12.516 522 HE3 MET 67 HE3 MET 67 22.757 -16.264 12.564 523 H ASP 68 H ASP 68 23.178 -12.988 17.850 524 HA ASP 68 HA ASP 68 24.948 -14.917 16.837 525 HB2 ASP 68 HB3 ASP 68 26.316 -12.872 16.296 526 HB3 ASP 68 HB2 ASP 68 26.377 -12.529 18.026 527 H THR 69 H THR 69 24.178 -16.327 18.401 528 HA THR 69 HA THR 69 24.590 -15.488 21.172 529 HB THR 69 HB THR 69 21.916 -16.644 20.420 530 HG1 THR 69 HG1 THR 69 22.816 -13.953 20.292 531 HG21 THR 69 HG21 THR 69 22.603 -16.682 22.783 532 HG22 THR 69 HG22 THR 69 21.229 -15.606 22.518 533 HG23 THR 69 HG23 THR 69 22.846 -14.935 22.728 534 HA PRO 70 HA PRO 70 25.752 -19.846 21.067 535 HB2 PRO 70 HB3 PRO 70 27.401 -19.733 23.203 536 HB3 PRO 70 HB2 PRO 70 27.894 -19.185 21.597 537 HG2 PRO 70 HG3 PRO 70 27.040 -17.589 23.967 538 HG3 PRO 70 HG2 PRO 70 28.285 -17.230 22.758 539 HD2 PRO 70 HD3 PRO 70 25.743 -16.144 22.776 540 HD3 PRO 70 HD2 PRO 70 26.787 -16.251 21.347 541 H SER 71 H SER 71 23.689 -20.593 21.645 542 HA SER 71 HA SER 71 22.765 -20.360 24.360 543 HB2 SER 71 HB3 SER 71 20.909 -21.847 23.524 544 HB3 SER 71 HB2 SER 71 21.105 -20.349 22.613 545 HG SER 71 HG SER 71 22.275 -22.820 21.851 546 H ARG 72 H ARG 72 23.819 -21.499 25.869 547 HA ARG 72 HA ARG 72 25.064 -24.018 25.267 548 HB2 ARG 72 HB3 ARG 72 25.669 -24.016 27.688 549 HB3 ARG 72 HB2 ARG 72 26.183 -22.573 26.829 550 HG2 ARG 72 HG3 ARG 72 24.283 -21.345 27.748 551 HG3 ARG 72 HG2 ARG 72 23.765 -22.794 28.611 552 HD2 ARG 72 HD3 ARG 72 24.960 -21.333 30.117 553 HD3 ARG 72 HD2 ARG 72 25.908 -22.791 29.835 554 HE ARG 72 HE ARG 72 27.095 -21.296 28.096 555 HH11 ARG 72 HH11 ARG 72 25.845 -20.257 31.204 556 HH12 ARG 72 HH12 ARG 72 26.963 -18.938 31.355 557 HH21 ARG 72 HH21 ARG 72 28.582 -19.583 28.301 558 HH22 ARG 72 HH22 ARG 72 28.514 -18.534 29.685 559 H CYS 73 H CYS 73 24.122 -25.901 25.279 560 HA CYS 73 HA CYS 73 21.408 -26.217 26.109 561 HB2 CYS 73 HB3 CYS 73 22.505 -27.394 24.171 562 HB3 CYS 73 HB2 CYS 73 23.385 -28.370 25.340 563 H VAL 74 H VAL 74 20.829 -26.391 28.157 564 HA VAL 74 HA VAL 74 22.522 -27.918 30.007 565 HB VAL 74 HB VAL 74 21.386 -25.165 30.547 566 HG11 VAL 74 HG11 VAL 74 22.435 -25.341 32.751 567 HG12 VAL 74 HG12 VAL 74 22.906 -27.003 32.396 568 HG13 VAL 74 HG13 VAL 74 21.198 -26.579 32.526 569 HG21 VAL 74 HG21 VAL 74 23.415 -25.083 29.225 570 HG22 VAL 74 HG22 VAL 74 24.234 -26.136 30.377 571 HG23 VAL 74 HG23 VAL 74 23.737 -24.515 30.864 572 H ARG 75 H ARG 75 21.357 -29.356 31.108 573 HA ARG 75 HA ARG 75 18.643 -28.737 31.903 574 HB2 ARG 75 HB3 ARG 75 17.860 -31.012 31.076 575 HB3 ARG 75 HB2 ARG 75 18.093 -29.772 29.857 576 HG2 ARG 75 HG3 ARG 75 19.389 -31.163 28.730 577 HG3 ARG 75 HG2 ARG 75 20.536 -31.158 30.071 578 HD2 ARG 75 HD3 ARG 75 18.118 -32.945 30.030 579 HD3 ARG 75 HD2 ARG 75 19.652 -33.420 29.301 580 HE ARG 75 HE ARG 75 20.631 -33.080 31.569 581 HH11 ARG 75 HH11 ARG 75 17.211 -33.739 31.229 582 HH12 ARG 75 HH12 ARG 75 17.070 -34.495 32.784 583 HH21 ARG 75 HH21 ARG 75 20.450 -34.067 33.611 584 HH22 ARG 75 HH22 ARG 75 18.908 -34.669 34.145 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 10.815 0.191 -2.916 2 H2 GLY 1 HT2 GLY 1 9.551 1.315 -2.982 3 H3 GLY 1 HT3 GLY 1 10.689 1.250 -4.238 4 HA2 GLY 1 HA2 GLY 1 8.697 0.210 -4.996 5 HA3 GLY 1 HA3 GLY 1 9.939 -1.017 -4.773 6 HA PRO 2 HA PRO 2 6.329 -2.703 -2.517 7 HB2 PRO 2 HB3 PRO 2 7.677 -5.255 -3.040 8 HB3 PRO 2 HB2 PRO 2 6.043 -4.744 -3.474 9 HG2 PRO 2 HG3 PRO 2 7.993 -5.057 -5.315 10 HG3 PRO 2 HG2 PRO 2 6.721 -3.834 -5.480 11 HD2 PRO 2 HD3 PRO 2 9.558 -3.511 -4.579 12 HD3 PRO 2 HD2 PRO 2 8.584 -2.463 -5.634 13 H THR 3 H THR 3 7.049 -1.891 -0.551 14 HA THR 3 HA THR 3 9.412 -2.904 0.710 15 HB THR 3 HB THR 3 8.404 -1.516 2.677 16 HG1 THR 3 HG1 THR 3 6.386 -1.019 2.116 17 HG21 THR 3 HG21 THR 3 9.241 -0.210 0.079 18 HG22 THR 3 HG22 THR 3 10.328 -0.816 1.330 19 HG23 THR 3 HG23 THR 3 9.270 0.553 1.671 20 H SER 4 H SER 4 9.248 -5.019 1.207 21 HA SER 4 HA SER 4 7.146 -5.754 3.131 22 HB2 SER 4 HB3 SER 4 8.620 -7.576 1.206 23 HB3 SER 4 HB2 SER 4 7.381 -8.076 2.359 24 HG SER 4 HG SER 4 7.063 -6.335 0.140 25 H GLU 5 H GLU 5 8.126 -5.428 5.040 26 HA GLU 5 HA GLU 5 10.927 -6.023 5.383 27 HB2 GLU 5 HB3 GLU 5 8.889 -5.061 7.395 28 HB3 GLU 5 HB2 GLU 5 10.630 -5.132 7.647 29 HG2 GLU 5 HG3 GLU 5 9.098 -3.354 5.772 30 HG3 GLU 5 HG2 GLU 5 10.106 -2.886 7.141 31 H GLY 6 H GLY 6 11.525 -8.038 5.637 32 HA2 GLY 6 HA3 GLY 6 10.212 -9.670 7.660 33 HA3 GLY 6 HA2 GLY 6 10.193 -10.292 6.016 34 H CYS 7 H CYS 7 11.506 -11.124 8.595 35 HA CYS 7 HA CYS 7 14.326 -11.033 7.908 36 HB2 CYS 7 HB3 CYS 7 12.951 -12.487 10.178 37 HB3 CYS 7 HB2 CYS 7 14.670 -12.129 10.040 38 H GLN 8 H GLN 8 15.585 -12.989 7.648 39 HA GLN 8 HA GLN 8 14.149 -14.894 5.997 40 HB2 GLN 8 HB3 GLN 8 16.400 -15.746 5.437 41 HB3 GLN 8 HB2 GLN 8 16.222 -14.029 5.115 42 HG2 GLN 8 HG3 GLN 8 17.593 -13.420 6.885 43 HG3 GLN 8 HG2 GLN 8 17.383 -14.965 7.705 44 HE21 GLN 8 HE21 GLN 8 17.892 -16.593 5.403 45 HE22 GLN 8 HE22 GLN 8 19.579 -16.484 5.064 46 H ILE 9 H ILE 9 15.120 -17.219 6.126 47 HA ILE 9 HA ILE 9 14.569 -18.214 8.801 48 HB ILE 9 HB ILE 9 15.129 -19.678 6.210 49 HG12 ILE 9 HG13 ILE 9 12.541 -19.240 7.718 50 HG13 ILE 9 HG12 ILE 9 13.002 -18.443 6.216 51 HG21 ILE 9 HG21 ILE 9 14.333 -21.689 7.380 52 HG22 ILE 9 HG22 ILE 9 14.252 -20.767 8.882 53 HG23 ILE 9 HG23 ILE 9 15.807 -21.036 8.094 54 HD11 ILE 9 HD11 ILE 9 11.438 -20.261 5.822 55 HD12 ILE 9 HD12 ILE 9 12.556 -21.398 6.576 56 HD13 ILE 9 HD13 ILE 9 12.998 -20.591 5.072 57 H ILE 10 H ILE 10 16.128 -18.539 10.215 58 HA ILE 10 HA ILE 10 18.887 -18.253 9.566 59 HB ILE 10 HB ILE 10 17.697 -19.294 12.146 60 HG12 ILE 10 HG13 ILE 10 18.327 -16.433 11.384 61 HG13 ILE 10 HG12 ILE 10 16.706 -17.118 11.459 62 HG21 ILE 10 HG21 ILE 10 20.092 -19.644 11.968 63 HG22 ILE 10 HG22 ILE 10 19.747 -18.389 13.158 64 HG23 ILE 10 HG23 ILE 10 20.332 -17.947 11.554 65 HD11 ILE 10 HD11 ILE 10 17.236 -15.808 13.443 66 HD12 ILE 10 HD12 ILE 10 18.611 -16.862 13.777 67 HD13 ILE 10 HD13 ILE 10 16.969 -17.504 13.844 68 H HIS 11 H HIS 11 20.506 -19.788 9.513 69 HA HIS 11 HA HIS 11 19.747 -22.536 9.045 70 HB2 HIS 11 HB3 HIS 11 22.416 -21.122 9.098 71 HB3 HIS 11 HB2 HIS 11 22.269 -22.858 8.860 72 HD1 HIS 11 HD1 HIS 11 21.379 -23.677 6.582 73 HD2 HIS 11 HD2 HIS 11 21.691 -19.540 6.901 74 HE1 HIS 11 HE1 HIS 11 21.176 -22.795 4.234 75 HE2 HIS 11 HE2 HIS 11 21.609 -20.321 4.433 76 HA PRO 12 HA PRO 12 20.257 -23.830 13.288 77 HB2 PRO 12 HB3 PRO 12 20.893 -26.473 12.129 78 HB3 PRO 12 HB2 PRO 12 19.599 -26.016 13.242 79 HG2 PRO 12 HG3 PRO 12 19.076 -26.603 10.683 80 HG3 PRO 12 HG2 PRO 12 18.195 -25.321 11.534 81 HD2 PRO 12 HD3 PRO 12 20.453 -25.091 9.577 82 HD3 PRO 12 HD2 PRO 12 18.972 -24.117 9.710 83 HA PRO 13 HA PRO 13 24.741 -23.428 13.261 84 HB2 PRO 13 HB3 PRO 13 24.981 -23.085 15.962 85 HB3 PRO 13 HB2 PRO 13 24.551 -21.787 14.844 86 HG2 PRO 13 HG3 PRO 13 22.783 -23.448 16.592 87 HG3 PRO 13 HG2 PRO 13 22.706 -21.709 16.251 88 HD2 PRO 13 HD3 PRO 13 21.068 -23.501 15.059 89 HD3 PRO 13 HD2 PRO 13 21.626 -22.028 14.239 90 H TRP 14 H TRP 14 24.134 -24.755 16.431 91 HA TRP 14 HA TRP 14 25.381 -27.275 15.608 92 HB2 TRP 14 HB3 TRP 14 26.222 -25.815 17.616 93 HB3 TRP 14 HB2 TRP 14 24.863 -26.539 18.474 94 HD1 TRP 14 HD1 TRP 14 25.591 -28.590 19.820 95 HE1 TRP 14 HE1 TRP 14 27.335 -30.463 19.543 96 HE3 TRP 14 HE3 TRP 14 27.623 -27.156 15.352 97 HZ2 TRP 14 HZ2 TRP 14 29.308 -31.234 17.673 98 HZ3 TRP 14 HZ3 TRP 14 29.431 -28.518 14.387 99 HH2 TRP 14 HH2 TRP 14 30.253 -30.514 15.526 100 H GLU 15 H GLU 15 24.435 -29.116 17.255 101 HA GLU 15 HA GLU 15 21.947 -29.833 16.328 102 HB2 GLU 15 HB3 GLU 15 23.406 -30.613 18.837 103 HB3 GLU 15 HB2 GLU 15 21.834 -31.291 18.432 104 HG2 GLU 15 HG3 GLU 15 22.859 -31.993 16.228 105 HG3 GLU 15 HG2 GLU 15 24.421 -31.573 16.937 106 H GLY 16 H GLY 16 20.309 -28.442 16.403 107 HA2 GLY 16 HA3 GLY 16 18.832 -28.205 18.824 108 HA3 GLY 16 HA2 GLY 16 19.589 -26.674 18.397 109 H GLY 17 H GLY 17 17.645 -25.635 17.975 110 HA2 GLY 17 HA3 GLY 17 16.781 -25.762 15.296 111 HA3 GLY 17 HA2 GLY 17 15.605 -26.586 16.314 112 H ILE 18 H ILE 18 14.294 -24.731 15.358 113 HA ILE 18 HA ILE 18 14.566 -22.426 17.150 114 HB ILE 18 HB ILE 18 13.899 -22.441 14.221 115 HG12 ILE 18 HG13 ILE 18 15.817 -20.891 15.963 116 HG13 ILE 18 HG12 ILE 18 16.238 -22.217 14.881 117 HG21 ILE 18 HG21 ILE 18 13.276 -20.068 14.429 118 HG22 ILE 18 HG22 ILE 18 13.359 -20.214 16.185 119 HG23 ILE 18 HG23 ILE 18 12.151 -21.126 15.282 120 HD11 ILE 18 HD11 ILE 18 16.838 -20.084 13.906 121 HD12 ILE 18 HD12 ILE 18 15.171 -19.526 14.046 122 HD13 ILE 18 HD13 ILE 18 15.568 -20.857 12.958 123 H ARG 19 H ARG 19 12.900 -21.840 18.252 124 HA ARG 19 HA ARG 19 10.385 -23.313 17.985 125 HB2 ARG 19 HB3 ARG 19 11.790 -22.956 20.151 126 HB3 ARG 19 HB2 ARG 19 11.087 -21.348 20.143 127 HG2 ARG 19 HG3 ARG 19 9.815 -22.776 21.595 128 HG3 ARG 19 HG2 ARG 19 8.838 -22.346 20.189 129 HD2 ARG 19 HD3 ARG 19 8.919 -24.470 19.314 130 HD3 ARG 19 HD2 ARG 19 10.442 -24.856 20.116 131 HE ARG 19 HE ARG 19 8.878 -24.689 22.225 132 HH11 ARG 19 HH11 ARG 19 8.169 -26.148 19.125 133 HH12 ARG 19 HH12 ARG 19 7.150 -27.387 19.792 134 HH21 ARG 19 HH21 ARG 19 7.516 -26.302 23.104 135 HH22 ARG 19 HH22 ARG 19 6.757 -27.450 22.042 136 H TYR 20 H TYR 20 8.514 -22.272 17.363 137 HA TYR 20 HA TYR 20 8.961 -19.535 16.431 138 HB2 TYR 20 HB3 TYR 20 7.086 -21.687 15.455 139 HB3 TYR 20 HB2 TYR 20 7.060 -20.027 14.859 140 HD1 TYR 20 HD1 TYR 20 8.819 -23.217 14.788 141 HD2 TYR 20 HD2 TYR 20 8.977 -19.140 13.580 142 HE1 TYR 20 HE1 TYR 20 10.619 -23.764 13.202 143 HE2 TYR 20 HE2 TYR 20 10.771 -19.676 11.983 144 HH TYR 20 HH TYR 20 11.602 -22.874 11.146 145 H ARG 21 H ARG 21 6.394 -18.747 15.958 146 HA ARG 21 HA ARG 21 5.547 -18.254 18.739 147 HB2 ARG 21 HB3 ARG 21 6.673 -16.415 17.348 148 HB3 ARG 21 HB2 ARG 21 5.197 -16.388 16.401 149 HG2 ARG 21 HG3 ARG 21 3.935 -15.802 18.430 150 HG3 ARG 21 HG2 ARG 21 5.455 -15.764 19.335 151 HD2 ARG 21 HD3 ARG 21 6.282 -14.100 17.627 152 HD3 ARG 21 HD2 ARG 21 4.630 -14.013 17.027 153 HE ARG 21 HE ARG 21 4.985 -13.472 19.861 154 HH11 ARG 21 HH11 ARG 21 4.632 -12.216 16.618 155 HH12 ARG 21 HH12 ARG 21 4.289 -10.595 17.136 156 HH21 ARG 21 HH21 ARG 21 4.507 -11.336 20.556 157 HH22 ARG 21 HH22 ARG 21 4.203 -10.095 19.376 158 H GLY 22 H GLY 22 4.458 -18.514 15.387 159 HA2 GLY 22 HA3 GLY 22 1.899 -19.577 16.313 160 HA3 GLY 22 HA2 GLY 22 1.852 -18.126 15.323 161 H LEU 23 H LEU 23 4.046 -20.877 15.037 162 HA LEU 23 HA LEU 23 2.817 -21.465 12.429 163 HB2 LEU 23 HB3 LEU 23 5.740 -21.455 13.171 164 HB3 LEU 23 HB2 LEU 23 5.123 -22.205 11.712 165 HG LEU 23 HG LEU 23 4.892 -19.270 12.386 166 HD11 LEU 23 HD11 LEU 23 6.529 -18.956 10.593 167 HD12 LEU 23 HD12 LEU 23 6.683 -20.705 10.431 168 HD13 LEU 23 HD13 LEU 23 7.191 -19.909 11.920 169 HD21 LEU 23 HD21 LEU 23 4.114 -19.024 10.090 170 HD22 LEU 23 HD22 LEU 23 3.045 -20.090 11.003 171 HD23 LEU 23 HD23 LEU 23 4.205 -20.771 9.861 172 H THR 24 H THR 24 2.180 -23.482 12.131 173 HA THR 24 HA THR 24 2.784 -25.456 14.183 174 HB THR 24 HB THR 24 0.436 -25.102 13.366 175 HG1 THR 24 HG1 THR 24 1.191 -27.094 14.357 176 HG21 THR 24 HG21 THR 24 -0.232 -26.089 11.241 177 HG22 THR 24 HG22 THR 24 1.446 -26.501 10.888 178 HG23 THR 24 HG23 THR 24 0.952 -24.809 10.976 179 H ARG 25 H ARG 25 2.824 -27.832 13.000 180 HA ARG 25 HA ARG 25 5.477 -27.866 11.936 181 HB2 ARG 25 HB3 ARG 25 5.132 -30.337 11.878 182 HB3 ARG 25 HB2 ARG 25 4.830 -29.606 13.450 183 HG2 ARG 25 HG3 ARG 25 2.467 -29.767 13.147 184 HG3 ARG 25 HG2 ARG 25 2.665 -30.271 11.466 185 HD2 ARG 25 HD3 ARG 25 3.635 -31.820 13.867 186 HD3 ARG 25 HD2 ARG 25 2.140 -32.144 12.991 187 HE ARG 25 HE ARG 25 4.699 -32.212 11.546 188 HH11 ARG 25 HH11 ARG 25 1.899 -33.879 12.824 189 HH12 ARG 25 HH12 ARG 25 2.156 -35.316 11.882 190 HH21 ARG 25 HH21 ARG 25 5.053 -34.108 10.321 191 HH22 ARG 25 HH22 ARG 25 3.962 -35.449 10.467 192 H ASP 26 H ASP 26 5.612 -29.875 10.175 193 HA ASP 26 HA ASP 26 5.786 -30.190 7.944 194 HB2 ASP 26 HB3 ASP 26 3.413 -30.936 8.345 195 HB3 ASP 26 HB2 ASP 26 2.887 -29.350 7.787 196 H GLN 27 H GLN 27 5.886 -27.347 9.135 197 HA GLN 27 HA GLN 27 5.935 -25.949 6.552 198 HB2 GLN 27 HB3 GLN 27 5.147 -24.864 9.267 199 HB3 GLN 27 HB2 GLN 27 5.429 -23.858 7.854 200 HG2 GLN 27 HG3 GLN 27 3.592 -24.926 6.692 201 HG3 GLN 27 HG2 GLN 27 3.337 -26.014 8.055 202 HE21 GLN 27 HE21 GLN 27 3.809 -23.971 10.057 203 HE22 GLN 27 HE22 GLN 27 2.414 -22.941 10.047 204 H VAL 28 H VAL 28 7.137 -23.638 7.444 205 HA VAL 28 HA VAL 28 9.096 -22.631 7.867 206 HB VAL 28 HB VAL 28 10.156 -22.950 9.930 207 HG11 VAL 28 HG11 VAL 28 8.291 -23.158 11.522 208 HG12 VAL 28 HG12 VAL 28 7.275 -23.772 10.216 209 HG13 VAL 28 HG13 VAL 28 7.910 -22.128 10.144 210 HG21 VAL 28 HG21 VAL 28 10.692 -25.327 9.784 211 HG22 VAL 28 HG22 VAL 28 9.005 -25.736 10.092 212 HG23 VAL 28 HG23 VAL 28 9.962 -24.936 11.339 213 H LYS 29 H LYS 29 9.053 -25.264 6.215 214 HA LYS 29 HA LYS 29 11.932 -25.765 6.229 215 HB2 LYS 29 HB3 LYS 29 11.363 -27.523 4.521 216 HB3 LYS 29 HB2 LYS 29 10.661 -27.779 6.111 217 HG2 LYS 29 HG3 LYS 29 8.523 -26.923 5.312 218 HG3 LYS 29 HG2 LYS 29 9.228 -26.644 3.718 219 HD2 LYS 29 HD3 LYS 29 9.654 -29.020 3.460 220 HD3 LYS 29 HD2 LYS 29 9.046 -29.328 5.087 221 HE2 LYS 29 HE3 LYS 29 6.836 -28.513 4.411 222 HE3 LYS 29 HE2 LYS 29 7.447 -28.217 2.782 223 HZ1 LYS 29 HZ1 LYS 29 7.796 -30.525 2.453 224 HZ2 LYS 29 HZ2 LYS 29 6.225 -30.358 3.074 225 HZ3 LYS 29 HZ3 LYS 29 7.484 -30.883 4.077 226 H ALA 30 H ALA 30 9.423 -24.216 4.420 227 HA ALA 30 HA ALA 30 11.439 -22.889 2.804 228 HB1 ALA 30 HB1 ALA 30 10.763 -24.817 1.440 229 HB2 ALA 30 HB2 ALA 30 10.291 -23.285 0.704 230 HB3 ALA 30 HB3 ALA 30 9.086 -24.276 1.525 231 H ILE 31 H ILE 31 10.988 -21.001 3.815 232 HA ILE 31 HA ILE 31 8.395 -19.774 3.168 233 HB ILE 31 HB ILE 31 9.878 -19.394 5.789 234 HG12 ILE 31 HG13 ILE 31 7.226 -20.734 5.225 235 HG13 ILE 31 HG12 ILE 31 8.716 -21.564 5.661 236 HG21 ILE 31 HG21 ILE 31 8.785 -17.350 5.070 237 HG22 ILE 31 HG22 ILE 31 7.929 -18.045 6.447 238 HG23 ILE 31 HG23 ILE 31 7.272 -18.223 4.820 239 HD11 ILE 31 HD11 ILE 31 7.216 -21.376 7.563 240 HD12 ILE 31 HD12 ILE 31 7.206 -19.620 7.396 241 HD13 ILE 31 HD13 ILE 31 8.695 -20.457 7.835 242 H ASN 32 H ASN 32 8.536 -17.524 2.693 243 HA ASN 32 HA ASN 32 11.071 -16.778 1.572 244 HB2 ASN 32 HB3 ASN 32 8.636 -15.006 1.852 245 HB3 ASN 32 HB2 ASN 32 9.967 -14.824 0.716 246 HD21 ASN 32 HD21 ASN 32 6.947 -16.272 1.350 247 HD22 ASN 32 HD22 ASN 32 6.785 -17.131 -0.148 248 H PHE 33 H PHE 33 8.934 -15.007 3.795 249 HA PHE 33 HA PHE 33 11.258 -14.247 5.401 250 HB2 PHE 33 HB3 PHE 33 9.310 -12.255 4.212 251 HB3 PHE 33 HB2 PHE 33 10.555 -11.876 5.395 252 HD1 PHE 33 HD1 PHE 33 9.775 -12.165 1.937 253 HD2 PHE 33 HD2 PHE 33 12.983 -12.307 4.730 254 HE1 PHE 33 HE1 PHE 33 11.376 -11.748 0.117 255 HE2 PHE 33 HE2 PHE 33 14.591 -11.894 2.916 256 HZ PHE 33 HZ PHE 33 13.789 -11.617 0.602 257 H LEU 34 H LEU 34 10.774 -13.690 7.522 258 HA LEU 34 HA LEU 34 8.108 -14.420 8.448 259 HB2 LEU 34 HB3 LEU 34 10.688 -13.820 9.895 260 HB3 LEU 34 HB2 LEU 34 9.167 -14.033 10.738 261 HG LEU 34 HG LEU 34 10.345 -16.083 10.898 262 HD11 LEU 34 HD11 LEU 34 8.253 -16.332 8.750 263 HD12 LEU 34 HD12 LEU 34 7.976 -16.341 10.490 264 HD13 LEU 34 HD13 LEU 34 8.876 -17.658 9.732 265 HD21 LEU 34 HD21 LEU 34 10.687 -15.997 7.904 266 HD22 LEU 34 HD22 LEU 34 11.148 -17.337 8.950 267 HD23 LEU 34 HD23 LEU 34 11.957 -15.778 9.108 268 HA PRO 35 HA PRO 35 6.613 -10.293 8.454 269 HB2 PRO 35 HB3 PRO 35 4.919 -10.481 10.635 270 HB3 PRO 35 HB2 PRO 35 4.520 -10.989 8.992 271 HG2 PRO 35 HG3 PRO 35 5.461 -12.628 11.308 272 HG3 PRO 35 HG2 PRO 35 4.227 -13.009 10.092 273 HD2 PRO 35 HD3 PRO 35 6.675 -14.075 9.966 274 HD3 PRO 35 HD2 PRO 35 5.809 -13.587 8.492 275 H VAL 36 H VAL 36 7.060 -8.358 9.365 276 HA VAL 36 HA VAL 36 9.038 -8.235 11.402 277 HB VAL 36 HB VAL 36 9.123 -6.596 9.666 278 HG11 VAL 36 HG11 VAL 36 6.768 -6.544 9.054 279 HG12 VAL 36 HG12 VAL 36 7.395 -4.915 9.305 280 HG13 VAL 36 HG13 VAL 36 6.391 -5.672 10.540 281 HG21 VAL 36 HG21 VAL 36 8.274 -5.246 12.225 282 HG22 VAL 36 HG22 VAL 36 9.226 -4.516 10.932 283 HG23 VAL 36 HG23 VAL 36 9.888 -5.858 11.865 284 H ASP 37 H ASP 37 8.155 -9.205 13.161 285 HA ASP 37 HA ASP 37 6.976 -7.848 15.215 286 HB2 ASP 37 HB3 ASP 37 4.968 -7.590 13.766 287 HB3 ASP 37 HB2 ASP 37 4.864 -9.341 13.625 288 H TYR 38 H TYR 38 7.407 -10.726 13.409 289 HA TYR 38 HA TYR 38 6.582 -12.658 15.275 290 HB2 TYR 38 HB3 TYR 38 7.172 -12.774 12.700 291 HB3 TYR 38 HB2 TYR 38 8.757 -13.235 13.309 292 HD1 TYR 38 HD1 TYR 38 9.018 -15.322 14.622 293 HD2 TYR 38 HD2 TYR 38 5.320 -14.257 12.813 294 HE1 TYR 38 HE1 TYR 38 8.220 -17.633 14.896 295 HE2 TYR 38 HE2 TYR 38 4.514 -16.560 13.080 296 HH TYR 38 HH TYR 38 5.552 -18.856 13.315 297 H GLU 39 H GLU 39 7.597 -13.689 16.897 298 HA GLU 39 HA GLU 39 10.418 -13.040 17.432 299 HB2 GLU 39 HB3 GLU 39 8.235 -13.622 19.453 300 HB3 GLU 39 HB2 GLU 39 9.917 -13.272 19.826 301 HG2 GLU 39 HG3 GLU 39 9.660 -11.031 18.883 302 HG3 GLU 39 HG2 GLU 39 7.975 -11.388 18.508 303 H ILE 40 H ILE 40 11.768 -14.750 17.913 304 HA ILE 40 HA ILE 40 10.540 -17.429 17.923 305 HB ILE 40 HB ILE 40 12.476 -18.293 16.666 306 HG12 ILE 40 HG13 ILE 40 13.179 -15.376 16.259 307 HG13 ILE 40 HG12 ILE 40 14.080 -16.507 17.264 308 HG21 ILE 40 HG21 ILE 40 10.441 -17.799 15.478 309 HG22 ILE 40 HG22 ILE 40 11.827 -17.380 14.471 310 HG23 ILE 40 HG23 ILE 40 10.918 -16.111 15.295 311 HD11 ILE 40 HD11 ILE 40 13.713 -16.661 14.281 312 HD12 ILE 40 HD12 ILE 40 14.555 -17.858 15.265 313 HD13 ILE 40 HD13 ILE 40 15.184 -16.215 15.147 314 H GLU 41 H GLU 41 11.921 -19.131 18.771 315 HA GLU 41 HA GLU 41 13.740 -18.201 20.902 316 HB2 GLU 41 HB3 GLU 41 11.657 -18.864 21.938 317 HB3 GLU 41 HB2 GLU 41 11.613 -20.356 21.015 318 HG2 GLU 41 HG3 GLU 41 13.609 -21.134 22.230 319 HG3 GLU 41 HG2 GLU 41 13.575 -19.654 23.187 320 H TYR 42 H TYR 42 15.439 -19.714 21.462 321 HA TYR 42 HA TYR 42 16.154 -21.455 19.211 322 HB2 TYR 42 HB3 TYR 42 17.866 -20.229 21.381 323 HB3 TYR 42 HB2 TYR 42 18.466 -21.370 20.183 324 HD1 TYR 42 HD1 TYR 42 18.661 -20.713 17.829 325 HD2 TYR 42 HD2 TYR 42 17.396 -17.940 20.800 326 HE1 TYR 42 HE1 TYR 42 19.099 -18.859 16.277 327 HE2 TYR 42 HE2 TYR 42 17.836 -16.078 19.254 328 HH TYR 42 HH TYR 42 18.484 -16.574 15.917 329 H VAL 43 H VAL 43 15.323 -23.443 19.590 330 HA VAL 43 HA VAL 43 15.594 -24.571 22.278 331 HB VAL 43 HB VAL 43 14.158 -26.435 21.411 332 HG11 VAL 43 HG11 VAL 43 12.080 -25.095 21.455 333 HG12 VAL 43 HG12 VAL 43 13.054 -23.630 21.324 334 HG13 VAL 43 HG13 VAL 43 13.207 -24.667 22.742 335 HG21 VAL 43 HG21 VAL 43 14.619 -26.184 19.031 336 HG22 VAL 43 HG22 VAL 43 13.842 -24.600 19.034 337 HG23 VAL 43 HG23 VAL 43 12.889 -26.050 19.350 338 H CYS 44 H CYS 44 16.022 -27.033 22.246 339 HA CYS 44 HA CYS 44 18.447 -27.464 20.622 340 HB2 CYS 44 HB3 CYS 44 18.746 -27.107 23.104 341 HB3 CYS 44 HB2 CYS 44 17.828 -28.579 23.369 342 H ARG 45 H ARG 45 18.969 -29.940 20.489 343 HA ARG 45 HA ARG 45 16.715 -31.211 19.261 344 HB2 ARG 45 HB3 ARG 45 19.446 -32.333 19.924 345 HB3 ARG 45 HB2 ARG 45 18.254 -33.099 18.883 346 HG2 ARG 45 HG3 ARG 45 19.484 -30.407 18.348 347 HG3 ARG 45 HG2 ARG 45 20.072 -31.925 17.672 348 HD2 ARG 45 HD3 ARG 45 17.195 -31.314 17.328 349 HD3 ARG 45 HD2 ARG 45 18.338 -30.344 16.401 350 HE ARG 45 HE ARG 45 19.082 -32.995 16.055 351 HH11 ARG 45 HH11 ARG 45 16.262 -31.017 15.395 352 HH12 ARG 45 HH12 ARG 45 15.843 -31.871 13.937 353 HH21 ARG 45 HH21 ARG 45 18.535 -34.123 14.145 354 HH22 ARG 45 HH22 ARG 45 17.122 -33.659 13.250 355 H GLY 46 H GLY 46 15.121 -32.045 20.434 356 HA2 GLY 46 HA3 GLY 46 14.389 -33.939 21.728 357 HA3 GLY 46 HA2 GLY 46 15.851 -33.787 22.692 358 H GLU 47 H GLU 47 15.745 -32.710 24.557 359 HA GLU 47 HA GLU 47 13.745 -30.666 24.975 360 HB2 GLU 47 HB3 GLU 47 12.739 -31.831 26.930 361 HB3 GLU 47 HB2 GLU 47 12.386 -32.598 25.388 362 HG2 GLU 47 HG3 GLU 47 14.269 -34.195 25.875 363 HG3 GLU 47 HG2 GLU 47 14.319 -33.513 27.501 364 H ARG 48 H ARG 48 16.409 -30.315 24.997 365 HA ARG 48 HA ARG 48 17.377 -30.422 27.737 366 HB2 ARG 48 HB3 ARG 48 18.601 -29.276 25.219 367 HB3 ARG 48 HB2 ARG 48 19.397 -29.320 26.784 368 HG2 ARG 48 HG3 ARG 48 18.457 -31.785 25.350 369 HG3 ARG 48 HG2 ARG 48 20.067 -31.096 25.144 370 HD2 ARG 48 HD3 ARG 48 20.419 -31.312 27.588 371 HD3 ARG 48 HD2 ARG 48 18.850 -32.109 27.711 372 HE ARG 48 HE ARG 48 19.869 -33.769 26.067 373 HH11 ARG 48 HH11 ARG 48 21.738 -32.058 28.485 374 HH12 ARG 48 HH12 ARG 48 22.958 -33.291 28.602 375 HH21 ARG 48 HH21 ARG 48 21.474 -35.369 26.183 376 HH22 ARG 48 HH22 ARG 48 22.799 -35.185 27.295 377 H GLU 49 H GLU 49 17.719 -28.618 29.042 378 HA GLU 49 HA GLU 49 16.110 -26.302 28.440 379 HB2 GLU 49 HB3 GLU 49 17.890 -26.951 30.800 380 HB3 GLU 49 HB2 GLU 49 16.914 -25.494 30.671 381 HG2 GLU 49 HG3 GLU 49 15.928 -28.333 30.809 382 HG3 GLU 49 HG2 GLU 49 15.773 -27.086 32.045 383 H VAL 50 H VAL 50 16.833 -24.751 27.174 384 HA VAL 50 HA VAL 50 19.710 -24.381 26.860 385 HB VAL 50 HB VAL 50 18.515 -24.570 24.787 386 HG11 VAL 50 HG11 VAL 50 16.735 -23.029 24.125 387 HG12 VAL 50 HG12 VAL 50 16.807 -22.260 25.711 388 HG13 VAL 50 HG13 VAL 50 16.293 -23.940 25.570 389 HG21 VAL 50 HG21 VAL 50 19.102 -22.459 23.691 390 HG22 VAL 50 HG22 VAL 50 20.365 -22.987 24.801 391 HG23 VAL 50 HG23 VAL 50 19.268 -21.686 25.268 392 H VAL 51 H VAL 51 20.711 -22.952 28.097 393 HA VAL 51 HA VAL 51 19.157 -20.694 29.128 394 HB VAL 51 HB VAL 51 20.199 -21.914 30.897 395 HG11 VAL 51 HG11 VAL 51 22.827 -21.535 29.466 396 HG12 VAL 51 HG12 VAL 51 21.944 -23.052 29.636 397 HG13 VAL 51 HG13 VAL 51 22.615 -22.259 31.060 398 HG21 VAL 51 HG21 VAL 51 21.619 -20.185 31.917 399 HG22 VAL 51 HG22 VAL 51 20.161 -19.515 31.184 400 HG23 VAL 51 HG23 VAL 51 21.712 -19.364 30.358 401 H GLY 52 H GLY 52 19.153 -19.272 27.525 402 HA2 GLY 52 HA3 GLY 52 21.598 -17.756 27.163 403 HA3 GLY 52 HA2 GLY 52 20.883 -18.416 25.693 404 HA PRO 53 HA PRO 53 18.540 -14.465 26.723 405 HB2 PRO 53 HB3 PRO 53 19.656 -12.853 24.839 406 HB3 PRO 53 HB2 PRO 53 20.235 -12.913 26.508 407 HG2 PRO 53 HG3 PRO 53 21.344 -14.233 24.066 408 HG3 PRO 53 HG2 PRO 53 22.204 -13.441 25.399 409 HD2 PRO 53 HD3 PRO 53 21.953 -16.141 25.185 410 HD3 PRO 53 HD2 PRO 53 22.086 -15.300 26.741 411 H LYS 54 H LYS 54 17.316 -16.374 25.699 412 HA LYS 54 HA LYS 54 17.390 -16.507 22.810 413 HB2 LYS 54 HB3 LYS 54 15.718 -18.385 23.185 414 HB3 LYS 54 HB2 LYS 54 17.329 -18.617 23.849 415 HG2 LYS 54 HG3 LYS 54 16.561 -18.124 26.063 416 HG3 LYS 54 HG2 LYS 54 14.976 -17.639 25.457 417 HD2 LYS 54 HD3 LYS 54 14.619 -19.949 24.651 418 HD3 LYS 54 HD2 LYS 54 16.169 -20.411 25.356 419 HE2 LYS 54 HE3 LYS 54 15.400 -19.979 27.556 420 HE3 LYS 54 HE2 LYS 54 13.951 -19.169 26.963 421 HZ1 LYS 54 HZ1 LYS 54 13.256 -21.316 26.000 422 HZ2 LYS 54 HZ2 LYS 54 13.358 -21.340 27.694 423 HZ3 LYS 54 HZ3 LYS 54 14.577 -22.063 26.763 424 H VAL 55 H VAL 55 16.519 -14.462 22.317 425 HA VAL 55 HA VAL 55 13.731 -14.754 21.726 426 HB VAL 55 HB VAL 55 13.494 -13.685 23.905 427 HG11 VAL 55 HG11 VAL 55 15.684 -12.632 24.078 428 HG12 VAL 55 HG12 VAL 55 14.396 -11.460 24.361 429 HG13 VAL 55 HG13 VAL 55 15.241 -11.485 22.814 430 HG21 VAL 55 HG21 VAL 55 12.238 -11.670 23.230 431 HG22 VAL 55 HG22 VAL 55 11.890 -13.061 22.202 432 HG23 VAL 55 HG23 VAL 55 12.960 -11.783 21.626 433 H ARG 56 H ARG 56 13.451 -14.048 19.707 434 HA ARG 56 HA ARG 56 15.216 -11.920 18.723 435 HB2 ARG 56 HB3 ARG 56 14.545 -14.458 17.223 436 HB3 ARG 56 HB2 ARG 56 15.441 -13.094 16.567 437 HG2 ARG 56 HG3 ARG 56 16.299 -14.894 18.821 438 HG3 ARG 56 HG2 ARG 56 16.958 -14.855 17.183 439 HD2 ARG 56 HD3 ARG 56 17.741 -12.575 17.547 440 HD3 ARG 56 HD2 ARG 56 17.047 -12.585 19.167 441 HE ARG 56 HE ARG 56 19.244 -14.371 18.334 442 HH11 ARG 56 HH11 ARG 56 17.671 -12.343 20.724 443 HH12 ARG 56 HH12 ARG 56 18.978 -12.464 21.861 444 HH21 ARG 56 HH21 ARG 56 20.962 -14.521 19.853 445 HH22 ARG 56 HH22 ARG 56 20.834 -13.678 21.367 446 H LYS 57 H LYS 57 13.958 -10.299 18.219 447 HA LYS 57 HA LYS 57 11.265 -10.827 17.183 448 HB2 LYS 57 HB3 LYS 57 11.480 -9.370 19.178 449 HB3 LYS 57 HB2 LYS 57 12.474 -8.263 18.244 450 HG2 LYS 57 HG3 LYS 57 10.614 -7.763 16.787 451 HG3 LYS 57 HG2 LYS 57 9.612 -8.950 17.626 452 HD2 LYS 57 HD3 LYS 57 10.794 -6.448 18.826 453 HD3 LYS 57 HD2 LYS 57 9.097 -6.700 18.404 454 HE2 LYS 57 HE3 LYS 57 8.926 -8.474 20.042 455 HE3 LYS 57 HE2 LYS 57 10.643 -8.339 20.409 456 HZ1 LYS 57 HZ1 LYS 57 10.223 -6.063 21.189 457 HZ2 LYS 57 HZ2 LYS 57 9.375 -7.226 22.083 458 HZ3 LYS 57 HZ3 LYS 57 8.564 -6.294 20.931 459 H CYS 58 H CYS 58 10.903 -10.583 15.089 460 HA CYS 58 HA CYS 58 12.957 -9.791 13.306 461 HB2 CYS 58 HB3 CYS 58 11.139 -11.402 12.739 462 HB3 CYS 58 HB2 CYS 58 9.997 -10.063 12.734 463 H LEU 59 H LEU 59 13.578 -7.823 12.786 464 HA LEU 59 HA LEU 59 11.817 -5.566 13.417 465 HB2 LEU 59 HB3 LEU 59 14.792 -5.597 12.884 466 HB3 LEU 59 HB2 LEU 59 13.848 -4.203 13.376 467 HG LEU 59 HG LEU 59 14.284 -6.680 15.050 468 HD11 LEU 59 HD11 LEU 59 15.502 -3.928 15.243 469 HD12 LEU 59 HD12 LEU 59 16.338 -5.417 14.802 470 HD13 LEU 59 HD13 LEU 59 15.694 -5.218 16.432 471 HD21 LEU 59 HD21 LEU 59 12.149 -5.614 15.525 472 HD22 LEU 59 HD22 LEU 59 12.947 -4.050 15.696 473 HD23 LEU 59 HD23 LEU 59 13.280 -5.339 16.852 474 H ALA 60 H ALA 60 12.522 -3.582 11.875 475 HA ALA 60 HA ALA 60 11.624 -4.409 9.264 476 HB1 ALA 60 HB1 ALA 60 11.516 -2.022 8.761 477 HB2 ALA 60 HB2 ALA 60 12.324 -1.661 10.288 478 HB3 ALA 60 HB3 ALA 60 10.718 -2.391 10.290 479 H ASN 61 H ASN 61 13.831 -5.680 9.375 480 HA ASN 61 HA ASN 61 15.349 -4.585 7.221 481 HB2 ASN 61 HB3 ASN 61 17.565 -4.716 8.311 482 HB3 ASN 61 HB2 ASN 61 16.552 -3.482 9.049 483 HD21 ASN 61 HD21 ASN 61 18.315 -6.366 9.522 484 HD22 ASN 61 HD22 ASN 61 17.980 -6.556 11.210 485 H GLY 62 H GLY 62 17.118 -6.262 6.601 486 HA2 GLY 62 HA3 GLY 62 15.668 -8.769 6.498 487 HA3 GLY 62 HA2 GLY 62 17.112 -8.355 5.589 488 H SER 63 H SER 63 16.742 -8.223 9.104 489 HA SER 63 HA SER 63 18.187 -10.687 9.503 490 HB2 SER 63 HB3 SER 63 19.480 -8.041 10.219 491 HB3 SER 63 HB2 SER 63 20.070 -9.624 10.725 492 HG SER 63 HG SER 63 19.690 -9.597 8.063 493 H TRP 64 H TRP 64 18.335 -11.248 11.781 494 HA TRP 64 HA TRP 64 16.062 -10.230 13.246 495 HB2 TRP 64 HB3 TRP 64 18.037 -12.435 13.893 496 HB3 TRP 64 HB2 TRP 64 16.632 -12.032 14.876 497 HD1 TRP 64 HD1 TRP 64 17.575 -13.626 11.514 498 HE1 TRP 64 HE1 TRP 64 15.547 -14.961 10.639 499 HE3 TRP 64 HE3 TRP 64 14.098 -12.197 14.989 500 HZ2 TRP 64 HZ2 TRP 64 12.845 -15.359 11.344 501 HZ3 TRP 64 HZ3 TRP 64 11.819 -13.107 14.816 502 HH2 TRP 64 HH2 TRP 64 11.207 -14.656 13.029 503 H THR 65 H THR 65 16.571 -10.184 15.787 504 HA THR 65 HA THR 65 17.773 -7.732 16.264 505 HB THR 65 HB THR 65 17.534 -9.848 18.388 506 HG1 THR 65 HG1 THR 65 15.439 -8.405 17.079 507 HG21 THR 65 HG21 THR 65 18.430 -7.683 19.053 508 HG22 THR 65 HG22 THR 65 16.830 -7.928 19.752 509 HG23 THR 65 HG23 THR 65 17.031 -6.870 18.355 510 H ASP 66 H ASP 66 19.060 -10.971 17.050 511 HA ASP 66 HA ASP 66 21.791 -9.973 16.838 512 HB2 ASP 66 HB3 ASP 66 21.287 -9.605 19.206 513 HB3 ASP 66 HB2 ASP 66 20.672 -11.246 19.355 514 H MET 67 H MET 67 22.997 -11.523 15.776 515 HA MET 67 HA MET 67 22.240 -14.302 16.344 516 HB2 MET 67 HB3 MET 67 22.910 -13.220 13.598 517 HB3 MET 67 HB2 MET 67 22.691 -14.922 13.985 518 HG2 MET 67 HG3 MET 67 20.381 -14.547 14.538 519 HG3 MET 67 HG2 MET 67 20.574 -12.809 14.323 520 HE1 MET 67 HE1 MET 67 21.259 -12.588 10.452 521 HE2 MET 67 HE2 MET 67 22.448 -12.714 11.749 522 HE3 MET 67 HE3 MET 67 21.045 -11.660 11.937 523 H ASP 68 H ASP 68 24.005 -13.817 17.855 524 HA ASP 68 HA ASP 68 25.996 -15.629 17.006 525 HB2 ASP 68 HB3 ASP 68 27.067 -13.470 16.249 526 HB3 ASP 68 HB2 ASP 68 27.056 -12.940 17.931 527 H THR 69 H THR 69 25.210 -16.895 18.702 528 HA THR 69 HA THR 69 25.349 -15.682 21.365 529 HB THR 69 HB THR 69 22.843 -17.104 20.481 530 HG1 THR 69 HG1 THR 69 23.382 -14.296 20.418 531 HG21 THR 69 HG21 THR 69 23.404 -15.145 22.708 532 HG22 THR 69 HG22 THR 69 23.229 -16.892 22.896 533 HG23 THR 69 HG23 THR 69 21.856 -15.915 22.372 534 HA PRO 70 HA PRO 70 26.764 -19.862 22.165 535 HB2 PRO 70 HB3 PRO 70 27.384 -18.948 24.836 536 HB3 PRO 70 HB2 PRO 70 28.495 -19.357 23.531 537 HG2 PRO 70 HG3 PRO 70 28.141 -16.822 24.499 538 HG3 PRO 70 HG2 PRO 70 28.700 -17.187 22.857 539 HD2 PRO 70 HD3 PRO 70 25.971 -16.406 23.806 540 HD3 PRO 70 HD2 PRO 70 26.834 -15.925 22.328 541 H SER 71 H SER 71 24.119 -19.783 22.156 542 HA SER 71 HA SER 71 22.974 -20.126 24.770 543 HB2 SER 71 HB3 SER 71 20.972 -20.909 23.328 544 HB3 SER 71 HB2 SER 71 21.484 -19.225 23.187 545 HG SER 71 HG SER 71 22.137 -21.365 21.434 546 H ARG 72 H ARG 72 23.728 -21.837 25.864 547 HA ARG 72 HA ARG 72 24.164 -24.379 24.505 548 HB2 ARG 72 HB3 ARG 72 25.405 -25.036 26.394 549 HB3 ARG 72 HB2 ARG 72 25.769 -23.325 26.226 550 HG2 ARG 72 HG3 ARG 72 23.961 -22.892 27.935 551 HG3 ARG 72 HG2 ARG 72 23.931 -24.633 28.213 552 HD2 ARG 72 HD3 ARG 72 25.353 -23.743 29.864 553 HD3 ARG 72 HD2 ARG 72 26.417 -24.467 28.658 554 HE ARG 72 HE ARG 72 26.821 -22.205 27.805 555 HH11 ARG 72 HH11 ARG 72 25.489 -22.537 31.041 556 HH12 ARG 72 HH12 ARG 72 26.018 -20.963 31.555 557 HH21 ARG 72 HH21 ARG 72 27.515 -20.131 28.486 558 HH22 ARG 72 HH22 ARG 72 27.162 -19.588 30.100 559 H CYS 73 H CYS 73 22.956 -26.209 24.868 560 HA CYS 73 HA CYS 73 20.642 -25.894 26.639 561 HB2 CYS 73 HB3 CYS 73 19.818 -27.977 25.358 562 HB3 CYS 73 HB2 CYS 73 19.777 -26.421 24.541 563 H VAL 74 H VAL 74 21.183 -26.559 28.583 564 HA VAL 74 HA VAL 74 22.821 -28.996 28.843 565 HB VAL 74 HB VAL 74 24.100 -26.940 29.336 566 HG11 VAL 74 HG11 VAL 74 23.560 -25.625 31.346 567 HG12 VAL 74 HG12 VAL 74 22.046 -26.517 31.497 568 HG13 VAL 74 HG13 VAL 74 22.331 -25.491 30.089 569 HG21 VAL 74 HG21 VAL 74 24.716 -28.984 30.496 570 HG22 VAL 74 HG22 VAL 74 23.548 -28.634 31.771 571 HG23 VAL 74 HG23 VAL 74 24.949 -27.586 31.545 572 H ARG 75 H ARG 75 22.452 -30.288 30.715 573 HA ARG 75 HA ARG 75 20.395 -29.600 32.586 574 HB2 ARG 75 HB3 ARG 75 19.078 -30.483 30.642 575 HB3 ARG 75 HB2 ARG 75 19.921 -32.017 30.832 576 HG2 ARG 75 HG3 ARG 75 19.064 -32.052 33.203 577 HG3 ARG 75 HG2 ARG 75 18.028 -30.697 32.755 578 HD2 ARG 75 HD3 ARG 75 17.100 -32.115 30.923 579 HD3 ARG 75 HD2 ARG 75 18.029 -33.469 31.571 580 HE ARG 75 HE ARG 75 15.631 -32.275 32.684 581 HH11 ARG 75 HH11 ARG 75 18.412 -34.331 33.300 582 HH12 ARG 75 HH12 ARG 75 17.662 -35.159 34.631 583 HH21 ARG 75 HH21 ARG 75 14.643 -33.380 34.433 584 HH22 ARG 75 HH22 ARG 75 15.526 -34.620 35.272 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 3.003 -3.660 -3.914 2 H2 GLY 1 HT2 GLY 1 3.535 -2.609 -5.135 3 H3 GLY 1 HT3 GLY 1 2.381 -2.086 -4.007 4 HA2 GLY 1 HA2 GLY 1 4.530 -1.156 -3.473 5 HA3 GLY 1 HA3 GLY 1 4.003 -2.276 -2.224 6 HA PRO 2 HA PRO 2 7.804 -3.959 -4.688 7 HB2 PRO 2 HB3 PRO 2 9.755 -2.131 -4.892 8 HB3 PRO 2 HB2 PRO 2 8.450 -2.227 -6.082 9 HG2 PRO 2 HG3 PRO 2 8.776 -0.354 -3.771 10 HG3 PRO 2 HG2 PRO 2 8.246 -0.002 -5.425 11 HD2 PRO 2 HD3 PRO 2 6.536 -0.321 -3.309 12 HD3 PRO 2 HD2 PRO 2 6.087 -0.645 -4.994 13 H THR 3 H THR 3 7.255 -2.570 -1.786 14 HA THR 3 HA THR 3 9.860 -2.740 -0.600 15 HB THR 3 HB THR 3 8.460 -2.385 1.538 16 HG1 THR 3 HG1 THR 3 6.366 -2.348 1.279 17 HG21 THR 3 HG21 THR 3 9.725 -0.602 0.452 18 HG22 THR 3 HG22 THR 3 8.178 0.003 1.048 19 HG23 THR 3 HG23 THR 3 8.395 -0.329 -0.671 20 H SER 4 H SER 4 10.605 -4.830 -0.642 21 HA SER 4 HA SER 4 8.992 -6.797 0.822 22 HB2 SER 4 HB3 SER 4 11.486 -7.247 -0.837 23 HB3 SER 4 HB2 SER 4 10.470 -8.497 -0.116 24 HG SER 4 HG SER 4 8.893 -6.933 -1.549 25 H GLU 5 H GLU 5 9.359 -6.267 2.913 26 HA GLU 5 HA GLU 5 12.160 -6.318 3.825 27 HB2 GLU 5 HB3 GLU 5 9.904 -4.701 5.035 28 HB3 GLU 5 HB2 GLU 5 11.574 -4.726 5.580 29 HG2 GLU 5 HG3 GLU 5 10.589 -3.674 2.936 30 HG3 GLU 5 HG2 GLU 5 11.074 -2.705 4.325 31 H GLY 6 H GLY 6 12.468 -8.163 4.871 32 HA2 GLY 6 HA3 GLY 6 10.740 -8.843 7.083 33 HA3 GLY 6 HA2 GLY 6 10.680 -9.994 5.753 34 H CYS 7 H CYS 7 11.544 -10.711 8.286 35 HA CYS 7 HA CYS 7 14.436 -10.773 8.246 36 HB2 CYS 7 HB3 CYS 7 12.453 -12.155 10.064 37 HB3 CYS 7 HB2 CYS 7 14.197 -12.105 10.305 38 H GLN 8 H GLN 8 15.687 -12.440 7.573 39 HA GLN 8 HA GLN 8 14.463 -14.347 5.820 40 HB2 GLN 8 HB3 GLN 8 16.722 -15.022 5.273 41 HB3 GLN 8 HB2 GLN 8 16.618 -13.270 5.288 42 HG2 GLN 8 HG3 GLN 8 17.825 -13.086 7.270 43 HG3 GLN 8 HG2 GLN 8 17.552 -14.770 7.703 44 HE21 GLN 8 HE21 GLN 8 18.230 -15.779 5.047 45 HE22 GLN 8 HE22 GLN 8 19.943 -15.651 4.916 46 H ILE 9 H ILE 9 15.563 -16.627 5.877 47 HA ILE 9 HA ILE 9 14.788 -17.857 8.393 48 HB ILE 9 HB ILE 9 15.660 -19.053 5.754 49 HG12 ILE 9 HG13 ILE 9 12.948 -18.867 7.078 50 HG13 ILE 9 HG12 ILE 9 13.474 -17.974 5.653 51 HG21 ILE 9 HG21 ILE 9 16.278 -20.572 7.525 52 HG22 ILE 9 HG22 ILE 9 14.880 -21.212 6.654 53 HG23 ILE 9 HG23 ILE 9 14.665 -20.450 8.231 54 HD11 ILE 9 HD11 ILE 9 12.052 -19.819 5.022 55 HD12 ILE 9 HD12 ILE 9 13.109 -20.954 5.860 56 HD13 ILE 9 HD13 ILE 9 13.693 -20.095 4.436 57 H ILE 10 H ILE 10 16.214 -18.200 9.950 58 HA ILE 10 HA ILE 10 19.060 -18.088 9.449 59 HB ILE 10 HB ILE 10 17.566 -18.643 12.021 60 HG12 ILE 10 HG13 ILE 10 18.836 -16.085 11.019 61 HG13 ILE 10 HG12 ILE 10 17.107 -16.407 11.088 62 HG21 ILE 10 HG21 ILE 10 19.847 -19.519 12.049 63 HG22 ILE 10 HG22 ILE 10 19.673 -18.145 13.143 64 HG23 ILE 10 HG23 ILE 10 20.464 -17.935 11.581 65 HD11 ILE 10 HD11 ILE 10 17.865 -15.010 12.942 66 HD12 ILE 10 HD12 ILE 10 18.956 -16.296 13.460 67 HD13 ILE 10 HD13 ILE 10 17.210 -16.548 13.507 68 H HIS 11 H HIS 11 20.390 -19.796 9.246 69 HA HIS 11 HA HIS 11 19.233 -22.462 9.224 70 HB2 HIS 11 HB3 HIS 11 22.071 -21.566 8.666 71 HB3 HIS 11 HB2 HIS 11 21.446 -23.190 8.408 72 HD1 HIS 11 HD1 HIS 11 20.000 -23.584 6.304 73 HD2 HIS 11 HD2 HIS 11 21.306 -19.660 6.766 74 HE1 HIS 11 HE1 HIS 11 19.545 -22.450 4.101 75 HE2 HIS 11 HE2 HIS 11 20.544 -20.141 4.340 76 HA PRO 12 HA PRO 12 20.145 -23.045 13.564 77 HB2 PRO 12 HB3 PRO 12 19.851 -25.895 12.764 78 HB3 PRO 12 HB2 PRO 12 19.054 -25.008 14.067 79 HG2 PRO 12 HG3 PRO 12 17.734 -25.634 11.838 80 HG3 PRO 12 HG2 PRO 12 17.477 -24.074 12.644 81 HD2 PRO 12 HD3 PRO 12 19.034 -24.705 10.173 82 HD3 PRO 12 HD2 PRO 12 18.039 -23.284 10.547 83 HA PRO 13 HA PRO 13 24.493 -23.876 12.673 84 HB2 PRO 13 HB3 PRO 13 24.914 -22.862 15.391 85 HB3 PRO 13 HB2 PRO 13 25.498 -22.215 13.856 86 HG2 PRO 13 HG3 PRO 13 23.595 -20.975 15.311 87 HG3 PRO 13 HG2 PRO 13 23.619 -20.923 13.539 88 HD2 PRO 13 HD3 PRO 13 21.940 -22.606 15.359 89 HD3 PRO 13 HD2 PRO 13 21.482 -21.761 13.865 90 H TRP 14 H TRP 14 23.328 -24.376 15.997 91 HA TRP 14 HA TRP 14 24.997 -26.775 16.164 92 HB2 TRP 14 HB3 TRP 14 25.126 -24.844 17.868 93 HB3 TRP 14 HB2 TRP 14 23.580 -25.435 18.466 94 HD1 TRP 14 HD1 TRP 14 24.138 -26.581 20.700 95 HE1 TRP 14 HE1 TRP 14 25.807 -28.386 21.471 96 HE3 TRP 14 HE3 TRP 14 26.836 -27.104 16.379 97 HZ2 TRP 14 HZ2 TRP 14 27.960 -29.835 20.394 98 HZ3 TRP 14 HZ3 TRP 14 28.685 -28.730 16.337 99 HH2 TRP 14 HH2 TRP 14 29.232 -30.066 18.307 100 H GLU 15 H GLU 15 23.846 -28.377 17.908 101 HA GLU 15 HA GLU 15 21.598 -29.453 16.561 102 HB2 GLU 15 HB3 GLU 15 21.526 -31.043 18.491 103 HB3 GLU 15 HB2 GLU 15 23.083 -30.947 17.680 104 HG2 GLU 15 HG3 GLU 15 23.877 -29.433 19.458 105 HG3 GLU 15 HG2 GLU 15 22.334 -29.644 20.286 106 H GLY 16 H GLY 16 21.814 -26.893 18.686 107 HA2 GLY 16 HA3 GLY 16 19.141 -27.163 19.772 108 HA3 GLY 16 HA2 GLY 16 20.208 -25.775 19.949 109 H GLY 17 H GLY 17 17.353 -26.612 18.703 110 HA2 GLY 17 HA3 GLY 17 17.683 -25.282 16.119 111 HA3 GLY 17 HA2 GLY 17 16.289 -26.228 16.619 112 H ILE 18 H ILE 18 15.254 -24.255 15.633 113 HA ILE 18 HA ILE 18 15.052 -22.131 17.654 114 HB ILE 18 HB ILE 18 14.907 -21.962 14.658 115 HG12 ILE 18 HG13 ILE 18 16.472 -20.532 16.810 116 HG13 ILE 18 HG12 ILE 18 17.097 -21.740 15.690 117 HG21 ILE 18 HG21 ILE 18 14.166 -19.631 14.880 118 HG22 ILE 18 HG22 ILE 18 13.972 -19.863 16.619 119 HG23 ILE 18 HG23 ILE 18 12.956 -20.760 15.490 120 HD11 ILE 18 HD11 ILE 18 16.695 -20.212 13.824 121 HD12 ILE 18 HD12 ILE 18 17.777 -19.514 15.029 122 HD13 ILE 18 HD13 ILE 18 16.093 -18.999 14.954 123 H ARG 19 H ARG 19 13.206 -21.730 18.523 124 HA ARG 19 HA ARG 19 10.894 -23.340 17.738 125 HB2 ARG 19 HB3 ARG 19 11.961 -23.154 20.118 126 HB3 ARG 19 HB2 ARG 19 11.075 -21.638 20.199 127 HG2 ARG 19 HG3 ARG 19 9.733 -23.312 21.225 128 HG3 ARG 19 HG2 ARG 19 8.987 -22.894 19.681 129 HD2 ARG 19 HD3 ARG 19 10.234 -24.875 18.706 130 HD3 ARG 19 HD2 ARG 19 10.606 -25.336 20.367 131 HE ARG 19 HE ARG 19 7.796 -24.933 19.634 132 HH11 ARG 19 HH11 ARG 19 10.380 -27.134 20.516 133 HH12 ARG 19 HH12 ARG 19 9.311 -28.485 20.728 134 HH21 ARG 19 HH21 ARG 19 6.415 -26.684 19.911 135 HH22 ARG 19 HH22 ARG 19 7.054 -28.232 20.395 136 H TYR 20 H TYR 20 8.908 -22.392 17.298 137 HA TYR 20 HA TYR 20 8.961 -19.476 16.885 138 HB2 TYR 20 HB3 TYR 20 7.311 -21.508 15.362 139 HB3 TYR 20 HB2 TYR 20 7.474 -19.793 15.002 140 HD1 TYR 20 HD1 TYR 20 8.971 -23.082 14.675 141 HD2 TYR 20 HD2 TYR 20 9.591 -18.919 14.056 142 HE1 TYR 20 HE1 TYR 20 10.874 -23.591 13.210 143 HE2 TYR 20 HE2 TYR 20 11.495 -19.416 12.581 144 HH TYR 20 HH TYR 20 13.090 -21.217 12.177 145 H ARG 21 H ARG 21 6.300 -18.976 16.498 146 HA ARG 21 HA ARG 21 5.105 -19.951 19.013 147 HB2 ARG 21 HB3 ARG 21 5.668 -17.463 18.885 148 HB3 ARG 21 HB2 ARG 21 4.397 -17.340 17.672 149 HG2 ARG 21 HG3 ARG 21 3.080 -18.641 19.642 150 HG3 ARG 21 HG2 ARG 21 4.205 -17.664 20.588 151 HD2 ARG 21 HD3 ARG 21 2.337 -16.623 18.465 152 HD3 ARG 21 HD2 ARG 21 2.047 -16.541 20.199 153 HE ARG 21 HE ARG 21 4.342 -15.244 20.061 154 HH11 ARG 21 HH11 ARG 21 1.558 -15.069 17.944 155 HH12 ARG 21 HH12 ARG 21 1.782 -13.382 17.572 156 HH21 ARG 21 HH21 ARG 21 4.648 -13.011 19.587 157 HH22 ARG 21 HH22 ARG 21 3.512 -12.211 18.531 158 H GLY 22 H GLY 22 4.261 -18.698 15.789 159 HA2 GLY 22 HA3 GLY 22 1.779 -20.288 15.935 160 HA3 GLY 22 HA2 GLY 22 1.973 -18.826 14.982 161 H LEU 23 H LEU 23 4.479 -21.218 15.069 162 HA LEU 23 HA LEU 23 3.701 -22.075 12.367 163 HB2 LEU 23 HB3 LEU 23 6.473 -21.586 13.455 164 HB3 LEU 23 HB2 LEU 23 6.143 -22.352 11.910 165 HG LEU 23 HG LEU 23 5.320 -19.540 12.649 166 HD11 LEU 23 HD11 LEU 23 7.752 -19.762 12.437 167 HD12 LEU 23 HD12 LEU 23 7.062 -18.802 11.130 168 HD13 LEU 23 HD13 LEU 23 7.540 -20.475 10.839 169 HD21 LEU 23 HD21 LEU 23 3.821 -20.568 11.038 170 HD22 LEU 23 HD22 LEU 23 5.193 -21.029 10.031 171 HD23 LEU 23 HD23 LEU 23 4.804 -19.325 10.265 172 H THR 24 H THR 24 3.333 -24.155 12.155 173 HA THR 24 HA THR 24 3.965 -25.856 14.454 174 HB THR 24 HB THR 24 1.571 -25.469 13.972 175 HG1 THR 24 HG1 THR 24 1.666 -27.360 14.960 176 HG21 THR 24 HG21 THR 24 2.158 -26.944 11.405 177 HG22 THR 24 HG22 THR 24 1.662 -25.258 11.553 178 HG23 THR 24 HG23 THR 24 0.547 -26.548 12.004 179 H ARG 25 H ARG 25 3.741 -28.296 13.708 180 HA ARG 25 HA ARG 25 6.050 -29.023 12.331 181 HB2 ARG 25 HB3 ARG 25 3.548 -30.603 12.915 182 HB3 ARG 25 HB2 ARG 25 5.042 -31.305 12.315 183 HG2 ARG 25 HG3 ARG 25 6.212 -30.657 14.317 184 HG3 ARG 25 HG2 ARG 25 4.789 -29.796 14.905 185 HD2 ARG 25 HD3 ARG 25 5.062 -32.010 15.961 186 HD3 ARG 25 HD2 ARG 25 3.552 -31.861 15.061 187 HE ARG 25 HE ARG 25 5.926 -33.215 13.940 188 HH11 ARG 25 HH11 ARG 25 2.492 -33.107 14.652 189 HH12 ARG 25 HH12 ARG 25 2.152 -34.612 13.844 190 HH21 ARG 25 HH21 ARG 25 5.472 -35.168 12.860 191 HH22 ARG 25 HH22 ARG 25 3.845 -35.775 12.810 192 H ASP 26 H ASP 26 6.544 -29.156 10.285 193 HA ASP 26 HA ASP 26 6.403 -29.686 8.056 194 HB2 ASP 26 HB3 ASP 26 4.328 -30.993 8.376 195 HB3 ASP 26 HB2 ASP 26 3.390 -29.507 8.288 196 H GLN 27 H GLN 27 5.686 -27.053 9.732 197 HA GLN 27 HA GLN 27 5.455 -25.304 7.402 198 HB2 GLN 27 HB3 GLN 27 5.542 -24.751 10.375 199 HB3 GLN 27 HB2 GLN 27 5.492 -23.486 9.153 200 HG2 GLN 27 HG3 GLN 27 3.410 -25.616 9.134 201 HG3 GLN 27 HG2 GLN 27 3.304 -24.305 10.307 202 HE21 GLN 27 HE21 GLN 27 2.812 -22.285 9.650 203 HE22 GLN 27 HE22 GLN 27 2.301 -21.894 8.039 204 H VAL 28 H VAL 28 7.031 -23.280 7.788 205 HA VAL 28 HA VAL 28 9.103 -22.481 7.425 206 HB VAL 28 HB VAL 28 10.700 -22.673 9.134 207 HG11 VAL 28 HG11 VAL 28 9.382 -22.392 11.174 208 HG12 VAL 28 HG12 VAL 28 7.978 -23.075 10.351 209 HG13 VAL 28 HG13 VAL 28 8.670 -21.550 9.798 210 HG21 VAL 28 HG21 VAL 28 10.954 -25.093 9.249 211 HG22 VAL 28 HG22 VAL 28 9.386 -25.234 10.045 212 HG23 VAL 28 HG23 VAL 28 10.718 -24.411 10.860 213 H LYS 29 H LYS 29 8.397 -25.148 6.133 214 HA LYS 29 HA LYS 29 10.989 -26.353 5.731 215 HB2 LYS 29 HB3 LYS 29 9.844 -27.903 4.258 216 HB3 LYS 29 HB2 LYS 29 8.923 -27.714 5.743 217 HG2 LYS 29 HG3 LYS 29 7.547 -25.986 4.443 218 HG3 LYS 29 HG2 LYS 29 8.299 -26.676 3.004 219 HD2 LYS 29 HD3 LYS 29 6.621 -28.135 5.045 220 HD3 LYS 29 HD2 LYS 29 6.151 -27.723 3.398 221 HE2 LYS 29 HE3 LYS 29 7.930 -29.181 2.539 222 HE3 LYS 29 HE2 LYS 29 8.370 -29.606 4.194 223 HZ1 LYS 29 HZ1 LYS 29 5.804 -30.194 2.818 224 HZ2 LYS 29 HZ2 LYS 29 6.070 -30.463 4.470 225 HZ3 LYS 29 HZ3 LYS 29 6.974 -31.318 3.317 226 H ALA 30 H ALA 30 9.100 -23.860 4.358 227 HA ALA 30 HA ALA 30 11.262 -22.973 2.743 228 HB1 ALA 30 HB1 ALA 30 10.168 -23.072 0.565 229 HB2 ALA 30 HB2 ALA 30 8.818 -23.958 1.277 230 HB3 ALA 30 HB3 ALA 30 10.424 -24.685 1.225 231 H ILE 31 H ILE 31 11.172 -20.933 3.373 232 HA ILE 31 HA ILE 31 8.690 -19.413 2.983 233 HB ILE 31 HB ILE 31 10.419 -19.183 5.467 234 HG12 ILE 31 HG13 ILE 31 7.613 -20.286 5.182 235 HG13 ILE 31 HG12 ILE 31 9.060 -21.233 5.509 236 HG21 ILE 31 HG21 ILE 31 9.475 -17.051 4.835 237 HG22 ILE 31 HG22 ILE 31 8.664 -17.659 6.280 238 HG23 ILE 31 HG23 ILE 31 7.869 -17.767 4.708 239 HD11 ILE 31 HD11 ILE 31 7.770 -20.872 7.530 240 HD12 ILE 31 HD12 ILE 31 7.888 -19.126 7.310 241 HD13 ILE 31 HD13 ILE 31 9.339 -20.074 7.637 242 H ASN 32 H ASN 32 9.081 -17.172 2.498 243 HA ASN 32 HA ASN 32 11.793 -16.631 1.577 244 HB2 ASN 32 HB3 ASN 32 9.227 -15.058 1.290 245 HB3 ASN 32 HB2 ASN 32 10.783 -14.507 0.680 246 HD21 ASN 32 HD21 ASN 32 8.451 -14.981 -0.840 247 HD22 ASN 32 HD22 ASN 32 8.814 -16.248 -1.969 248 H PHE 33 H PHE 33 9.416 -14.717 3.435 249 HA PHE 33 HA PHE 33 11.592 -13.936 5.233 250 HB2 PHE 33 HB3 PHE 33 9.699 -12.028 3.851 251 HB3 PHE 33 HB2 PHE 33 10.730 -11.583 5.207 252 HD1 PHE 33 HD1 PHE 33 10.456 -11.644 1.715 253 HD2 PHE 33 HD2 PHE 33 13.289 -12.119 4.860 254 HE1 PHE 33 HE1 PHE 33 12.283 -11.113 0.151 255 HE2 PHE 33 HE2 PHE 33 15.115 -11.590 3.303 256 HZ PHE 33 HZ PHE 33 14.614 -11.084 0.944 257 H LEU 34 H LEU 34 11.012 -13.609 7.318 258 HA LEU 34 HA LEU 34 8.345 -14.428 8.107 259 HB2 LEU 34 HB3 LEU 34 10.854 -13.747 9.635 260 HB3 LEU 34 HB2 LEU 34 9.319 -13.971 10.448 261 HG LEU 34 HG LEU 34 10.570 -15.996 10.633 262 HD11 LEU 34 HD11 LEU 34 8.404 -16.315 8.566 263 HD12 LEU 34 HD12 LEU 34 8.185 -16.270 10.314 264 HD13 LEU 34 HD13 LEU 34 9.065 -17.604 9.570 265 HD21 LEU 34 HD21 LEU 34 10.815 -15.947 7.628 266 HD22 LEU 34 HD22 LEU 34 11.307 -17.280 8.669 267 HD23 LEU 34 HD23 LEU 34 12.119 -15.720 8.794 268 HA PRO 35 HA PRO 35 6.590 -10.411 8.358 269 HB2 PRO 35 HB3 PRO 35 5.148 -11.332 10.770 270 HB3 PRO 35 HB2 PRO 35 4.509 -10.765 9.223 271 HG2 PRO 35 HG3 PRO 35 4.406 -13.352 9.899 272 HG3 PRO 35 HG2 PRO 35 4.703 -12.842 8.226 273 HD2 PRO 35 HD3 PRO 35 6.642 -13.829 10.283 274 HD3 PRO 35 HD2 PRO 35 6.558 -14.194 8.547 275 H VAL 36 H VAL 36 6.556 -8.509 9.586 276 HA VAL 36 HA VAL 36 8.821 -8.087 11.179 277 HB VAL 36 HB VAL 36 7.808 -6.303 9.854 278 HG11 VAL 36 HG11 VAL 36 5.544 -6.380 11.843 279 HG12 VAL 36 HG12 VAL 36 5.458 -6.872 10.151 280 HG13 VAL 36 HG13 VAL 36 5.758 -5.184 10.565 281 HG21 VAL 36 HG21 VAL 36 9.223 -5.648 11.706 282 HG22 VAL 36 HG22 VAL 36 7.843 -5.690 12.805 283 HG23 VAL 36 HG23 VAL 36 7.906 -4.494 11.512 284 H ASP 37 H ASP 37 9.145 -7.898 13.312 285 HA ASP 37 HA ASP 37 8.901 -8.111 15.535 286 HB2 ASP 37 HB3 ASP 37 6.203 -7.155 14.752 287 HB3 ASP 37 HB2 ASP 37 6.390 -7.824 16.372 288 H TYR 38 H TYR 38 8.181 -10.435 13.559 289 HA TYR 38 HA TYR 38 6.741 -12.223 15.255 290 HB2 TYR 38 HB3 TYR 38 7.103 -12.538 12.752 291 HB3 TYR 38 HB2 TYR 38 8.743 -13.051 13.145 292 HD1 TYR 38 HD1 TYR 38 9.174 -15.238 14.029 293 HD2 TYR 38 HD2 TYR 38 5.169 -13.882 13.551 294 HE1 TYR 38 HE1 TYR 38 8.357 -17.517 14.469 295 HE2 TYR 38 HE2 TYR 38 4.341 -16.155 13.994 296 HH TYR 38 HH TYR 38 5.278 -18.534 13.771 297 H GLU 39 H GLU 39 7.598 -13.910 16.566 298 HA GLU 39 HA GLU 39 10.242 -13.206 17.650 299 HB2 GLU 39 HB3 GLU 39 7.867 -14.324 19.150 300 HB3 GLU 39 HB2 GLU 39 9.390 -13.778 19.844 301 HG2 GLU 39 HG3 GLU 39 8.921 -11.515 19.299 302 HG3 GLU 39 HG2 GLU 39 7.532 -11.976 18.317 303 H ILE 40 H ILE 40 11.732 -14.755 17.597 304 HA ILE 40 HA ILE 40 10.829 -17.566 17.604 305 HB ILE 40 HB ILE 40 12.807 -18.188 16.305 306 HG12 ILE 40 HG13 ILE 40 13.318 -15.220 16.028 307 HG13 ILE 40 HG12 ILE 40 14.248 -16.303 17.056 308 HG21 ILE 40 HG21 ILE 40 10.738 -17.733 15.114 309 HG22 ILE 40 HG22 ILE 40 12.127 -17.241 14.145 310 HG23 ILE 40 HG23 ILE 40 11.166 -16.027 14.990 311 HD11 ILE 40 HD11 ILE 40 14.032 -16.445 14.060 312 HD12 ILE 40 HD12 ILE 40 14.938 -17.568 15.075 313 HD13 ILE 40 HD13 ILE 40 15.415 -15.872 14.989 314 H GLU 41 H GLU 41 12.314 -19.080 18.613 315 HA GLU 41 HA GLU 41 13.972 -17.829 20.699 316 HB2 GLU 41 HB3 GLU 41 11.698 -18.423 21.530 317 HB3 GLU 41 HB2 GLU 41 12.014 -20.097 21.106 318 HG2 GLU 41 HG3 GLU 41 13.723 -20.270 22.751 319 HG3 GLU 41 HG2 GLU 41 13.678 -18.534 23.061 320 H TYR 42 H TYR 42 15.749 -19.058 21.401 321 HA TYR 42 HA TYR 42 16.535 -21.227 19.596 322 HB2 TYR 42 HB3 TYR 42 18.122 -19.539 21.536 323 HB3 TYR 42 HB2 TYR 42 18.801 -20.931 20.701 324 HD1 TYR 42 HD1 TYR 42 19.857 -20.607 18.665 325 HD2 TYR 42 HD2 TYR 42 17.038 -17.718 19.996 326 HE1 TYR 42 HE1 TYR 42 20.428 -19.178 16.748 327 HE2 TYR 42 HE2 TYR 42 17.600 -16.288 18.084 328 HH TYR 42 HH TYR 42 19.435 -17.372 15.439 329 H VAL 43 H VAL 43 15.761 -23.133 20.302 330 HA VAL 43 HA VAL 43 15.982 -23.727 23.184 331 HB VAL 43 HB VAL 43 14.132 -25.351 22.852 332 HG11 VAL 43 HG11 VAL 43 12.339 -23.699 22.713 333 HG12 VAL 43 HG12 VAL 43 13.469 -22.520 22.045 334 HG13 VAL 43 HG13 VAL 43 13.677 -23.102 23.696 335 HG21 VAL 43 HG21 VAL 43 14.435 -25.751 20.458 336 HG22 VAL 43 HG22 VAL 43 13.924 -24.098 20.113 337 HG23 VAL 43 HG23 VAL 43 12.783 -25.245 20.815 338 H CYS 44 H CYS 44 16.083 -26.147 23.618 339 HA CYS 44 HA CYS 44 18.102 -27.327 21.850 340 HB2 CYS 44 HB3 CYS 44 18.481 -27.153 24.363 341 HB3 CYS 44 HB2 CYS 44 17.210 -28.357 24.548 342 H ARG 45 H ARG 45 17.702 -28.903 20.573 343 HA ARG 45 HA ARG 45 15.093 -29.627 19.927 344 HB2 ARG 45 HB3 ARG 45 16.811 -29.719 18.274 345 HB3 ARG 45 HB2 ARG 45 17.764 -30.842 19.235 346 HG2 ARG 45 HG3 ARG 45 16.059 -32.524 18.958 347 HG3 ARG 45 HG2 ARG 45 15.106 -31.423 17.968 348 HD2 ARG 45 HD3 ARG 45 17.053 -31.273 16.405 349 HD3 ARG 45 HD2 ARG 45 17.831 -32.548 17.344 350 HE ARG 45 HE ARG 45 15.499 -33.701 16.739 351 HH11 ARG 45 HH11 ARG 45 17.809 -31.970 14.746 352 HH12 ARG 45 HH12 ARG 45 17.382 -32.813 13.291 353 HH21 ARG 45 HH21 ARG 45 14.940 -34.816 14.813 354 HH22 ARG 45 HH22 ARG 45 15.736 -34.405 13.319 355 H GLY 46 H GLY 46 13.731 -30.972 20.861 356 HA2 GLY 46 HA3 GLY 46 13.288 -33.274 21.547 357 HA3 GLY 46 HA2 GLY 46 14.827 -33.247 22.398 358 H GLU 47 H GLU 47 14.466 -33.314 24.497 359 HA GLU 47 HA GLU 47 12.345 -31.583 25.597 360 HB2 GLU 47 HB3 GLU 47 12.132 -33.296 27.425 361 HB3 GLU 47 HB2 GLU 47 11.585 -33.828 25.840 362 HG2 GLU 47 HG3 GLU 47 13.777 -34.954 25.532 363 HG3 GLU 47 HG2 GLU 47 14.176 -34.529 27.195 364 H ARG 48 H ARG 48 15.433 -31.589 25.211 365 HA ARG 48 HA ARG 48 16.307 -31.108 27.944 366 HB2 ARG 48 HB3 ARG 48 17.750 -30.992 25.288 367 HB3 ARG 48 HB2 ARG 48 18.515 -30.656 26.836 368 HG2 ARG 48 HG3 ARG 48 17.112 -33.249 26.312 369 HG3 ARG 48 HG2 ARG 48 18.791 -32.988 25.840 370 HD2 ARG 48 HD3 ARG 48 17.869 -32.422 28.633 371 HD3 ARG 48 HD2 ARG 48 18.293 -34.058 28.132 372 HE ARG 48 HE ARG 48 20.471 -32.828 27.358 373 HH11 ARG 48 HH11 ARG 48 18.623 -32.183 30.274 374 HH12 ARG 48 HH12 ARG 48 20.034 -31.787 31.226 375 HH21 ARG 48 HH21 ARG 48 22.313 -32.355 28.611 376 HH22 ARG 48 HH22 ARG 48 22.130 -31.904 30.282 377 H GLU 49 H GLU 49 17.470 -29.024 28.413 378 HA GLU 49 HA GLU 49 16.020 -26.825 27.104 379 HB2 GLU 49 HB3 GLU 49 16.640 -27.163 30.040 380 HB3 GLU 49 HB2 GLU 49 15.947 -25.713 29.322 381 HG2 GLU 49 HG3 GLU 49 13.977 -26.918 28.661 382 HG3 GLU 49 HG2 GLU 49 14.683 -28.441 29.197 383 H VAL 50 H VAL 50 17.022 -24.680 27.470 384 HA VAL 50 HA VAL 50 19.958 -24.832 27.575 385 HB VAL 50 HB VAL 50 20.079 -23.123 25.793 386 HG11 VAL 50 HG11 VAL 50 19.435 -24.578 23.893 387 HG12 VAL 50 HG12 VAL 50 18.627 -25.650 25.039 388 HG13 VAL 50 HG13 VAL 50 20.372 -25.410 25.132 389 HG21 VAL 50 HG21 VAL 50 18.112 -22.639 24.416 390 HG22 VAL 50 HG22 VAL 50 17.888 -22.107 26.082 391 HG23 VAL 50 HG23 VAL 50 17.113 -23.588 25.518 392 H VAL 51 H VAL 51 20.986 -23.005 28.456 393 HA VAL 51 HA VAL 51 19.176 -20.894 29.419 394 HB VAL 51 HB VAL 51 19.979 -22.024 31.359 395 HG11 VAL 51 HG11 VAL 51 21.882 -23.187 30.394 396 HG12 VAL 51 HG12 VAL 51 22.347 -22.336 31.867 397 HG13 VAL 51 HG13 VAL 51 22.773 -21.670 30.291 398 HG21 VAL 51 HG21 VAL 51 21.199 -20.255 32.526 399 HG22 VAL 51 HG22 VAL 51 19.908 -19.592 31.525 400 HG23 VAL 51 HG23 VAL 51 21.582 -19.497 30.980 401 H GLY 52 H GLY 52 19.347 -19.483 27.839 402 HA2 GLY 52 HA3 GLY 52 21.843 -18.051 27.493 403 HA3 GLY 52 HA2 GLY 52 21.229 -18.856 26.052 404 HA PRO 53 HA PRO 53 18.941 -14.799 26.529 405 HB2 PRO 53 HB3 PRO 53 20.234 -13.285 24.709 406 HB3 PRO 53 HB2 PRO 53 20.743 -13.356 26.398 407 HG2 PRO 53 HG3 PRO 53 21.917 -14.676 24.003 408 HG3 PRO 53 HG2 PRO 53 22.726 -14.016 25.434 409 HD2 PRO 53 HD3 PRO 53 22.184 -16.705 24.972 410 HD3 PRO 53 HD2 PRO 53 22.554 -15.988 26.556 411 H LYS 54 H LYS 54 17.884 -16.853 25.448 412 HA LYS 54 HA LYS 54 18.040 -16.864 22.559 413 HB2 LYS 54 HB3 LYS 54 16.346 -18.849 22.993 414 HB3 LYS 54 HB2 LYS 54 18.075 -19.041 23.225 415 HG2 LYS 54 HG3 LYS 54 17.215 -20.026 25.121 416 HG3 LYS 54 HG2 LYS 54 17.570 -18.396 25.689 417 HD2 LYS 54 HD3 LYS 54 15.189 -17.800 25.270 418 HD3 LYS 54 HD2 LYS 54 14.881 -19.491 24.875 419 HE2 LYS 54 HE3 LYS 54 15.686 -20.114 27.137 420 HE3 LYS 54 HE2 LYS 54 15.850 -18.400 27.514 421 HZ1 LYS 54 HZ1 LYS 54 13.439 -18.180 27.003 422 HZ2 LYS 54 HZ2 LYS 54 13.780 -19.133 28.363 423 HZ3 LYS 54 HZ3 LYS 54 13.348 -19.872 26.900 424 H VAL 55 H VAL 55 17.034 -14.883 22.135 425 HA VAL 55 HA VAL 55 14.276 -15.286 21.498 426 HB VAL 55 HB VAL 55 13.990 -14.408 23.765 427 HG11 VAL 55 HG11 VAL 55 14.690 -12.140 24.352 428 HG12 VAL 55 HG12 VAL 55 15.515 -11.995 22.799 429 HG13 VAL 55 HG13 VAL 55 16.072 -13.172 23.987 430 HG21 VAL 55 HG21 VAL 55 13.255 -12.395 21.648 431 HG22 VAL 55 HG22 VAL 55 12.516 -12.531 23.243 432 HG23 VAL 55 HG23 VAL 55 12.336 -13.838 22.074 433 H ARG 56 H ARG 56 13.946 -14.429 19.554 434 HA ARG 56 HA ARG 56 15.548 -12.089 18.774 435 HB2 ARG 56 HB3 ARG 56 14.928 -14.484 17.034 436 HB3 ARG 56 HB2 ARG 56 15.680 -12.997 16.475 437 HG2 ARG 56 HG3 ARG 56 16.837 -14.797 18.578 438 HG3 ARG 56 HG2 ARG 56 17.268 -14.845 16.866 439 HD2 ARG 56 HD3 ARG 56 18.721 -13.188 17.157 440 HD3 ARG 56 HD2 ARG 56 17.449 -12.155 17.811 441 HE ARG 56 HE ARG 56 18.000 -12.908 19.997 442 HH11 ARG 56 HH11 ARG 56 20.195 -14.024 17.503 443 HH12 ARG 56 HH12 ARG 56 21.481 -14.370 18.620 444 HH21 ARG 56 HH21 ARG 56 19.703 -13.387 21.464 445 HH22 ARG 56 HH22 ARG 56 21.197 -14.030 20.845 446 H LYS 57 H LYS 57 14.285 -10.460 18.303 447 HA LYS 57 HA LYS 57 11.534 -11.015 17.445 448 HB2 LYS 57 HB3 LYS 57 11.921 -9.557 19.472 449 HB3 LYS 57 HB2 LYS 57 12.688 -8.387 18.405 450 HG2 LYS 57 HG3 LYS 57 10.552 -8.309 17.103 451 HG3 LYS 57 HG2 LYS 57 9.819 -9.295 18.372 452 HD2 LYS 57 HD3 LYS 57 9.281 -7.088 18.957 453 HD3 LYS 57 HD2 LYS 57 10.651 -7.498 19.993 454 HE2 LYS 57 HE3 LYS 57 10.965 -5.282 19.091 455 HE3 LYS 57 HE2 LYS 57 12.153 -6.377 18.388 456 HZ1 LYS 57 HZ1 LYS 57 10.948 -6.459 16.369 457 HZ2 LYS 57 HZ2 LYS 57 11.032 -4.821 16.795 458 HZ3 LYS 57 HZ3 LYS 57 9.597 -5.690 17.047 459 H CYS 58 H CYS 58 11.034 -10.686 15.372 460 HA CYS 58 HA CYS 58 12.942 -9.798 13.490 461 HB2 CYS 58 HB3 CYS 58 11.047 -11.328 12.971 462 HB3 CYS 58 HB2 CYS 58 9.941 -9.969 13.149 463 H LEU 59 H LEU 59 12.981 -7.908 12.228 464 HA LEU 59 HA LEU 59 11.743 -5.575 13.530 465 HB2 LEU 59 HB3 LEU 59 14.394 -5.751 12.088 466 HB3 LEU 59 HB2 LEU 59 13.706 -4.288 12.766 467 HG LEU 59 HG LEU 59 14.505 -6.714 14.378 468 HD11 LEU 59 HD11 LEU 59 15.893 -4.054 14.073 469 HD12 LEU 59 HD12 LEU 59 16.441 -5.584 13.386 470 HD13 LEU 59 HD13 LEU 59 16.384 -5.374 15.136 471 HD21 LEU 59 HD21 LEU 59 13.632 -3.955 15.221 472 HD22 LEU 59 HD22 LEU 59 14.204 -5.229 16.299 473 HD23 LEU 59 HD23 LEU 59 12.701 -5.441 15.398 474 H ALA 60 H ALA 60 11.972 -3.615 11.821 475 HA ALA 60 HA ALA 60 10.327 -4.424 9.584 476 HB1 ALA 60 HB1 ALA 60 9.797 -2.376 10.779 477 HB2 ALA 60 HB2 ALA 60 10.196 -2.020 9.097 478 HB3 ALA 60 HB3 ALA 60 11.378 -1.709 10.372 479 H ASN 61 H ASN 61 13.546 -4.473 10.117 480 HA ASN 61 HA ASN 61 14.162 -4.070 7.268 481 HB2 ASN 61 HB3 ASN 61 16.523 -3.784 7.949 482 HB3 ASN 61 HB2 ASN 61 15.477 -2.573 8.679 483 HD21 ASN 61 HD21 ASN 61 17.520 -5.306 9.242 484 HD22 ASN 61 HD22 ASN 61 17.541 -5.195 10.967 485 H GLY 62 H GLY 62 15.958 -5.591 6.496 486 HA2 GLY 62 HA3 GLY 62 14.924 -8.243 6.964 487 HA3 GLY 62 HA2 GLY 62 16.134 -7.785 5.778 488 H SER 63 H SER 63 16.016 -7.601 9.338 489 HA SER 63 HA SER 63 18.031 -9.651 9.590 490 HB2 SER 63 HB3 SER 63 18.694 -6.834 10.510 491 HB3 SER 63 HB2 SER 63 19.689 -8.271 10.745 492 HG SER 63 HG SER 63 19.107 -8.011 8.139 493 H TRP 64 H TRP 64 18.105 -10.495 11.671 494 HA TRP 64 HA TRP 64 15.941 -9.749 13.433 495 HB2 TRP 64 HB3 TRP 64 18.102 -11.858 13.697 496 HB3 TRP 64 HB2 TRP 64 16.786 -11.632 14.842 497 HD1 TRP 64 HD1 TRP 64 17.498 -12.956 11.319 498 HE1 TRP 64 HE1 TRP 64 15.494 -14.378 10.542 499 HE3 TRP 64 HE3 TRP 64 14.252 -11.933 15.136 500 HZ2 TRP 64 HZ2 TRP 64 12.883 -14.971 11.430 501 HZ3 TRP 64 HZ3 TRP 64 12.021 -12.964 15.093 502 HH2 TRP 64 HH2 TRP 64 11.350 -14.452 13.279 503 H THR 65 H THR 65 16.704 -9.799 15.920 504 HA THR 65 HA THR 65 18.068 -7.358 16.262 505 HB THR 65 HB THR 65 17.996 -8.075 18.746 506 HG1 THR 65 HG1 THR 65 17.318 -10.037 19.112 507 HG21 THR 65 HG21 THR 65 15.604 -7.556 18.881 508 HG22 THR 65 HG22 THR 65 15.436 -7.858 17.150 509 HG23 THR 65 HG23 THR 65 16.415 -6.505 17.718 510 H ASP 66 H ASP 66 19.169 -10.656 16.303 511 HA ASP 66 HA ASP 66 21.919 -9.810 16.406 512 HB2 ASP 66 HB3 ASP 66 21.396 -9.898 18.821 513 HB3 ASP 66 HB2 ASP 66 20.788 -11.535 18.632 514 H MET 67 H MET 67 23.165 -11.272 15.230 515 HA MET 67 HA MET 67 22.209 -14.066 15.311 516 HB2 MET 67 HB3 MET 67 23.515 -12.685 12.955 517 HB3 MET 67 HB2 MET 67 23.186 -14.408 13.050 518 HG2 MET 67 HG3 MET 67 20.788 -13.932 13.147 519 HG3 MET 67 HG2 MET 67 21.135 -12.206 13.030 520 HE1 MET 67 HE1 MET 67 19.167 -13.750 11.000 521 HE2 MET 67 HE2 MET 67 19.664 -13.000 9.483 522 HE3 MET 67 HE3 MET 67 19.513 -12.022 10.945 523 H ASP 68 H ASP 68 23.722 -13.787 17.241 524 HA ASP 68 HA ASP 68 25.710 -15.673 16.539 525 HB2 ASP 68 HB3 ASP 68 26.999 -13.560 16.101 526 HB3 ASP 68 HB2 ASP 68 26.774 -13.128 17.794 527 H THR 69 H THR 69 24.496 -16.963 17.984 528 HA THR 69 HA THR 69 24.969 -16.320 20.788 529 HB THR 69 HB THR 69 22.152 -16.929 19.900 530 HG1 THR 69 HG1 THR 69 23.556 -14.532 19.873 531 HG21 THR 69 HG21 THR 69 23.268 -15.744 22.439 532 HG22 THR 69 HG22 THR 69 22.709 -17.407 22.247 533 HG23 THR 69 HG23 THR 69 21.568 -16.068 22.103 534 HA PRO 70 HA PRO 70 25.326 -20.812 20.393 535 HB2 PRO 70 HB3 PRO 70 27.224 -20.679 22.548 536 HB3 PRO 70 HB2 PRO 70 27.532 -21.045 20.849 537 HG2 PRO 70 HG3 PRO 70 28.404 -18.771 22.133 538 HG3 PRO 70 HG2 PRO 70 28.170 -18.907 20.381 539 HD2 PRO 70 HD3 PRO 70 26.387 -17.680 22.449 540 HD3 PRO 70 HD2 PRO 70 26.742 -17.134 20.796 541 H SER 71 H SER 71 23.289 -21.225 21.261 542 HA SER 71 HA SER 71 22.704 -20.798 24.028 543 HB2 SER 71 HB3 SER 71 20.650 -22.216 23.424 544 HB3 SER 71 HB2 SER 71 20.849 -20.691 22.563 545 HG SER 71 HG SER 71 20.428 -22.875 21.399 546 H ARG 72 H ARG 72 23.556 -21.979 25.596 547 HA ARG 72 HA ARG 72 24.707 -24.558 25.062 548 HB2 ARG 72 HB3 ARG 72 25.311 -24.506 27.489 549 HB3 ARG 72 HB2 ARG 72 25.903 -23.131 26.568 550 HG2 ARG 72 HG3 ARG 72 24.266 -21.690 27.488 551 HG3 ARG 72 HG2 ARG 72 23.373 -23.041 28.190 552 HD2 ARG 72 HD3 ARG 72 24.626 -21.871 29.904 553 HD3 ARG 72 HD2 ARG 72 25.266 -23.497 29.682 554 HE ARG 72 HE ARG 72 27.069 -22.436 28.340 555 HH11 ARG 72 HH11 ARG 72 25.282 -20.583 30.707 556 HH12 ARG 72 HH12 ARG 72 26.554 -19.438 30.986 557 HH21 ARG 72 HH21 ARG 72 28.778 -20.947 28.706 558 HH22 ARG 72 HH22 ARG 72 28.542 -19.631 29.817 559 H CYS 73 H CYS 73 23.532 -26.329 24.963 560 HA CYS 73 HA CYS 73 21.010 -26.557 26.342 561 HB2 CYS 73 HB3 CYS 73 21.389 -27.560 24.100 562 HB3 CYS 73 HB2 CYS 73 22.553 -28.667 24.819 563 H VAL 74 H VAL 74 21.174 -26.663 28.472 564 HA VAL 74 HA VAL 74 22.227 -28.989 29.718 565 HB VAL 74 HB VAL 74 24.330 -27.724 29.423 566 HG11 VAL 74 HG11 VAL 74 23.019 -25.635 31.158 567 HG12 VAL 74 HG12 VAL 74 23.469 -25.457 29.463 568 HG13 VAL 74 HG13 VAL 74 24.719 -25.657 30.692 569 HG21 VAL 74 HG21 VAL 74 25.081 -27.827 31.767 570 HG22 VAL 74 HG22 VAL 74 24.132 -29.236 31.295 571 HG23 VAL 74 HG23 VAL 74 23.399 -27.971 32.277 572 H ARG 75 H ARG 75 21.361 -29.257 31.767 573 HA ARG 75 HA ARG 75 19.566 -27.117 32.678 574 HB2 ARG 75 HB3 ARG 75 18.787 -29.536 31.477 575 HB3 ARG 75 HB2 ARG 75 18.487 -29.749 33.195 576 HG2 ARG 75 HG3 ARG 75 17.461 -27.449 31.549 577 HG3 ARG 75 HG2 ARG 75 16.538 -28.897 31.951 578 HD2 ARG 75 HD3 ARG 75 17.680 -26.909 33.906 579 HD3 ARG 75 HD2 ARG 75 15.985 -27.062 33.450 580 HE ARG 75 HE ARG 75 17.499 -28.828 35.197 581 HH11 ARG 75 HH11 ARG 75 14.553 -28.295 33.377 582 HH12 ARG 75 HH12 ARG 75 13.601 -29.354 34.375 583 HH21 ARG 75 HH21 ARG 75 16.259 -30.217 36.505 584 HH22 ARG 75 HH22 ARG 75 14.570 -30.444 36.157 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -0.965 -0.737 1.686 2 H2 GLY 1 HT2 GLY 1 -0.601 0.895 1.958 3 H3 GLY 1 HT3 GLY 1 0.351 -0.317 2.663 4 HA2 GLY 1 HA2 GLY 1 0.101 0.152 -0.256 5 HA3 GLY 1 HA3 GLY 1 1.440 0.715 0.735 6 HA PRO 2 HA PRO 2 2.309 -3.654 -0.754 7 HB2 PRO 2 HB3 PRO 2 4.381 -3.107 -2.412 8 HB3 PRO 2 HB2 PRO 2 2.701 -3.118 -2.958 9 HG2 PRO 2 HG3 PRO 2 4.461 -0.809 -2.280 10 HG3 PRO 2 HG2 PRO 2 3.269 -0.965 -3.581 11 HD2 PRO 2 HD3 PRO 2 2.825 0.374 -1.224 12 HD3 PRO 2 HD2 PRO 2 1.538 -0.336 -2.219 13 H THR 3 H THR 3 3.109 -4.179 1.260 14 HA THR 3 HA THR 3 5.857 -3.290 1.827 15 HB THR 3 HB THR 3 5.243 -3.664 4.267 16 HG1 THR 3 HG1 THR 3 3.121 -3.822 4.797 17 HG21 THR 3 HG21 THR 3 5.494 -1.427 3.309 18 HG22 THR 3 HG22 THR 3 4.190 -1.465 4.495 19 HG23 THR 3 HG23 THR 3 3.814 -1.462 2.772 20 H SER 4 H SER 4 7.276 -4.890 1.670 21 HA SER 4 HA SER 4 6.548 -7.444 2.932 22 HB2 SER 4 HB3 SER 4 8.305 -6.999 0.507 23 HB3 SER 4 HB2 SER 4 8.235 -8.522 1.396 24 HG SER 4 HG SER 4 5.801 -7.428 0.611 25 H GLU 5 H GLU 5 7.383 -7.096 4.895 26 HA GLU 5 HA GLU 5 10.279 -6.566 5.040 27 HB2 GLU 5 HB3 GLU 5 8.207 -5.661 7.050 28 HB3 GLU 5 HB2 GLU 5 9.933 -5.337 7.107 29 HG2 GLU 5 HG3 GLU 5 9.715 -4.039 5.018 30 HG3 GLU 5 HG2 GLU 5 7.972 -4.294 5.078 31 H GLY 6 H GLY 6 11.189 -8.429 5.615 32 HA2 GLY 6 HA3 GLY 6 10.202 -9.840 7.926 33 HA3 GLY 6 HA2 GLY 6 10.019 -10.715 6.415 34 H CYS 7 H CYS 7 11.511 -11.581 8.574 35 HA CYS 7 HA CYS 7 14.286 -11.323 7.656 36 HB2 CYS 7 HB3 CYS 7 13.206 -12.455 10.248 37 HB3 CYS 7 HB2 CYS 7 14.904 -12.211 9.850 38 H GLN 8 H GLN 8 15.460 -13.166 7.107 39 HA GLN 8 HA GLN 8 13.867 -15.246 5.966 40 HB2 GLN 8 HB3 GLN 8 15.967 -16.150 5.135 41 HB3 GLN 8 HB2 GLN 8 15.870 -14.424 4.831 42 HG2 GLN 8 HG3 GLN 8 17.425 -13.924 6.514 43 HG3 GLN 8 HG2 GLN 8 17.288 -15.530 7.227 44 HE21 GLN 8 HE21 GLN 8 17.404 -16.907 4.674 45 HE22 GLN 8 HE22 GLN 8 19.052 -16.823 4.157 46 H ILE 9 H ILE 9 15.019 -17.562 6.157 47 HA ILE 9 HA ILE 9 14.553 -18.362 8.913 48 HB ILE 9 HB ILE 9 14.892 -19.906 6.344 49 HG12 ILE 9 HG13 ILE 9 12.562 -19.522 8.230 50 HG13 ILE 9 HG12 ILE 9 12.730 -18.840 6.615 51 HG21 ILE 9 HG21 ILE 9 14.403 -21.953 7.599 52 HG22 ILE 9 HG22 ILE 9 14.520 -21.042 9.106 53 HG23 ILE 9 HG23 ILE 9 15.938 -21.225 8.073 54 HD11 ILE 9 HD11 ILE 9 12.469 -21.762 7.285 55 HD12 ILE 9 HD12 ILE 9 12.656 -21.091 5.665 56 HD13 ILE 9 HD13 ILE 9 11.213 -20.725 6.611 57 H ILE 10 H ILE 10 16.143 -18.621 10.294 58 HA ILE 10 HA ILE 10 18.891 -18.374 9.509 59 HB ILE 10 HB ILE 10 17.775 -19.017 12.244 60 HG12 ILE 10 HG13 ILE 10 18.418 -16.305 11.063 61 HG13 ILE 10 HG12 ILE 10 16.793 -16.944 11.282 62 HG21 ILE 10 HG21 ILE 10 20.159 -19.439 12.057 63 HG22 ILE 10 HG22 ILE 10 19.871 -18.013 13.055 64 HG23 ILE 10 HG23 ILE 10 20.413 -17.828 11.388 65 HD11 ILE 10 HD11 ILE 10 17.370 -15.392 13.050 66 HD12 ILE 10 HD12 ILE 10 18.777 -16.368 13.468 67 HD13 ILE 10 HD13 ILE 10 17.153 -17.019 13.696 68 H HIS 11 H HIS 11 20.479 -19.920 9.540 69 HA HIS 11 HA HIS 11 19.675 -22.695 9.496 70 HB2 HIS 11 HB3 HIS 11 22.444 -21.472 9.365 71 HB3 HIS 11 HB2 HIS 11 22.055 -23.156 9.051 72 HD1 HIS 11 HD1 HIS 11 23.305 -20.846 7.100 73 HD2 HIS 11 HD2 HIS 11 19.517 -22.568 6.967 74 HE1 HIS 11 HE1 HIS 11 22.520 -20.586 4.719 75 HE2 HIS 11 HE2 HIS 11 20.194 -21.561 4.679 76 HA PRO 12 HA PRO 12 20.392 -23.305 13.896 77 HB2 PRO 12 HB3 PRO 12 20.420 -26.152 13.100 78 HB3 PRO 12 HB2 PRO 12 19.398 -25.324 14.279 79 HG2 PRO 12 HG3 PRO 12 18.420 -26.144 11.925 80 HG3 PRO 12 HG2 PRO 12 17.880 -24.632 12.676 81 HD2 PRO 12 HD3 PRO 12 19.805 -25.048 10.424 82 HD3 PRO 12 HD2 PRO 12 18.552 -23.803 10.622 83 HA PRO 13 HA PRO 13 24.834 -23.681 13.193 84 HB2 PRO 13 HB3 PRO 13 25.543 -22.983 15.747 85 HB3 PRO 13 HB2 PRO 13 25.169 -21.821 14.471 86 HG2 PRO 13 HG3 PRO 13 23.447 -22.808 16.704 87 HG3 PRO 13 HG2 PRO 13 23.594 -21.171 16.038 88 HD2 PRO 13 HD3 PRO 13 21.521 -22.805 15.432 89 HD3 PRO 13 HD2 PRO 13 22.173 -21.622 14.281 90 H TRP 14 H TRP 14 23.994 -24.558 16.529 91 HA TRP 14 HA TRP 14 25.376 -27.110 16.142 92 HB2 TRP 14 HB3 TRP 14 26.077 -25.566 18.009 93 HB3 TRP 14 HB2 TRP 14 24.501 -25.828 18.743 94 HD1 TRP 14 HD1 TRP 14 24.872 -27.337 20.762 95 HE1 TRP 14 HE1 TRP 14 26.131 -29.529 21.229 96 HE3 TRP 14 HE3 TRP 14 27.167 -27.928 16.229 97 HZ2 TRP 14 HZ2 TRP 14 27.868 -31.282 19.851 98 HZ3 TRP 14 HZ3 TRP 14 28.609 -29.891 15.888 99 HH2 TRP 14 HH2 TRP 14 28.952 -31.531 17.658 100 H GLU 15 H GLU 15 24.258 -28.806 17.846 101 HA GLU 15 HA GLU 15 21.847 -29.510 16.564 102 HB2 GLU 15 HB3 GLU 15 23.119 -30.611 19.070 103 HB3 GLU 15 HB2 GLU 15 21.735 -31.333 18.258 104 HG2 GLU 15 HG3 GLU 15 24.522 -31.008 17.165 105 HG3 GLU 15 HG2 GLU 15 23.708 -32.512 17.602 106 H GLY 16 H GLY 16 20.358 -27.947 16.775 107 HA2 GLY 16 HA3 GLY 16 18.769 -28.022 19.177 108 HA3 GLY 16 HA2 GLY 16 19.502 -26.452 18.851 109 H GLY 17 H GLY 17 17.374 -25.563 18.542 110 HA2 GLY 17 HA3 GLY 17 16.666 -25.639 15.760 111 HA3 GLY 17 HA2 GLY 17 15.441 -26.375 16.784 112 H ILE 18 H ILE 18 14.258 -24.519 15.698 113 HA ILE 18 HA ILE 18 14.454 -22.194 17.475 114 HB ILE 18 HB ILE 18 14.189 -22.187 14.487 115 HG12 ILE 18 HG13 ILE 18 15.926 -20.765 16.502 116 HG13 ILE 18 HG12 ILE 18 16.423 -22.054 15.411 117 HG21 ILE 18 HG21 ILE 18 13.485 -19.914 16.343 118 HG22 ILE 18 HG22 ILE 18 12.358 -20.798 15.316 119 HG23 ILE 18 HG23 ILE 18 13.620 -19.803 14.589 120 HD11 ILE 18 HD11 ILE 18 16.087 -20.597 13.498 121 HD12 ILE 18 HD12 ILE 18 17.209 -19.877 14.652 122 HD13 ILE 18 HD13 ILE 18 15.543 -19.304 14.565 123 H ARG 19 H ARG 19 12.670 -21.440 18.293 124 HA ARG 19 HA ARG 19 10.205 -22.941 17.802 125 HB2 ARG 19 HB3 ARG 19 11.234 -22.746 20.095 126 HB3 ARG 19 HB2 ARG 19 10.872 -21.030 20.041 127 HG2 ARG 19 HG3 ARG 19 9.151 -22.092 21.296 128 HG3 ARG 19 HG2 ARG 19 8.467 -21.590 19.750 129 HD2 ARG 19 HD3 ARG 19 7.664 -23.778 20.196 130 HD3 ARG 19 HD2 ARG 19 8.870 -23.912 18.916 131 HE ARG 19 HE ARG 19 9.753 -24.365 21.666 132 HH11 ARG 19 HH11 ARG 19 8.855 -25.709 18.555 133 HH12 ARG 19 HH12 ARG 19 9.568 -27.263 18.874 134 HH21 ARG 19 HH21 ARG 19 10.665 -26.435 22.099 135 HH22 ARG 19 HH22 ARG 19 10.582 -27.672 20.875 136 H TYR 20 H TYR 20 8.579 -22.006 16.721 137 HA TYR 20 HA TYR 20 8.626 -19.093 16.351 138 HB2 TYR 20 HB3 TYR 20 7.014 -21.247 14.949 139 HB3 TYR 20 HB2 TYR 20 6.924 -19.524 14.589 140 HD1 TYR 20 HD1 TYR 20 8.915 -22.568 14.234 141 HD2 TYR 20 HD2 TYR 20 8.770 -18.386 13.463 142 HE1 TYR 20 HE1 TYR 20 10.777 -22.802 12.643 143 HE2 TYR 20 HE2 TYR 20 10.632 -18.609 11.870 144 HH TYR 20 HH TYR 20 12.507 -20.158 11.433 145 H ARG 21 H ARG 21 5.949 -18.539 15.982 146 HA ARG 21 HA ARG 21 4.946 -19.049 18.699 147 HB2 ARG 21 HB3 ARG 21 5.322 -16.652 17.815 148 HB3 ARG 21 HB2 ARG 21 3.866 -16.925 16.862 149 HG2 ARG 21 HG3 ARG 21 2.680 -17.492 18.984 150 HG3 ARG 21 HG2 ARG 21 4.123 -16.980 19.860 151 HD2 ARG 21 HD3 ARG 21 2.338 -15.308 18.106 152 HD3 ARG 21 HD2 ARG 21 2.568 -15.167 19.845 153 HE ARG 21 HE ARG 21 4.276 -14.128 17.757 154 HH11 ARG 21 HH11 ARG 21 4.135 -15.069 21.140 155 HH12 ARG 21 HH12 ARG 21 5.351 -13.920 21.626 156 HH21 ARG 21 HH21 ARG 21 5.816 -12.593 18.421 157 HH22 ARG 21 HH22 ARG 21 6.275 -12.481 20.095 158 H GLY 22 H GLY 22 3.492 -18.413 15.499 159 HA2 GLY 22 HA3 GLY 22 1.429 -20.408 16.189 160 HA3 GLY 22 HA2 GLY 22 1.174 -19.041 15.115 161 H LEU 23 H LEU 23 3.745 -21.484 15.268 162 HA LEU 23 HA LEU 23 2.962 -22.389 12.593 163 HB2 LEU 23 HB3 LEU 23 5.743 -21.553 13.423 164 HB3 LEU 23 HB2 LEU 23 5.392 -22.466 11.968 165 HG LEU 23 HG LEU 23 4.363 -19.687 12.554 166 HD11 LEU 23 HD11 LEU 23 6.766 -19.688 12.186 167 HD12 LEU 23 HD12 LEU 23 5.923 -18.976 10.810 168 HD13 LEU 23 HD13 LEU 23 6.550 -20.621 10.704 169 HD21 LEU 23 HD21 LEU 23 4.202 -21.373 10.060 170 HD22 LEU 23 HD22 LEU 23 3.654 -19.705 10.217 171 HD23 LEU 23 HD23 LEU 23 2.858 -20.985 11.133 172 H THR 24 H THR 24 2.322 -24.385 13.112 173 HA THR 24 HA THR 24 3.956 -26.095 14.791 174 HB THR 24 HB THR 24 1.425 -26.154 14.800 175 HG1 THR 24 HG1 THR 24 2.517 -27.879 15.711 176 HG21 THR 24 HG21 THR 24 1.843 -27.590 12.174 177 HG22 THR 24 HG22 THR 24 1.031 -26.040 12.394 178 HG23 THR 24 HG23 THR 24 0.324 -27.508 13.069 179 H ARG 25 H ARG 25 3.980 -28.527 13.676 180 HA ARG 25 HA ARG 25 6.102 -28.318 11.818 181 HB2 ARG 25 HB3 ARG 25 5.954 -30.794 11.695 182 HB3 ARG 25 HB2 ARG 25 6.012 -30.181 13.341 183 HG2 ARG 25 HG3 ARG 25 3.584 -30.469 13.525 184 HG3 ARG 25 HG2 ARG 25 3.546 -31.115 11.883 185 HD2 ARG 25 HD3 ARG 25 4.954 -32.969 12.552 186 HD3 ARG 25 HD2 ARG 25 5.107 -32.297 14.176 187 HE ARG 25 HE ARG 25 2.382 -32.727 13.437 188 HH11 ARG 25 HH11 ARG 25 5.257 -34.367 14.606 189 HH12 ARG 25 HH12 ARG 25 4.354 -35.620 15.414 190 HH21 ARG 25 HH21 ARG 25 1.212 -34.363 14.517 191 HH22 ARG 25 HH22 ARG 25 2.074 -35.625 15.346 192 H ASP 26 H ASP 26 5.772 -30.258 9.935 193 HA ASP 26 HA ASP 26 5.214 -30.490 7.754 194 HB2 ASP 26 HB3 ASP 26 2.953 -30.985 8.298 195 HB3 ASP 26 HB2 ASP 26 2.602 -29.301 8.677 196 H GLN 27 H GLN 27 4.251 -27.324 9.018 197 HA GLN 27 HA GLN 27 4.983 -25.912 6.631 198 HB2 GLN 27 HB3 GLN 27 4.371 -25.016 9.448 199 HB3 GLN 27 HB2 GLN 27 4.733 -23.900 8.140 200 HG2 GLN 27 HG3 GLN 27 2.804 -24.638 6.912 201 HG3 GLN 27 HG2 GLN 27 2.465 -25.873 8.125 202 HE21 GLN 27 HE21 GLN 27 3.098 -24.199 10.382 203 HE22 GLN 27 HE22 GLN 27 1.809 -23.058 10.532 204 H VAL 28 H VAL 28 6.354 -23.738 7.923 205 HA VAL 28 HA VAL 28 8.463 -22.941 8.063 206 HB VAL 28 HB VAL 28 9.790 -23.632 9.921 207 HG11 VAL 28 HG11 VAL 28 6.866 -23.935 10.575 208 HG12 VAL 28 HG12 VAL 28 7.758 -22.420 10.434 209 HG13 VAL 28 HG13 VAL 28 8.147 -23.555 11.726 210 HG21 VAL 28 HG21 VAL 28 9.791 -26.058 9.576 211 HG22 VAL 28 HG22 VAL 28 8.111 -26.136 10.111 212 HG23 VAL 28 HG23 VAL 28 9.374 -25.641 11.239 213 H LYS 29 H LYS 29 8.013 -24.883 5.988 214 HA LYS 29 HA LYS 29 10.570 -26.288 5.782 215 HB2 LYS 29 HB3 LYS 29 9.450 -27.315 3.735 216 HB3 LYS 29 HB2 LYS 29 8.756 -27.722 5.296 217 HG2 LYS 29 HG3 LYS 29 7.070 -25.898 4.909 218 HG3 LYS 29 HG2 LYS 29 7.685 -25.793 3.258 219 HD2 LYS 29 HD3 LYS 29 7.035 -28.036 2.792 220 HD3 LYS 29 HD2 LYS 29 6.675 -28.347 4.491 221 HE2 LYS 29 HE3 LYS 29 4.902 -26.576 4.331 222 HE3 LYS 29 HE2 LYS 29 5.186 -26.543 2.592 223 HZ1 LYS 29 HZ1 LYS 29 4.544 -28.843 2.442 224 HZ2 LYS 29 HZ2 LYS 29 3.314 -27.973 3.224 225 HZ3 LYS 29 HZ3 LYS 29 4.364 -28.949 4.124 226 H ALA 30 H ALA 30 8.760 -23.660 4.421 227 HA ALA 30 HA ALA 30 11.124 -22.730 3.068 228 HB1 ALA 30 HB1 ALA 30 10.155 -22.560 0.861 229 HB2 ALA 30 HB2 ALA 30 8.666 -23.317 1.428 230 HB3 ALA 30 HB3 ALA 30 10.168 -24.242 1.391 231 H ILE 31 H ILE 31 11.037 -20.945 4.307 232 HA ILE 31 HA ILE 31 8.900 -19.043 3.633 233 HB ILE 31 HB ILE 31 10.276 -19.163 6.332 234 HG12 ILE 31 HG13 ILE 31 7.458 -20.014 5.607 235 HG13 ILE 31 HG12 ILE 31 8.779 -21.111 5.992 236 HG21 ILE 31 HG21 ILE 31 7.901 -17.558 5.377 237 HG22 ILE 31 HG22 ILE 31 9.531 -16.934 5.630 238 HG23 ILE 31 HG23 ILE 31 8.590 -17.526 7.000 239 HD11 ILE 31 HD11 ILE 31 7.277 -20.820 7.879 240 HD12 ILE 31 HD12 ILE 31 7.577 -19.082 7.860 241 HD13 ILE 31 HD13 ILE 31 8.886 -20.199 8.246 242 H ASN 32 H ASN 32 9.637 -16.964 3.159 243 HA ASN 32 HA ASN 32 12.567 -16.775 2.966 244 HB2 ASN 32 HB3 ASN 32 10.452 -15.369 1.321 245 HB3 ASN 32 HB2 ASN 32 12.188 -15.127 1.154 246 HD21 ASN 32 HD21 ASN 32 9.504 -17.089 0.373 247 HD22 ASN 32 HD22 ASN 32 10.352 -18.283 -0.556 248 H PHE 33 H PHE 33 9.650 -15.089 3.969 249 HA PHE 33 HA PHE 33 11.366 -13.269 5.507 250 HB2 PHE 33 HB3 PHE 33 8.958 -12.427 3.884 251 HB3 PHE 33 HB2 PHE 33 9.861 -11.383 4.975 252 HD1 PHE 33 HD1 PHE 33 9.603 -12.682 1.663 253 HD2 PHE 33 HD2 PHE 33 12.306 -10.948 4.452 254 HE1 PHE 33 HE1 PHE 33 11.116 -12.085 -0.183 255 HE2 PHE 33 HE2 PHE 33 13.825 -10.344 2.613 256 HZ PHE 33 HZ PHE 33 13.228 -10.914 0.289 257 H LEU 34 H LEU 34 10.937 -13.931 7.532 258 HA LEU 34 HA LEU 34 8.240 -14.407 8.452 259 HB2 LEU 34 HB3 LEU 34 10.903 -14.158 9.844 260 HB3 LEU 34 HB2 LEU 34 9.408 -14.227 10.751 261 HG LEU 34 HG LEU 34 10.371 -16.406 10.754 262 HD11 LEU 34 HD11 LEU 34 7.959 -16.357 10.544 263 HD12 LEU 34 HD12 LEU 34 8.624 -17.739 9.672 264 HD13 LEU 34 HD13 LEU 34 8.093 -16.309 8.787 265 HD21 LEU 34 HD21 LEU 34 10.452 -16.246 7.745 266 HD22 LEU 34 HD22 LEU 34 10.876 -17.655 8.717 267 HD23 LEU 34 HD23 LEU 34 11.844 -16.185 8.826 268 HA PRO 35 HA PRO 35 7.078 -10.178 8.417 269 HB2 PRO 35 HB3 PRO 35 5.333 -10.381 10.623 270 HB3 PRO 35 HB2 PRO 35 4.917 -10.549 8.917 271 HG2 PRO 35 HG3 PRO 35 5.466 -12.650 10.949 272 HG3 PRO 35 HG2 PRO 35 4.353 -12.676 9.568 273 HD2 PRO 35 HD3 PRO 35 6.665 -14.021 9.507 274 HD3 PRO 35 HD2 PRO 35 6.041 -13.200 8.059 275 H VAL 36 H VAL 36 7.839 -8.372 9.273 276 HA VAL 36 HA VAL 36 9.686 -8.175 11.293 277 HB VAL 36 HB VAL 36 9.293 -6.383 9.689 278 HG11 VAL 36 HG11 VAL 36 6.715 -5.894 11.171 279 HG12 VAL 36 HG12 VAL 36 6.872 -6.521 9.532 280 HG13 VAL 36 HG13 VAL 36 7.377 -4.871 9.896 281 HG21 VAL 36 HG21 VAL 36 10.414 -5.789 11.770 282 HG22 VAL 36 HG22 VAL 36 8.856 -5.439 12.520 283 HG23 VAL 36 HG23 VAL 36 9.432 -4.447 11.179 284 H ASP 37 H ASP 37 9.664 -7.704 13.460 285 HA ASP 37 HA ASP 37 8.935 -7.430 15.594 286 HB2 ASP 37 HB3 ASP 37 7.184 -5.917 14.732 287 HB3 ASP 37 HB2 ASP 37 6.129 -7.299 14.466 288 H TYR 38 H TYR 38 8.251 -9.991 13.605 289 HA TYR 38 HA TYR 38 6.881 -11.744 15.364 290 HB2 TYR 38 HB3 TYR 38 7.355 -12.035 12.843 291 HB3 TYR 38 HB2 TYR 38 8.936 -12.625 13.336 292 HD1 TYR 38 HD1 TYR 38 9.062 -14.725 14.754 293 HD2 TYR 38 HD2 TYR 38 5.450 -13.410 12.927 294 HE1 TYR 38 HE1 TYR 38 8.104 -16.972 15.037 295 HE2 TYR 38 HE2 TYR 38 4.485 -15.653 13.210 296 HH TYR 38 HH TYR 38 5.203 -17.947 13.511 297 H GLU 39 H GLU 39 7.673 -13.200 16.887 298 HA GLU 39 HA GLU 39 10.479 -12.784 17.677 299 HB2 GLU 39 HB3 GLU 39 8.105 -13.313 19.471 300 HB3 GLU 39 HB2 GLU 39 9.770 -13.133 20.002 301 HG2 GLU 39 HG3 GLU 39 9.801 -10.836 19.285 302 HG3 GLU 39 HG2 GLU 39 8.179 -10.993 18.608 303 H ILE 40 H ILE 40 11.692 -14.542 17.506 304 HA ILE 40 HA ILE 40 10.401 -17.178 17.786 305 HB ILE 40 HB ILE 40 12.262 -18.128 16.487 306 HG12 ILE 40 HG13 ILE 40 13.063 -15.258 15.961 307 HG13 ILE 40 HG12 ILE 40 13.920 -16.348 17.044 308 HG21 ILE 40 HG21 ILE 40 11.563 -17.275 14.303 309 HG22 ILE 40 HG22 ILE 40 10.805 -15.889 15.086 310 HG23 ILE 40 HG23 ILE 40 10.183 -17.514 15.375 311 HD11 ILE 40 HD11 ILE 40 14.375 -17.838 15.143 312 HD12 ILE 40 HD12 ILE 40 15.050 -16.222 14.923 313 HD13 ILE 40 HD13 ILE 40 13.573 -16.685 14.077 314 H GLU 41 H GLU 41 11.814 -18.886 18.676 315 HA GLU 41 HA GLU 41 13.561 -17.803 20.792 316 HB2 GLU 41 HB3 GLU 41 11.374 -18.361 21.711 317 HB3 GLU 41 HB2 GLU 41 11.465 -19.969 21.015 318 HG2 GLU 41 HG3 GLU 41 13.207 -20.601 22.500 319 HG3 GLU 41 HG2 GLU 41 13.396 -18.945 23.075 320 H TYR 42 H TYR 42 15.209 -19.219 21.555 321 HA TYR 42 HA TYR 42 16.083 -21.161 19.540 322 HB2 TYR 42 HB3 TYR 42 17.568 -19.547 21.601 323 HB3 TYR 42 HB2 TYR 42 18.305 -20.946 20.829 324 HD1 TYR 42 HD1 TYR 42 19.515 -20.637 18.894 325 HD2 TYR 42 HD2 TYR 42 16.558 -17.771 19.948 326 HE1 TYR 42 HE1 TYR 42 20.208 -19.236 16.994 327 HE2 TYR 42 HE2 TYR 42 17.239 -16.369 18.056 328 HH TYR 42 HH TYR 42 19.312 -17.468 15.583 329 H VAL 43 H VAL 43 15.262 -23.095 20.064 330 HA VAL 43 HA VAL 43 15.593 -24.047 22.825 331 HB VAL 43 HB VAL 43 14.055 -25.883 22.210 332 HG11 VAL 43 HG11 VAL 43 12.964 -23.128 21.645 333 HG12 VAL 43 HG12 VAL 43 13.184 -23.849 23.240 334 HG13 VAL 43 HG13 VAL 43 12.016 -24.541 22.114 335 HG21 VAL 43 HG21 VAL 43 13.790 -24.402 19.594 336 HG22 VAL 43 HG22 VAL 43 12.793 -25.763 20.109 337 HG23 VAL 43 HG23 VAL 43 14.518 -25.991 19.820 338 H CYS 44 H CYS 44 16.192 -26.422 22.989 339 HA CYS 44 HA CYS 44 18.470 -26.899 21.239 340 HB2 CYS 44 HB3 CYS 44 18.695 -27.073 23.736 341 HB3 CYS 44 HB2 CYS 44 17.620 -28.466 23.682 342 H ARG 45 H ARG 45 18.803 -29.373 20.782 343 HA ARG 45 HA ARG 45 16.617 -30.025 19.040 344 HB2 ARG 45 HB3 ARG 45 19.171 -30.292 18.625 345 HB3 ARG 45 HB2 ARG 45 18.998 -31.798 19.516 346 HG2 ARG 45 HG3 ARG 45 17.337 -31.130 17.104 347 HG3 ARG 45 HG2 ARG 45 18.888 -31.961 17.004 348 HD2 ARG 45 HD3 ARG 45 18.080 -33.831 18.175 349 HD3 ARG 45 HD2 ARG 45 16.656 -32.963 18.747 350 HE ARG 45 HE ARG 45 16.701 -33.110 15.902 351 HH11 ARG 45 HH11 ARG 45 16.119 -35.061 18.754 352 HH12 ARG 45 HH12 ARG 45 14.905 -36.043 17.992 353 HH21 ARG 45 HH21 ARG 45 15.132 -34.425 14.884 354 HH22 ARG 45 HH22 ARG 45 14.345 -35.683 15.791 355 H GLY 46 H GLY 46 14.865 -30.644 20.239 356 HA2 GLY 46 HA3 GLY 46 13.639 -32.655 20.634 357 HA3 GLY 46 HA2 GLY 46 15.103 -33.386 21.268 358 H GLU 47 H GLU 47 15.059 -33.722 23.351 359 HA GLU 47 HA GLU 47 13.203 -32.138 24.995 360 HB2 GLU 47 HB3 GLU 47 13.346 -34.116 26.555 361 HB3 GLU 47 HB2 GLU 47 12.592 -34.434 24.999 362 HG2 GLU 47 HG3 GLU 47 14.771 -35.354 24.213 363 HG3 GLU 47 HG2 GLU 47 15.379 -35.170 25.857 364 H ARG 48 H ARG 48 15.838 -31.231 24.321 365 HA ARG 48 HA ARG 48 17.138 -31.274 26.965 366 HB2 ARG 48 HB3 ARG 48 18.408 -30.545 24.317 367 HB3 ARG 48 HB2 ARG 48 19.225 -30.757 25.859 368 HG2 ARG 48 HG3 ARG 48 17.827 -32.931 24.312 369 HG3 ARG 48 HG2 ARG 48 19.569 -32.656 24.353 370 HD2 ARG 48 HD3 ARG 48 17.895 -33.216 26.795 371 HD3 ARG 48 HD2 ARG 48 18.744 -34.461 25.879 372 HE ARG 48 HE ARG 48 20.637 -32.538 26.501 373 HH11 ARG 48 HH11 ARG 48 18.477 -34.645 28.283 374 HH12 ARG 48 HH12 ARG 48 19.574 -34.852 29.611 375 HH21 ARG 48 HH21 ARG 48 22.080 -32.819 28.259 376 HH22 ARG 48 HH22 ARG 48 21.609 -33.821 29.604 377 H GLU 49 H GLU 49 17.665 -29.287 27.912 378 HA GLU 49 HA GLU 49 16.341 -26.988 26.660 379 HB2 GLU 49 HB3 GLU 49 17.044 -27.457 29.559 380 HB3 GLU 49 HB2 GLU 49 16.249 -26.020 28.932 381 HG2 GLU 49 HG3 GLU 49 14.375 -27.092 29.510 382 HG3 GLU 49 HG2 GLU 49 14.608 -27.944 27.986 383 H VAL 50 H VAL 50 17.268 -24.845 27.184 384 HA VAL 50 HA VAL 50 20.209 -24.866 27.179 385 HB VAL 50 HB VAL 50 20.215 -23.056 25.520 386 HG11 VAL 50 HG11 VAL 50 18.742 -25.512 24.595 387 HG12 VAL 50 HG12 VAL 50 20.491 -25.307 24.701 388 HG13 VAL 50 HG13 VAL 50 19.561 -24.356 23.544 389 HG21 VAL 50 HG21 VAL 50 18.174 -22.515 24.256 390 HG22 VAL 50 HG22 VAL 50 18.048 -22.072 25.958 391 HG23 VAL 50 HG23 VAL 50 17.239 -23.522 25.362 392 H VAL 51 H VAL 51 21.187 -22.991 28.107 393 HA VAL 51 HA VAL 51 19.278 -21.133 29.364 394 HB VAL 51 HB VAL 51 20.495 -22.304 31.093 395 HG11 VAL 51 HG11 VAL 51 22.936 -22.128 31.325 396 HG12 VAL 51 HG12 VAL 51 23.013 -21.338 29.749 397 HG13 VAL 51 HG13 VAL 51 22.459 -23.007 29.872 398 HG21 VAL 51 HG21 VAL 51 21.510 -20.411 32.270 399 HG22 VAL 51 HG22 VAL 51 19.976 -19.979 31.517 400 HG23 VAL 51 HG23 VAL 51 21.496 -19.481 30.772 401 H GLY 52 H GLY 52 19.105 -19.608 27.831 402 HA2 GLY 52 HA3 GLY 52 21.410 -17.878 27.459 403 HA3 GLY 52 HA2 GLY 52 20.785 -18.617 25.991 404 HA PRO 53 HA PRO 53 18.132 -14.839 26.887 405 HB2 PRO 53 HB3 PRO 53 19.324 -13.050 25.234 406 HB3 PRO 53 HB2 PRO 53 19.724 -13.173 26.952 407 HG2 PRO 53 HG3 PRO 53 21.193 -14.235 24.579 408 HG3 PRO 53 HG2 PRO 53 21.835 -13.505 26.062 409 HD2 PRO 53 HD3 PRO 53 21.771 -16.202 25.592 410 HD3 PRO 53 HD2 PRO 53 21.749 -15.480 27.213 411 H LYS 54 H LYS 54 17.269 -16.825 25.627 412 HA LYS 54 HA LYS 54 17.504 -16.771 22.769 413 HB2 LYS 54 HB3 LYS 54 15.714 -18.620 22.974 414 HB3 LYS 54 HB2 LYS 54 17.320 -18.937 23.619 415 HG2 LYS 54 HG3 LYS 54 16.583 -18.585 25.854 416 HG3 LYS 54 HG2 LYS 54 15.019 -17.971 25.306 417 HD2 LYS 54 HD3 LYS 54 14.519 -20.199 24.362 418 HD3 LYS 54 HD2 LYS 54 16.059 -20.790 24.988 419 HE2 LYS 54 HE3 LYS 54 14.246 -21.401 26.487 420 HE3 LYS 54 HE2 LYS 54 15.332 -20.253 27.267 421 HZ1 LYS 54 HZ1 LYS 54 13.750 -18.478 26.743 422 HZ2 LYS 54 HZ2 LYS 54 13.038 -19.687 27.696 423 HZ3 LYS 54 HZ3 LYS 54 12.697 -19.608 26.035 424 H VAL 55 H VAL 55 16.686 -14.781 22.164 425 HA VAL 55 HA VAL 55 13.872 -14.839 21.624 426 HB VAL 55 HB VAL 55 13.781 -13.813 23.828 427 HG11 VAL 55 HG11 VAL 55 16.044 -12.928 23.962 428 HG12 VAL 55 HG12 VAL 55 14.856 -11.671 24.307 429 HG13 VAL 55 HG13 VAL 55 15.656 -11.720 22.737 430 HG21 VAL 55 HG21 VAL 55 12.679 -11.672 23.232 431 HG22 VAL 55 HG22 VAL 55 12.160 -13.029 22.232 432 HG23 VAL 55 HG23 VAL 55 13.304 -11.849 21.592 433 H ARG 56 H ARG 56 13.549 -14.040 19.662 434 HA ARG 56 HA ARG 56 15.425 -12.016 18.622 435 HB2 ARG 56 HB3 ARG 56 14.266 -14.348 17.087 436 HB3 ARG 56 HB2 ARG 56 15.228 -13.056 16.390 437 HG2 ARG 56 HG3 ARG 56 16.180 -15.000 18.471 438 HG3 ARG 56 HG2 ARG 56 16.491 -15.123 16.738 439 HD2 ARG 56 HD3 ARG 56 17.583 -12.878 16.864 440 HD3 ARG 56 HD2 ARG 56 17.420 -12.965 18.619 441 HE ARG 56 HE ARG 56 18.890 -15.021 17.109 442 HH11 ARG 56 HH11 ARG 56 18.703 -12.677 19.700 443 HH12 ARG 56 HH12 ARG 56 20.260 -13.080 20.346 444 HH21 ARG 56 HH21 ARG 56 20.924 -15.567 17.968 445 HH22 ARG 56 HH22 ARG 56 21.521 -14.719 19.365 446 H LYS 57 H LYS 57 14.472 -10.312 17.659 447 HA LYS 57 HA LYS 57 11.645 -10.597 16.910 448 HB2 LYS 57 HB3 LYS 57 11.916 -9.166 18.913 449 HB3 LYS 57 HB2 LYS 57 12.985 -8.112 17.998 450 HG2 LYS 57 HG3 LYS 57 11.216 -7.416 16.573 451 HG3 LYS 57 HG2 LYS 57 10.135 -8.657 17.212 452 HD2 LYS 57 HD3 LYS 57 11.283 -6.369 18.810 453 HD3 LYS 57 HD2 LYS 57 9.657 -6.408 18.122 454 HE2 LYS 57 HE3 LYS 57 9.098 -8.340 19.470 455 HE3 LYS 57 HE2 LYS 57 10.741 -8.406 20.105 456 HZ1 LYS 57 HZ1 LYS 57 8.829 -6.171 20.509 457 HZ2 LYS 57 HZ2 LYS 57 10.403 -6.260 21.139 458 HZ3 LYS 57 HZ3 LYS 57 9.220 -7.353 21.660 459 H CYS 58 H CYS 58 11.272 -10.278 14.833 460 HA CYS 58 HA CYS 58 13.408 -9.718 13.061 461 HB2 CYS 58 HB3 CYS 58 11.501 -11.158 12.450 462 HB3 CYS 58 HB2 CYS 58 10.443 -9.751 12.478 463 H LEU 59 H LEU 59 13.952 -7.920 11.936 464 HA LEU 59 HA LEU 59 12.767 -5.419 12.920 465 HB2 LEU 59 HB3 LEU 59 15.448 -5.952 11.642 466 HB3 LEU 59 HB2 LEU 59 14.886 -4.382 12.183 467 HG LEU 59 HG LEU 59 15.362 -6.774 13.963 468 HD11 LEU 59 HD11 LEU 59 17.441 -5.884 13.089 469 HD12 LEU 59 HD12 LEU 59 17.271 -5.484 14.799 470 HD13 LEU 59 HD13 LEU 59 16.969 -4.256 13.571 471 HD21 LEU 59 HD21 LEU 59 15.060 -5.180 15.798 472 HD22 LEU 59 HD22 LEU 59 13.600 -5.324 14.820 473 HD23 LEU 59 HD23 LEU 59 14.650 -3.918 14.637 474 H ALA 60 H ALA 60 13.280 -3.579 11.184 475 HA ALA 60 HA ALA 60 11.684 -4.236 8.873 476 HB1 ALA 60 HB1 ALA 60 11.833 -1.861 8.351 477 HB2 ALA 60 HB2 ALA 60 13.054 -1.646 9.608 478 HB3 ALA 60 HB3 ALA 60 11.406 -2.103 10.046 479 H ASN 61 H ASN 61 14.439 -5.365 9.238 480 HA ASN 61 HA ASN 61 15.384 -4.796 6.537 481 HB2 ASN 61 HB3 ASN 61 17.744 -4.764 7.308 482 HB3 ASN 61 HB2 ASN 61 16.816 -3.416 7.957 483 HD21 ASN 61 HD21 ASN 61 18.488 -6.361 8.680 484 HD22 ASN 61 HD22 ASN 61 18.440 -6.202 10.404 485 H GLY 62 H GLY 62 17.201 -6.515 6.034 486 HA2 GLY 62 HA3 GLY 62 15.806 -9.015 6.337 487 HA3 GLY 62 HA2 GLY 62 17.229 -8.726 5.354 488 H SER 63 H SER 63 16.584 -8.469 8.861 489 HA SER 63 HA SER 63 18.040 -10.804 9.529 490 HB2 SER 63 HB3 SER 63 19.941 -9.272 8.868 491 HB3 SER 63 HB2 SER 63 19.487 -8.234 10.217 492 HG SER 63 HG SER 63 21.134 -10.163 10.368 493 H TRP 64 H TRP 64 18.225 -11.059 11.889 494 HA TRP 64 HA TRP 64 15.903 -9.870 13.163 495 HB2 TRP 64 HB3 TRP 64 17.767 -12.069 14.105 496 HB3 TRP 64 HB2 TRP 64 16.289 -11.571 14.923 497 HD1 TRP 64 HD1 TRP 64 17.444 -13.280 11.665 498 HE1 TRP 64 HE1 TRP 64 15.518 -14.756 10.792 499 HE3 TRP 64 HE3 TRP 64 13.824 -11.933 15.009 500 HZ2 TRP 64 HZ2 TRP 64 12.822 -15.264 11.439 501 HZ3 TRP 64 HZ3 TRP 64 11.596 -12.957 14.809 502 HH2 TRP 64 HH2 TRP 64 11.105 -14.587 13.062 503 H THR 65 H THR 65 16.344 -9.614 15.715 504 HA THR 65 HA THR 65 17.696 -7.203 15.980 505 HB THR 65 HB THR 65 17.577 -7.893 18.532 506 HG1 THR 65 HG1 THR 65 16.083 -9.524 18.902 507 HG21 THR 65 HG21 THR 65 16.192 -6.179 17.471 508 HG22 THR 65 HG22 THR 65 15.230 -7.174 18.563 509 HG23 THR 65 HG23 THR 65 15.129 -7.427 16.821 510 H ASP 66 H ASP 66 18.847 -10.475 16.582 511 HA ASP 66 HA ASP 66 21.569 -9.462 16.721 512 HB2 ASP 66 HB3 ASP 66 20.894 -9.492 19.093 513 HB3 ASP 66 HB2 ASP 66 20.358 -11.155 18.926 514 H MET 67 H MET 67 23.032 -10.930 15.822 515 HA MET 67 HA MET 67 22.241 -13.750 16.018 516 HB2 MET 67 HB3 MET 67 23.554 -12.481 13.602 517 HB3 MET 67 HB2 MET 67 23.319 -14.207 13.827 518 HG2 MET 67 HG3 MET 67 20.897 -13.882 13.780 519 HG3 MET 67 HG2 MET 67 21.135 -12.148 13.569 520 HE1 MET 67 HE1 MET 67 19.387 -14.073 11.651 521 HE2 MET 67 HE2 MET 67 19.822 -13.434 10.066 522 HE3 MET 67 HE3 MET 67 19.515 -12.332 11.410 523 H ASP 68 H ASP 68 23.609 -13.229 17.971 524 HA ASP 68 HA ASP 68 25.825 -14.950 17.544 525 HB2 ASP 68 HB3 ASP 68 27.014 -12.847 17.039 526 HB3 ASP 68 HB2 ASP 68 26.503 -12.185 18.590 527 H THR 69 H THR 69 24.656 -16.252 18.995 528 HA THR 69 HA THR 69 24.765 -15.336 21.766 529 HB THR 69 HB THR 69 22.188 -16.435 20.635 530 HG1 THR 69 HG1 THR 69 23.228 -13.872 20.605 531 HG21 THR 69 HG21 THR 69 22.538 -16.731 23.062 532 HG22 THR 69 HG22 THR 69 21.225 -15.604 22.711 533 HG23 THR 69 HG23 THR 69 22.798 -14.992 23.214 534 HA PRO 70 HA PRO 70 26.092 -19.610 21.820 535 HB2 PRO 70 HB3 PRO 70 27.013 -19.093 24.513 536 HB3 PRO 70 HB2 PRO 70 27.971 -19.341 23.052 537 HG2 PRO 70 HG3 PRO 70 27.819 -16.955 24.366 538 HG3 PRO 70 HG2 PRO 70 28.143 -17.101 22.631 539 HD2 PRO 70 HD3 PRO 70 25.578 -16.448 24.030 540 HD3 PRO 70 HD2 PRO 70 26.269 -15.740 22.553 541 H SER 71 H SER 71 23.450 -19.519 22.125 542 HA SER 71 HA SER 71 22.545 -20.326 24.700 543 HB2 SER 71 HB3 SER 71 20.557 -21.193 23.326 544 HB3 SER 71 HB2 SER 71 20.898 -19.465 23.227 545 HG SER 71 HG SER 71 21.757 -21.427 21.361 546 H ARG 72 H ARG 72 23.576 -22.007 25.578 547 HA ARG 72 HA ARG 72 24.236 -24.291 23.871 548 HB2 ARG 72 HB3 ARG 72 25.797 -24.899 25.731 549 HB3 ARG 72 HB2 ARG 72 26.154 -23.371 24.939 550 HG2 ARG 72 HG3 ARG 72 24.945 -22.226 26.812 551 HG3 ARG 72 HG2 ARG 72 24.878 -23.789 27.629 552 HD2 ARG 72 HD3 ARG 72 26.776 -22.411 28.386 553 HD3 ARG 72 HD2 ARG 72 27.296 -23.924 27.643 554 HE ARG 72 HE ARG 72 27.786 -22.605 25.615 555 HH11 ARG 72 HH11 ARG 72 27.611 -20.959 28.704 556 HH12 ARG 72 HH12 ARG 72 28.583 -19.612 28.182 557 HH21 ARG 72 HH21 ARG 72 29.086 -20.874 24.937 558 HH22 ARG 72 HH22 ARG 72 29.441 -19.574 26.033 559 H CYS 73 H CYS 73 23.634 -26.326 24.304 560 HA CYS 73 HA CYS 73 21.306 -26.713 25.931 561 HB2 CYS 73 HB3 CYS 73 23.016 -28.775 24.521 562 HB3 CYS 73 HB2 CYS 73 21.380 -29.011 25.129 563 H VAL 74 H VAL 74 21.378 -27.010 28.052 564 HA VAL 74 HA VAL 74 23.370 -28.771 29.208 565 HB VAL 74 HB VAL 74 24.555 -26.665 29.321 566 HG11 VAL 74 HG11 VAL 74 22.146 -25.560 30.759 567 HG12 VAL 74 HG12 VAL 74 22.674 -25.138 29.130 568 HG13 VAL 74 HG13 VAL 74 23.681 -24.724 30.517 569 HG21 VAL 74 HG21 VAL 74 24.820 -28.163 31.208 570 HG22 VAL 74 HG22 VAL 74 23.429 -27.434 32.014 571 HG23 VAL 74 HG23 VAL 74 24.894 -26.487 31.747 572 H ARG 75 H ARG 75 22.493 -29.957 30.762 573 HA ARG 75 HA ARG 75 19.808 -29.204 31.676 574 HB2 ARG 75 HB3 ARG 75 20.858 -31.620 30.637 575 HB3 ARG 75 HB2 ARG 75 20.484 -31.911 32.331 576 HG2 ARG 75 HG3 ARG 75 18.565 -30.760 30.318 577 HG3 ARG 75 HG2 ARG 75 18.619 -32.453 30.812 578 HD2 ARG 75 HD3 ARG 75 18.042 -31.874 33.067 579 HD3 ARG 75 HD2 ARG 75 18.209 -30.155 32.716 580 HE ARG 75 HE ARG 75 16.277 -30.601 31.081 581 HH11 ARG 75 HH11 ARG 75 16.719 -32.267 34.140 582 HH12 ARG 75 HH12 ARG 75 15.020 -32.500 34.411 583 HH21 ARG 75 HH21 ARG 75 14.053 -30.851 31.449 584 HH22 ARG 75 HH22 ARG 75 13.490 -31.697 32.868 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 8.398 -2.570 -5.881 2 H2 GLY 1 HT2 GLY 1 8.529 -1.148 -4.962 3 H3 GLY 1 HT3 GLY 1 8.322 -1.052 -6.640 4 HA2 GLY 1 HA2 GLY 1 6.266 -0.550 -5.462 5 HA3 GLY 1 HA3 GLY 1 6.122 -1.973 -6.486 6 HA PRO 2 HA PRO 2 4.599 -4.127 -2.921 7 HB2 PRO 2 HB3 PRO 2 5.563 -6.615 -4.132 8 HB3 PRO 2 HB2 PRO 2 3.905 -6.095 -3.818 9 HG2 PRO 2 HG3 PRO 2 4.922 -6.259 -6.317 10 HG3 PRO 2 HG2 PRO 2 3.705 -5.053 -5.860 11 HD2 PRO 2 HD3 PRO 2 6.661 -4.732 -6.198 12 HD3 PRO 2 HD2 PRO 2 5.345 -3.635 -6.672 13 H THR 3 H THR 3 6.122 -3.410 -1.405 14 HA THR 3 HA THR 3 8.620 -4.898 -1.165 15 HB THR 3 HB THR 3 8.983 -3.196 0.748 16 HG1 THR 3 HG1 THR 3 6.925 -2.364 0.990 17 HG21 THR 3 HG21 THR 3 8.754 -2.225 -2.103 18 HG22 THR 3 HG22 THR 3 10.137 -3.070 -1.406 19 HG23 THR 3 HG23 THR 3 9.700 -1.463 -0.824 20 H SER 4 H SER 4 9.133 -6.172 0.554 21 HA SER 4 HA SER 4 7.352 -6.289 2.845 22 HB2 SER 4 HB3 SER 4 8.107 -8.776 1.283 23 HB3 SER 4 HB2 SER 4 7.129 -8.713 2.751 24 HG SER 4 HG SER 4 6.083 -7.052 0.931 25 H GLU 5 H GLU 5 8.888 -5.563 4.207 26 HA GLU 5 HA GLU 5 11.550 -6.710 4.144 27 HB2 GLU 5 HB3 GLU 5 10.304 -4.491 5.757 28 HB3 GLU 5 HB2 GLU 5 11.907 -5.117 6.111 29 HG2 GLU 5 HG3 GLU 5 12.121 -3.140 4.794 30 HG3 GLU 5 HG2 GLU 5 12.603 -4.523 3.817 31 H GLY 6 H GLY 6 11.922 -8.527 5.139 32 HA2 GLY 6 HA3 GLY 6 10.891 -8.940 7.830 33 HA3 GLY 6 HA2 GLY 6 10.456 -10.140 6.618 34 H CYS 7 H CYS 7 11.703 -11.250 8.523 35 HA CYS 7 HA CYS 7 14.585 -11.188 8.043 36 HB2 CYS 7 HB3 CYS 7 13.067 -12.727 10.150 37 HB3 CYS 7 HB2 CYS 7 14.790 -12.372 10.121 38 H GLN 8 H GLN 8 15.673 -12.847 7.123 39 HA GLN 8 HA GLN 8 14.197 -14.789 5.641 40 HB2 GLN 8 HB3 GLN 8 16.419 -15.634 4.961 41 HB3 GLN 8 HB2 GLN 8 16.258 -13.899 4.736 42 HG2 GLN 8 HG3 GLN 8 17.660 -13.408 6.528 43 HG3 GLN 8 HG2 GLN 8 17.495 -15.018 7.218 44 HE21 GLN 8 HE21 GLN 8 17.942 -16.432 4.753 45 HE22 GLN 8 HE22 GLN 8 19.618 -16.265 4.376 46 H ILE 9 H ILE 9 15.136 -17.136 5.667 47 HA ILE 9 HA ILE 9 14.709 -18.179 8.338 48 HB ILE 9 HB ILE 9 15.005 -19.546 5.661 49 HG12 ILE 9 HG13 ILE 9 12.662 -19.213 7.545 50 HG13 ILE 9 HG12 ILE 9 12.872 -18.419 5.988 51 HG21 ILE 9 HG21 ILE 9 14.462 -21.641 6.800 52 HG22 ILE 9 HG22 ILE 9 14.524 -20.811 8.354 53 HG23 ILE 9 HG23 ILE 9 15.984 -20.962 7.375 54 HD11 ILE 9 HD11 ILE 9 11.294 -20.265 5.849 55 HD12 ILE 9 HD12 ILE 9 12.538 -21.381 6.412 56 HD13 ILE 9 HD13 ILE 9 12.719 -20.567 4.858 57 H ILE 10 H ILE 10 16.335 -18.429 9.650 58 HA ILE 10 HA ILE 10 19.069 -18.361 8.884 59 HB ILE 10 HB ILE 10 17.921 -19.343 11.507 60 HG12 ILE 10 HG13 ILE 10 18.706 -16.514 10.787 61 HG13 ILE 10 HG12 ILE 10 17.044 -17.097 10.817 62 HG21 ILE 10 HG21 ILE 10 20.592 -18.118 10.827 63 HG22 ILE 10 HG22 ILE 10 20.291 -19.814 11.201 64 HG23 ILE 10 HG23 ILE 10 20.053 -18.582 12.441 65 HD11 ILE 10 HD11 ILE 10 17.613 -15.885 12.846 66 HD12 ILE 10 HD12 ILE 10 18.921 -17.025 13.169 67 HD13 ILE 10 HD13 ILE 10 17.243 -17.573 13.190 68 H HIS 11 H HIS 11 20.523 -20.033 8.629 69 HA HIS 11 HA HIS 11 19.496 -22.669 8.145 70 HB2 HIS 11 HB3 HIS 11 22.279 -21.509 8.188 71 HB3 HIS 11 HB2 HIS 11 22.001 -23.234 7.984 72 HD1 HIS 11 HD1 HIS 11 23.194 -22.875 5.637 73 HD2 HIS 11 HD2 HIS 11 19.471 -21.070 6.066 74 HE1 HIS 11 HE1 HIS 11 22.441 -22.306 3.303 75 HE2 HIS 11 HE2 HIS 11 20.123 -21.351 3.575 76 HA PRO 12 HA PRO 12 19.633 -24.221 12.286 77 HB2 PRO 12 HB3 PRO 12 20.399 -26.787 11.003 78 HB3 PRO 12 HB2 PRO 12 19.051 -26.431 12.086 79 HG2 PRO 12 HG3 PRO 12 18.653 -26.823 9.477 80 HG3 PRO 12 HG2 PRO 12 17.721 -25.613 10.381 81 HD2 PRO 12 HD3 PRO 12 20.017 -25.229 8.506 82 HD3 PRO 12 HD2 PRO 12 18.563 -24.236 8.726 83 HA PRO 13 HA PRO 13 24.100 -23.992 12.738 84 HB2 PRO 13 HB3 PRO 13 24.104 -23.278 15.327 85 HB3 PRO 13 HB2 PRO 13 23.641 -22.142 14.056 86 HG2 PRO 13 HG3 PRO 13 21.906 -23.729 15.900 87 HG3 PRO 13 HG2 PRO 13 21.743 -22.040 15.386 88 HD2 PRO 13 HD3 PRO 13 20.324 -24.126 14.299 89 HD3 PRO 13 HD2 PRO 13 20.684 -22.617 13.438 90 H TRP 14 H TRP 14 24.969 -24.596 15.471 91 HA TRP 14 HA TRP 14 25.483 -27.322 15.287 92 HB2 TRP 14 HB3 TRP 14 26.730 -25.669 16.709 93 HB3 TRP 14 HB2 TRP 14 25.379 -25.706 17.840 94 HD1 TRP 14 HD1 TRP 14 25.362 -27.621 19.605 95 HE1 TRP 14 HE1 TRP 14 26.881 -29.648 20.091 96 HE3 TRP 14 HE3 TRP 14 28.269 -27.470 15.404 97 HZ2 TRP 14 HZ2 TRP 14 29.027 -30.996 18.846 98 HZ3 TRP 14 HZ3 TRP 14 30.032 -29.165 15.126 99 HH2 TRP 14 HH2 TRP 14 30.402 -30.890 16.811 100 H GLU 15 H GLU 15 24.656 -29.104 16.464 101 HA GLU 15 HA GLU 15 22.015 -29.544 16.096 102 HB2 GLU 15 HB3 GLU 15 23.915 -30.890 17.988 103 HB3 GLU 15 HB2 GLU 15 22.267 -31.457 17.755 104 HG2 GLU 15 HG3 GLU 15 24.447 -31.281 15.695 105 HG3 GLU 15 HG2 GLU 15 23.691 -32.738 16.344 106 H GLY 16 H GLY 16 20.536 -28.215 16.766 107 HA2 GLY 16 HA3 GLY 16 19.675 -28.512 19.520 108 HA3 GLY 16 HA2 GLY 16 19.977 -26.860 18.982 109 H GLY 17 H GLY 17 18.136 -25.874 18.450 110 HA2 GLY 17 HA3 GLY 17 16.667 -26.717 16.201 111 HA3 GLY 17 HA2 GLY 17 15.758 -27.119 17.653 112 H ILE 18 H ILE 18 14.295 -25.540 16.417 113 HA ILE 18 HA ILE 18 14.646 -22.964 17.737 114 HB ILE 18 HB ILE 18 14.349 -23.293 14.773 115 HG12 ILE 18 HG13 ILE 18 15.964 -21.512 16.596 116 HG13 ILE 18 HG12 ILE 18 16.565 -22.894 15.682 117 HG21 ILE 18 HG21 ILE 18 12.426 -21.946 15.420 118 HG22 ILE 18 HG22 ILE 18 13.627 -20.949 14.600 119 HG23 ILE 18 HG23 ILE 18 13.470 -20.876 16.354 120 HD11 ILE 18 HD11 ILE 18 15.526 -20.318 14.520 121 HD12 ILE 18 HD12 ILE 18 16.098 -21.704 13.593 122 HD13 ILE 18 HD13 ILE 18 17.216 -20.815 14.626 123 H ARG 19 H ARG 19 12.908 -22.266 18.642 124 HA ARG 19 HA ARG 19 10.388 -23.703 18.194 125 HB2 ARG 19 HB3 ARG 19 11.600 -23.505 20.474 126 HB3 ARG 19 HB2 ARG 19 11.033 -21.844 20.469 127 HG2 ARG 19 HG3 ARG 19 9.501 -23.120 21.754 128 HG3 ARG 19 HG2 ARG 19 8.708 -22.700 20.237 129 HD2 ARG 19 HD3 ARG 19 9.153 -24.923 19.361 130 HD3 ARG 19 HD2 ARG 19 10.039 -25.344 20.827 131 HE ARG 19 HE ARG 19 7.195 -24.600 20.968 132 HH11 ARG 19 HH11 ARG 19 9.721 -26.992 21.390 133 HH12 ARG 19 HH12 ARG 19 8.761 -28.005 22.428 134 HH21 ARG 19 HH21 ARG 19 5.920 -25.926 22.266 135 HH22 ARG 19 HH22 ARG 19 6.572 -27.409 22.910 136 H TYR 20 H TYR 20 8.515 -22.522 17.642 137 HA TYR 20 HA TYR 20 9.088 -19.734 16.896 138 HB2 TYR 20 HB3 TYR 20 7.005 -21.630 15.776 139 HB3 TYR 20 HB2 TYR 20 7.287 -19.977 15.230 140 HD1 TYR 20 HD1 TYR 20 8.414 -23.424 15.081 141 HD2 TYR 20 HD2 TYR 20 9.412 -19.413 14.074 142 HE1 TYR 20 HE1 TYR 20 10.145 -24.247 13.541 143 HE2 TYR 20 HE2 TYR 20 11.145 -20.224 12.530 144 HH TYR 20 HH TYR 20 12.508 -22.195 12.169 145 H ARG 21 H ARG 21 6.595 -18.687 16.623 146 HA ARG 21 HA ARG 21 5.411 -19.001 19.299 147 HB2 ARG 21 HB3 ARG 21 7.098 -17.078 19.103 148 HB3 ARG 21 HB2 ARG 21 5.919 -16.295 18.062 149 HG2 ARG 21 HG3 ARG 21 4.891 -17.237 20.653 150 HG3 ARG 21 HG2 ARG 21 6.073 -15.931 20.727 151 HD2 ARG 21 HD3 ARG 21 3.647 -15.859 18.947 152 HD3 ARG 21 HD2 ARG 21 3.649 -15.233 20.595 153 HE ARG 21 HE ARG 21 5.587 -13.785 19.739 154 HH11 ARG 21 HH11 ARG 21 2.871 -14.824 17.774 155 HH12 ARG 21 HH12 ARG 21 2.924 -13.429 16.742 156 HH21 ARG 21 HH21 ARG 21 5.654 -11.954 18.381 157 HH22 ARG 21 HH22 ARG 21 4.513 -11.797 17.076 158 H GLY 22 H GLY 22 5.030 -18.572 15.960 159 HA2 GLY 22 HA3 GLY 22 2.124 -18.668 16.304 160 HA3 GLY 22 HA2 GLY 22 2.791 -17.404 15.279 161 H LEU 23 H LEU 23 4.269 -20.535 15.497 162 HA LEU 23 HA LEU 23 3.079 -21.406 12.986 163 HB2 LEU 23 HB3 LEU 23 6.037 -20.973 13.395 164 HB3 LEU 23 HB2 LEU 23 5.384 -21.973 12.114 165 HG LEU 23 HG LEU 23 4.821 -19.024 12.439 166 HD11 LEU 23 HD11 LEU 23 6.319 -18.705 10.559 167 HD12 LEU 23 HD12 LEU 23 6.658 -20.436 10.510 168 HD13 LEU 23 HD13 LEU 23 7.172 -19.474 11.897 169 HD21 LEU 23 HD21 LEU 23 4.204 -20.940 10.190 170 HD22 LEU 23 HD22 LEU 23 3.911 -19.202 10.175 171 HD23 LEU 23 HD23 LEU 23 3.031 -20.234 11.302 172 H THR 24 H THR 24 2.738 -23.528 12.967 173 HA THR 24 HA THR 24 3.774 -25.131 15.169 174 HB THR 24 HB THR 24 1.337 -25.188 14.499 175 HG1 THR 24 HG1 THR 24 2.290 -26.863 15.736 176 HG21 THR 24 HG21 THR 24 1.602 -25.190 12.072 177 HG22 THR 24 HG22 THR 24 0.712 -26.621 12.600 178 HG23 THR 24 HG23 THR 24 2.413 -26.753 12.150 179 H ARG 25 H ARG 25 4.073 -27.618 14.237 180 HA ARG 25 HA ARG 25 6.608 -27.427 12.919 181 HB2 ARG 25 HB3 ARG 25 4.940 -29.779 13.820 182 HB3 ARG 25 HB2 ARG 25 6.529 -29.950 13.088 183 HG2 ARG 25 HG3 ARG 25 7.580 -28.846 14.905 184 HG3 ARG 25 HG2 ARG 25 6.031 -28.323 15.568 185 HD2 ARG 25 HD3 ARG 25 6.816 -31.214 15.268 186 HD3 ARG 25 HD2 ARG 25 7.106 -30.281 16.736 187 HE ARG 25 HE ARG 25 4.515 -29.889 16.493 188 HH11 ARG 25 HH11 ARG 25 6.325 -32.864 16.002 189 HH12 ARG 25 HH12 ARG 25 4.993 -33.883 16.476 190 HH21 ARG 25 HH21 ARG 25 2.776 -31.255 17.112 191 HH22 ARG 25 HH22 ARG 25 2.998 -32.982 17.083 192 H ASP 26 H ASP 26 6.898 -29.505 11.281 193 HA ASP 26 HA ASP 26 6.842 -30.005 9.073 194 HB2 ASP 26 HB3 ASP 26 4.880 -31.279 9.905 195 HB3 ASP 26 HB2 ASP 26 3.844 -29.919 9.479 196 H GLN 27 H GLN 27 7.003 -27.215 9.681 197 HA GLN 27 HA GLN 27 5.923 -26.150 7.174 198 HB2 GLN 27 HB3 GLN 27 5.725 -24.962 9.926 199 HB3 GLN 27 HB2 GLN 27 5.729 -23.924 8.504 200 HG2 GLN 27 HG3 GLN 27 3.774 -25.132 7.639 201 HG3 GLN 27 HG2 GLN 27 3.762 -26.129 9.092 202 HE21 GLN 27 HE21 GLN 27 4.475 -23.989 10.871 203 HE22 GLN 27 HE22 GLN 27 3.076 -22.974 11.011 204 H VAL 28 H VAL 28 6.968 -23.617 7.357 205 HA VAL 28 HA VAL 28 8.799 -22.455 6.750 206 HB VAL 28 HB VAL 28 10.627 -22.307 8.352 207 HG11 VAL 28 HG11 VAL 28 8.586 -21.113 8.814 208 HG12 VAL 28 HG12 VAL 28 9.309 -21.678 10.319 209 HG13 VAL 28 HG13 VAL 28 7.917 -22.519 9.641 210 HG21 VAL 28 HG21 VAL 28 10.954 -24.631 8.955 211 HG22 VAL 28 HG22 VAL 28 9.370 -24.677 9.730 212 HG23 VAL 28 HG23 VAL 28 10.651 -23.668 10.401 213 H LYS 29 H LYS 29 8.544 -24.864 5.331 214 HA LYS 29 HA LYS 29 11.166 -26.030 5.026 215 HB2 LYS 29 HB3 LYS 29 8.809 -26.220 3.140 216 HB3 LYS 29 HB2 LYS 29 10.208 -27.282 3.187 217 HG2 LYS 29 HG3 LYS 29 9.506 -28.064 5.417 218 HG3 LYS 29 HG2 LYS 29 8.073 -27.039 5.299 219 HD2 LYS 29 HD3 LYS 29 7.494 -28.270 3.186 220 HD3 LYS 29 HD2 LYS 29 8.806 -29.388 3.557 221 HE2 LYS 29 HE3 LYS 29 6.422 -28.832 5.321 222 HE3 LYS 29 HE2 LYS 29 6.609 -30.236 4.277 223 HZ1 LYS 29 HZ1 LYS 29 8.306 -29.535 6.616 224 HZ2 LYS 29 HZ2 LYS 29 8.587 -30.846 5.581 225 HZ3 LYS 29 HZ3 LYS 29 7.175 -30.797 6.525 226 H ALA 30 H ALA 30 9.136 -23.698 3.349 227 HA ALA 30 HA ALA 30 11.510 -22.437 2.257 228 HB1 ALA 30 HB1 ALA 30 9.283 -23.335 0.431 229 HB2 ALA 30 HB2 ALA 30 10.890 -24.055 0.514 230 HB3 ALA 30 HB3 ALA 30 10.698 -22.390 -0.030 231 H ILE 31 H ILE 31 10.962 -20.766 3.661 232 HA ILE 31 HA ILE 31 8.693 -19.128 2.744 233 HB ILE 31 HB ILE 31 9.893 -19.195 5.526 234 HG12 ILE 31 HG13 ILE 31 7.201 -20.109 4.488 235 HG13 ILE 31 HG12 ILE 31 8.487 -21.144 5.100 236 HG21 ILE 31 HG21 ILE 31 7.605 -17.557 4.438 237 HG22 ILE 31 HG22 ILE 31 9.195 -16.947 4.898 238 HG23 ILE 31 HG23 ILE 31 8.118 -17.615 6.124 239 HD11 ILE 31 HD11 ILE 31 6.976 -19.099 6.707 240 HD12 ILE 31 HD12 ILE 31 8.214 -20.201 7.312 241 HD13 ILE 31 HD13 ILE 31 6.682 -20.837 6.715 242 H ASN 32 H ASN 32 9.163 -17.023 2.197 243 HA ASN 32 HA ASN 32 11.952 -16.532 1.655 244 HB2 ASN 32 HB3 ASN 32 9.519 -14.827 1.088 245 HB3 ASN 32 HB2 ASN 32 11.144 -14.531 0.470 246 HD21 ASN 32 HD21 ASN 32 8.289 -16.456 0.229 247 HD22 ASN 32 HD22 ASN 32 8.716 -17.295 -1.230 248 H PHE 33 H PHE 33 9.404 -14.919 3.534 249 HA PHE 33 HA PHE 33 11.486 -13.752 5.224 250 HB2 PHE 33 HB3 PHE 33 9.247 -12.195 3.917 251 HB3 PHE 33 HB2 PHE 33 10.200 -11.584 5.264 252 HD1 PHE 33 HD1 PHE 33 9.882 -11.632 1.785 253 HD2 PHE 33 HD2 PHE 33 12.813 -11.667 4.870 254 HE1 PHE 33 HE1 PHE 33 11.556 -10.765 0.204 255 HE2 PHE 33 HE2 PHE 33 14.489 -10.797 3.296 256 HZ PHE 33 HZ PHE 33 13.858 -10.345 0.957 257 H LEU 34 H LEU 34 11.019 -13.769 7.327 258 HA LEU 34 HA LEU 34 8.401 -14.640 8.225 259 HB2 LEU 34 HB3 LEU 34 10.992 -14.017 9.633 260 HB3 LEU 34 HB2 LEU 34 9.505 -14.239 10.529 261 HG LEU 34 HG LEU 34 10.743 -16.284 10.600 262 HD11 LEU 34 HD11 LEU 34 8.454 -16.537 8.660 263 HD12 LEU 34 HD12 LEU 34 8.335 -16.506 10.420 264 HD13 LEU 34 HD13 LEU 34 9.149 -17.847 9.613 265 HD21 LEU 34 HD21 LEU 34 10.792 -16.184 7.587 266 HD22 LEU 34 HD22 LEU 34 11.348 -17.534 8.575 267 HD23 LEU 34 HD23 LEU 34 12.172 -15.977 8.665 268 HA PRO 35 HA PRO 35 6.706 -10.595 8.510 269 HB2 PRO 35 HB3 PRO 35 5.049 -10.984 10.692 270 HB3 PRO 35 HB2 PRO 35 4.654 -11.425 9.029 271 HG2 PRO 35 HG3 PRO 35 5.684 -13.135 11.249 272 HG3 PRO 35 HG2 PRO 35 4.473 -13.512 10.010 273 HD2 PRO 35 HD3 PRO 35 6.990 -14.432 9.844 274 HD3 PRO 35 HD2 PRO 35 6.078 -13.953 8.398 275 H VAL 36 H VAL 36 7.060 -8.699 9.558 276 HA VAL 36 HA VAL 36 9.062 -8.504 11.516 277 HB VAL 36 HB VAL 36 8.609 -6.675 9.981 278 HG11 VAL 36 HG11 VAL 36 5.984 -6.363 11.429 279 HG12 VAL 36 HG12 VAL 36 6.200 -6.923 9.771 280 HG13 VAL 36 HG13 VAL 36 6.619 -5.266 10.204 281 HG21 VAL 36 HG21 VAL 36 8.620 -4.792 11.548 282 HG22 VAL 36 HG22 VAL 36 9.664 -6.105 12.096 283 HG23 VAL 36 HG23 VAL 36 8.081 -5.868 12.837 284 H ASP 37 H ASP 37 8.984 -8.057 13.708 285 HA ASP 37 HA ASP 37 8.192 -7.911 15.832 286 HB2 ASP 37 HB3 ASP 37 6.358 -6.494 15.002 287 HB3 ASP 37 HB2 ASP 37 5.424 -7.928 14.601 288 H TYR 38 H TYR 38 7.995 -10.420 13.802 289 HA TYR 38 HA TYR 38 6.652 -12.307 15.505 290 HB2 TYR 38 HB3 TYR 38 6.870 -12.533 12.994 291 HB3 TYR 38 HB2 TYR 38 8.570 -12.917 13.250 292 HD1 TYR 38 HD1 TYR 38 9.235 -15.111 13.826 293 HD2 TYR 38 HD2 TYR 38 5.125 -14.029 14.018 294 HE1 TYR 38 HE1 TYR 38 8.636 -17.468 14.194 295 HE2 TYR 38 HE2 TYR 38 4.518 -16.380 14.388 296 HH TYR 38 HH TYR 38 5.595 -18.664 13.827 297 H GLU 39 H GLU 39 7.655 -13.976 16.712 298 HA GLU 39 HA GLU 39 10.434 -13.407 17.512 299 HB2 GLU 39 HB3 GLU 39 8.206 -14.353 19.321 300 HB3 GLU 39 HB2 GLU 39 9.839 -13.920 19.801 301 HG2 GLU 39 HG3 GLU 39 9.455 -11.629 19.398 302 HG3 GLU 39 HG2 GLU 39 7.943 -11.962 18.548 303 H ILE 40 H ILE 40 11.754 -15.159 17.884 304 HA ILE 40 HA ILE 40 10.540 -17.831 17.894 305 HB ILE 40 HB ILE 40 12.433 -18.715 16.534 306 HG12 ILE 40 HG13 ILE 40 12.955 -15.790 15.987 307 HG13 ILE 40 HG12 ILE 40 14.003 -16.873 16.896 308 HG21 ILE 40 HG21 ILE 40 10.271 -18.355 15.506 309 HG22 ILE 40 HG22 ILE 40 11.559 -17.973 14.363 310 HG23 ILE 40 HG23 ILE 40 10.682 -16.673 15.171 311 HD11 ILE 40 HD11 ILE 40 14.818 -16.504 14.634 312 HD12 ILE 40 HD12 ILE 40 13.307 -17.140 13.982 313 HD13 ILE 40 HD13 ILE 40 14.385 -18.195 14.895 314 H GLU 41 H GLU 41 11.817 -19.448 18.921 315 HA GLU 41 HA GLU 41 13.784 -18.355 20.833 316 HB2 GLU 41 HB3 GLU 41 11.622 -19.063 21.850 317 HB3 GLU 41 HB2 GLU 41 11.888 -20.684 21.226 318 HG2 GLU 41 HG3 GLU 41 13.959 -20.812 22.571 319 HG3 GLU 41 HG2 GLU 41 13.561 -19.244 23.267 320 H TYR 42 H TYR 42 15.519 -19.791 21.450 321 HA TYR 42 HA TYR 42 16.144 -21.793 19.395 322 HB2 TYR 42 HB3 TYR 42 17.875 -20.142 21.215 323 HB3 TYR 42 HB2 TYR 42 18.495 -21.605 20.459 324 HD1 TYR 42 HD1 TYR 42 19.400 -21.507 18.320 325 HD2 TYR 42 HD2 TYR 42 16.868 -18.364 19.652 326 HE1 TYR 42 HE1 TYR 42 19.927 -20.229 16.286 327 HE2 TYR 42 HE2 TYR 42 17.387 -17.081 17.630 328 HH TYR 42 HH TYR 42 18.940 -18.423 14.935 329 H VAL 43 H VAL 43 15.278 -23.671 20.100 330 HA VAL 43 HA VAL 43 15.706 -24.495 22.863 331 HB VAL 43 HB VAL 43 14.361 -26.484 22.293 332 HG11 VAL 43 HG11 VAL 43 13.093 -23.864 21.506 333 HG12 VAL 43 HG12 VAL 43 13.243 -24.508 23.142 334 HG13 VAL 43 HG13 VAL 43 12.220 -25.327 21.961 335 HG21 VAL 43 HG21 VAL 43 14.985 -26.692 19.940 336 HG22 VAL 43 HG22 VAL 43 14.098 -25.214 19.569 337 HG23 VAL 43 HG23 VAL 43 13.233 -26.643 20.133 338 H CYS 44 H CYS 44 16.416 -26.858 23.117 339 HA CYS 44 HA CYS 44 18.830 -27.231 21.489 340 HB2 CYS 44 HB3 CYS 44 18.845 -27.103 24.069 341 HB3 CYS 44 HB2 CYS 44 18.145 -28.714 24.024 342 H ARG 45 H ARG 45 19.390 -29.695 21.244 343 HA ARG 45 HA ARG 45 17.430 -30.886 19.632 344 HB2 ARG 45 HB3 ARG 45 20.035 -31.748 20.759 345 HB3 ARG 45 HB2 ARG 45 18.948 -33.019 20.224 346 HG2 ARG 45 HG3 ARG 45 19.909 -30.720 18.530 347 HG3 ARG 45 HG2 ARG 45 20.529 -32.373 18.476 348 HD2 ARG 45 HD3 ARG 45 18.262 -33.161 17.885 349 HD3 ARG 45 HD2 ARG 45 17.714 -31.488 17.849 350 HE ARG 45 HE ARG 45 19.950 -32.063 16.102 351 HH11 ARG 45 HH11 ARG 45 16.458 -31.889 16.436 352 HH12 ARG 45 HH12 ARG 45 16.179 -31.811 14.715 353 HH21 ARG 45 HH21 ARG 45 19.569 -31.947 13.846 354 HH22 ARG 45 HH22 ARG 45 17.937 -31.843 13.259 355 H GLY 46 H GLY 46 15.582 -31.743 20.202 356 HA2 GLY 46 HA3 GLY 46 14.176 -33.266 21.278 357 HA3 GLY 46 HA2 GLY 46 15.435 -33.556 22.471 358 H GLU 47 H GLU 47 14.574 -33.115 24.385 359 HA GLU 47 HA GLU 47 12.994 -30.651 24.679 360 HB2 GLU 47 HB3 GLU 47 12.014 -31.862 26.693 361 HB3 GLU 47 HB2 GLU 47 11.547 -32.449 25.102 362 HG2 GLU 47 HG3 GLU 47 13.235 -34.234 25.305 363 HG3 GLU 47 HG2 GLU 47 13.597 -33.669 26.936 364 H ARG 48 H ARG 48 15.844 -30.773 24.834 365 HA ARG 48 HA ARG 48 16.480 -30.481 27.661 366 HB2 ARG 48 HB3 ARG 48 18.211 -30.082 25.207 367 HB3 ARG 48 HB2 ARG 48 18.777 -30.069 26.872 368 HG2 ARG 48 HG3 ARG 48 17.472 -32.436 25.551 369 HG3 ARG 48 HG2 ARG 48 19.216 -32.186 25.653 370 HD2 ARG 48 HD3 ARG 48 17.412 -32.264 28.061 371 HD3 ARG 48 HD2 ARG 48 18.211 -33.694 27.412 372 HE ARG 48 HE ARG 48 19.974 -31.471 28.006 373 HH11 ARG 48 HH11 ARG 48 18.455 -34.399 29.221 374 HH12 ARG 48 HH12 ARG 48 19.676 -34.670 30.438 375 HH21 ARG 48 HH21 ARG 48 21.568 -31.835 29.587 376 HH22 ARG 48 HH22 ARG 48 21.458 -33.227 30.623 377 H GLU 49 H GLU 49 16.172 -28.603 28.655 378 HA GLU 49 HA GLU 49 15.527 -26.236 27.164 379 HB2 GLU 49 HB3 GLU 49 16.016 -26.389 30.137 380 HB3 GLU 49 HB2 GLU 49 15.032 -25.223 29.263 381 HG2 GLU 49 HG3 GLU 49 13.375 -26.530 30.069 382 HG3 GLU 49 HG2 GLU 49 13.713 -27.435 28.593 383 H VAL 50 H VAL 50 16.653 -24.282 27.144 384 HA VAL 50 HA VAL 50 19.520 -24.560 27.766 385 HB VAL 50 HB VAL 50 20.019 -23.042 25.944 386 HG11 VAL 50 HG11 VAL 50 18.196 -25.291 25.109 387 HG12 VAL 50 HG12 VAL 50 19.939 -25.372 25.366 388 HG13 VAL 50 HG13 VAL 50 19.290 -24.426 24.029 389 HG21 VAL 50 HG21 VAL 50 18.296 -22.234 24.410 390 HG22 VAL 50 HG22 VAL 50 18.021 -21.644 26.050 391 HG23 VAL 50 HG23 VAL 50 17.049 -22.972 25.417 392 H VAL 51 H VAL 51 20.570 -22.871 28.795 393 HA VAL 51 HA VAL 51 18.845 -20.659 29.677 394 HB VAL 51 HB VAL 51 19.835 -21.796 31.555 395 HG11 VAL 51 HG11 VAL 51 22.266 -21.948 31.878 396 HG12 VAL 51 HG12 VAL 51 22.507 -21.306 30.252 397 HG13 VAL 51 HG13 VAL 51 21.717 -22.867 30.475 398 HG21 VAL 51 HG21 VAL 51 21.087 -19.959 32.612 399 HG22 VAL 51 HG22 VAL 51 19.636 -19.399 31.779 400 HG23 VAL 51 HG23 VAL 51 21.222 -19.170 31.038 401 H GLY 52 H GLY 52 18.911 -19.262 28.044 402 HA2 GLY 52 HA3 GLY 52 21.415 -17.913 27.510 403 HA3 GLY 52 HA2 GLY 52 20.717 -18.756 26.133 404 HA PRO 53 HA PRO 53 18.606 -14.566 26.424 405 HB2 PRO 53 HB3 PRO 53 19.917 -13.310 24.423 406 HB3 PRO 53 HB2 PRO 53 20.473 -13.230 26.099 407 HG2 PRO 53 HG3 PRO 53 21.461 -14.944 23.856 408 HG3 PRO 53 HG2 PRO 53 22.390 -14.066 25.085 409 HD2 PRO 53 HD3 PRO 53 21.864 -16.745 25.219 410 HD3 PRO 53 HD2 PRO 53 22.109 -15.720 26.651 411 H LYS 54 H LYS 54 17.561 -16.792 25.542 412 HA LYS 54 HA LYS 54 17.613 -17.109 22.692 413 HB2 LYS 54 HB3 LYS 54 15.918 -18.918 23.173 414 HB3 LYS 54 HB2 LYS 54 17.476 -19.108 23.965 415 HG2 LYS 54 HG3 LYS 54 16.586 -18.394 26.058 416 HG3 LYS 54 HG2 LYS 54 15.064 -17.911 25.310 417 HD2 LYS 54 HD3 LYS 54 14.737 -20.311 24.656 418 HD3 LYS 54 HD2 LYS 54 16.142 -20.705 25.649 419 HE2 LYS 54 HE3 LYS 54 15.049 -19.901 27.624 420 HE3 LYS 54 HE2 LYS 54 13.706 -19.260 26.678 421 HZ1 LYS 54 HZ1 LYS 54 13.198 -21.568 26.008 422 HZ2 LYS 54 HZ2 LYS 54 13.044 -21.305 27.677 423 HZ3 LYS 54 HZ3 LYS 54 14.401 -22.120 27.071 424 H VAL 55 H VAL 55 16.817 -15.078 22.034 425 HA VAL 55 HA VAL 55 14.045 -15.320 21.394 426 HB VAL 55 HB VAL 55 13.774 -14.157 23.516 427 HG11 VAL 55 HG11 VAL 55 14.697 -11.898 23.865 428 HG12 VAL 55 HG12 VAL 55 15.634 -12.073 22.382 429 HG13 VAL 55 HG13 VAL 55 15.949 -13.135 23.753 430 HG21 VAL 55 HG21 VAL 55 12.586 -12.138 22.721 431 HG22 VAL 55 HG22 VAL 55 12.215 -13.577 21.773 432 HG23 VAL 55 HG23 VAL 55 13.322 -12.364 21.133 433 H ARG 56 H ARG 56 13.831 -14.725 19.347 434 HA ARG 56 HA ARG 56 15.688 -12.689 18.288 435 HB2 ARG 56 HB3 ARG 56 14.316 -14.938 16.803 436 HB3 ARG 56 HB2 ARG 56 15.318 -13.703 16.065 437 HG2 ARG 56 HG3 ARG 56 16.318 -15.636 18.133 438 HG3 ARG 56 HG2 ARG 56 16.401 -15.925 16.395 439 HD2 ARG 56 HD3 ARG 56 17.643 -13.724 16.231 440 HD3 ARG 56 HD2 ARG 56 17.769 -13.775 17.992 441 HE ARG 56 HE ARG 56 18.807 -15.947 16.284 442 HH11 ARG 56 HH11 ARG 56 19.215 -13.645 18.894 443 HH12 ARG 56 HH12 ARG 56 20.789 -14.246 19.333 444 HH21 ARG 56 HH21 ARG 56 20.846 -16.756 16.897 445 HH22 ARG 56 HH22 ARG 56 21.693 -16.025 18.222 446 H LYS 57 H LYS 57 14.696 -10.832 17.882 447 HA LYS 57 HA LYS 57 11.805 -10.879 17.374 448 HB2 LYS 57 HB3 LYS 57 12.622 -9.515 19.292 449 HB3 LYS 57 HB2 LYS 57 13.589 -8.564 18.176 450 HG2 LYS 57 HG3 LYS 57 11.478 -7.899 17.030 451 HG3 LYS 57 HG2 LYS 57 10.590 -8.714 18.320 452 HD2 LYS 57 HD3 LYS 57 12.528 -6.428 18.666 453 HD3 LYS 57 HD2 LYS 57 10.769 -6.320 18.761 454 HE2 LYS 57 HE3 LYS 57 10.732 -7.697 20.724 455 HE3 LYS 57 HE2 LYS 57 12.449 -8.056 20.567 456 HZ1 LYS 57 HZ1 LYS 57 12.082 -6.392 22.256 457 HZ2 LYS 57 HZ2 LYS 57 11.271 -5.392 21.156 458 HZ3 LYS 57 HZ3 LYS 57 12.926 -5.708 20.957 459 H CYS 58 H CYS 58 11.176 -10.620 15.335 460 HA CYS 58 HA CYS 58 13.095 -9.873 13.325 461 HB2 CYS 58 HB3 CYS 58 11.284 -11.614 13.011 462 HB3 CYS 58 HB2 CYS 58 10.131 -10.285 12.930 463 H LEU 59 H LEU 59 13.269 -7.986 12.257 464 HA LEU 59 HA LEU 59 11.615 -5.776 13.280 465 HB2 LEU 59 HB3 LEU 59 14.530 -5.740 12.494 466 HB3 LEU 59 HB2 LEU 59 13.603 -4.349 13.027 467 HG LEU 59 HG LEU 59 14.166 -6.787 14.714 468 HD11 LEU 59 HD11 LEU 59 15.411 -4.045 14.774 469 HD12 LEU 59 HD12 LEU 59 16.204 -5.541 14.278 470 HD13 LEU 59 HD13 LEU 59 15.690 -5.327 15.953 471 HD21 LEU 59 HD21 LEU 59 12.902 -4.131 15.388 472 HD22 LEU 59 HD22 LEU 59 13.333 -5.380 16.556 473 HD23 LEU 59 HD23 LEU 59 12.092 -5.698 15.343 474 H ALA 60 H ALA 60 12.134 -3.741 11.728 475 HA ALA 60 HA ALA 60 11.017 -4.481 9.186 476 HB1 ALA 60 HB1 ALA 60 10.982 -2.082 8.730 477 HB2 ALA 60 HB2 ALA 60 11.933 -1.786 10.187 478 HB3 ALA 60 HB3 ALA 60 10.299 -2.437 10.316 479 H ASN 61 H ASN 61 14.125 -4.258 10.427 480 HA ASN 61 HA ASN 61 15.338 -3.884 7.799 481 HB2 ASN 61 HB3 ASN 61 17.509 -4.143 9.082 482 HB3 ASN 61 HB2 ASN 61 16.544 -2.737 9.516 483 HD21 ASN 61 HD21 ASN 61 17.737 -5.830 10.552 484 HD22 ASN 61 HD22 ASN 61 17.294 -5.667 12.215 485 H GLY 62 H GLY 62 16.749 -5.511 6.918 486 HA2 GLY 62 HA3 GLY 62 15.454 -8.077 7.097 487 HA3 GLY 62 HA2 GLY 62 16.751 -7.634 5.999 488 H SER 63 H SER 63 16.460 -7.848 9.537 489 HA SER 63 HA SER 63 18.103 -10.161 9.724 490 HB2 SER 63 HB3 SER 63 20.004 -9.092 10.931 491 HB3 SER 63 HB2 SER 63 19.912 -8.594 9.243 492 HG SER 63 HG SER 63 19.317 -7.135 11.574 493 H TRP 64 H TRP 64 18.254 -10.904 11.922 494 HA TRP 64 HA TRP 64 16.040 -10.055 13.522 495 HB2 TRP 64 HB3 TRP 64 18.251 -12.032 14.134 496 HB3 TRP 64 HB2 TRP 64 16.785 -11.818 15.088 497 HD1 TRP 64 HD1 TRP 64 18.053 -13.374 11.848 498 HE1 TRP 64 HE1 TRP 64 16.210 -14.878 10.859 499 HE3 TRP 64 HE3 TRP 64 14.201 -12.106 14.963 500 HZ2 TRP 64 HZ2 TRP 64 13.488 -15.453 11.339 501 HZ3 TRP 64 HZ3 TRP 64 12.014 -13.182 14.633 502 HH2 TRP 64 HH2 TRP 64 11.669 -14.819 12.861 503 H THR 65 H THR 65 16.375 -9.614 15.903 504 HA THR 65 HA THR 65 17.571 -7.176 16.267 505 HB THR 65 HB THR 65 17.548 -7.972 18.798 506 HG1 THR 65 HG1 THR 65 16.496 -9.823 19.130 507 HG21 THR 65 HG21 THR 65 15.168 -7.402 18.874 508 HG22 THR 65 HG22 THR 65 15.062 -7.603 17.125 509 HG23 THR 65 HG23 THR 65 16.049 -6.310 17.807 510 H ASP 66 H ASP 66 18.963 -10.339 17.077 511 HA ASP 66 HA ASP 66 21.633 -9.273 16.780 512 HB2 ASP 66 HB3 ASP 66 21.177 -8.735 19.152 513 HB3 ASP 66 HB2 ASP 66 20.737 -10.406 19.452 514 H MET 67 H MET 67 21.375 -10.922 15.016 515 HA MET 67 HA MET 67 20.986 -13.629 16.019 516 HB2 MET 67 HB3 MET 67 20.915 -14.296 13.636 517 HB3 MET 67 HB2 MET 67 19.720 -13.079 14.054 518 HG2 MET 67 HG3 MET 67 21.197 -11.352 13.086 519 HG3 MET 67 HG2 MET 67 22.312 -12.626 12.588 520 HE1 MET 67 HE1 MET 67 22.322 -12.127 10.076 521 HE2 MET 67 HE2 MET 67 21.372 -10.674 10.389 522 HE3 MET 67 HE3 MET 67 20.886 -11.789 9.112 523 H ASP 68 H ASP 68 22.995 -13.496 17.193 524 HA ASP 68 HA ASP 68 24.599 -15.468 15.960 525 HB2 ASP 68 HB3 ASP 68 25.841 -13.507 15.088 526 HB3 ASP 68 HB2 ASP 68 26.023 -12.899 16.731 527 H THR 69 H THR 69 23.894 -16.725 17.653 528 HA THR 69 HA THR 69 24.925 -16.135 20.293 529 HB THR 69 HB THR 69 21.958 -16.399 20.226 530 HG1 THR 69 HG1 THR 69 23.335 -13.946 19.732 531 HG21 THR 69 HG21 THR 69 22.163 -14.875 22.176 532 HG22 THR 69 HG22 THR 69 23.912 -14.891 21.957 533 HG23 THR 69 HG23 THR 69 23.060 -16.381 22.371 534 HA PRO 70 HA PRO 70 24.308 -20.609 20.111 535 HB2 PRO 70 HB3 PRO 70 26.190 -21.226 21.939 536 HB3 PRO 70 HB2 PRO 70 26.599 -20.815 20.270 537 HG2 PRO 70 HG3 PRO 70 26.825 -19.165 22.737 538 HG3 PRO 70 HG2 PRO 70 27.868 -19.202 21.307 539 HD2 PRO 70 HD3 PRO 70 25.907 -17.296 21.840 540 HD3 PRO 70 HD2 PRO 70 26.648 -17.607 20.259 541 H SER 71 H SER 71 22.639 -21.491 21.180 542 HA SER 71 HA SER 71 21.864 -20.503 23.767 543 HB2 SER 71 HB3 SER 71 20.043 -22.264 23.494 544 HB3 SER 71 HB2 SER 71 20.069 -20.969 22.299 545 HG SER 71 HG SER 71 19.971 -23.401 21.681 546 H ARG 72 H ARG 72 22.115 -21.509 25.707 547 HA ARG 72 HA ARG 72 24.163 -23.592 25.685 548 HB2 ARG 72 HB3 ARG 72 23.242 -22.008 28.074 549 HB3 ARG 72 HB2 ARG 72 24.771 -22.847 27.847 550 HG2 ARG 72 HG3 ARG 72 25.386 -21.226 26.107 551 HG3 ARG 72 HG2 ARG 72 23.870 -20.368 26.392 552 HD2 ARG 72 HD3 ARG 72 25.612 -19.241 27.590 553 HD3 ARG 72 HD2 ARG 72 24.566 -20.051 28.757 554 HE ARG 72 HE ARG 72 27.080 -21.300 27.863 555 HH11 ARG 72 HH11 ARG 72 25.019 -20.078 30.418 556 HH12 ARG 72 HH12 ARG 72 26.027 -20.673 31.699 557 HH21 ARG 72 HH21 ARG 72 28.435 -22.058 29.538 558 HH22 ARG 72 HH22 ARG 72 27.972 -21.801 31.200 559 H CYS 73 H CYS 73 23.120 -25.533 25.516 560 HA CYS 73 HA CYS 73 20.751 -26.224 26.930 561 HB2 CYS 73 HB3 CYS 73 22.817 -28.190 25.935 562 HB3 CYS 73 HB2 CYS 73 21.082 -28.429 26.096 563 H VAL 74 H VAL 74 20.778 -26.130 29.135 564 HA VAL 74 HA VAL 74 22.937 -27.552 30.524 565 HB VAL 74 HB VAL 74 22.018 -24.762 31.242 566 HG11 VAL 74 HG11 VAL 74 23.679 -24.862 33.030 567 HG12 VAL 74 HG12 VAL 74 24.039 -26.536 32.607 568 HG13 VAL 74 HG13 VAL 74 22.448 -26.107 33.235 569 HG21 VAL 74 HG21 VAL 74 23.551 -24.784 29.346 570 HG22 VAL 74 HG22 VAL 74 24.696 -25.758 30.271 571 HG23 VAL 74 HG23 VAL 74 24.329 -24.106 30.777 572 H ARG 75 H ARG 75 22.047 -29.036 31.757 573 HA ARG 75 HA ARG 75 19.708 -28.283 33.380 574 HB2 ARG 75 HB3 ARG 75 20.426 -30.892 32.093 575 HB3 ARG 75 HB2 ARG 75 19.497 -30.891 33.583 576 HG2 ARG 75 HG3 ARG 75 17.825 -29.422 32.447 577 HG3 ARG 75 HG2 ARG 75 18.727 -29.666 30.948 578 HD2 ARG 75 HD3 ARG 75 18.331 -32.016 31.005 579 HD3 ARG 75 HD2 ARG 75 17.642 -31.920 32.623 580 HE ARG 75 HE ARG 75 16.247 -30.374 30.605 581 HH11 ARG 75 HH11 ARG 75 16.462 -33.391 32.373 582 HH12 ARG 75 HH12 ARG 75 14.855 -33.903 31.932 583 HH21 ARG 75 HH21 ARG 75 14.164 -31.029 30.031 584 HH22 ARG 75 HH22 ARG 75 13.552 -32.561 30.592 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 10.274 -0.963 -5.557 2 H2 GLY 1 HT2 GLY 1 8.910 -0.015 -5.892 3 H3 GLY 1 HT3 GLY 1 10.033 -0.355 -7.118 4 HA2 GLY 1 HA2 GLY 1 8.013 -1.703 -7.330 5 HA3 GLY 1 HA3 GLY 1 9.467 -2.668 -7.104 6 HA PRO 2 HA PRO 2 6.076 -3.682 -3.861 7 HB2 PRO 2 HB3 PRO 2 6.182 -6.303 -5.241 8 HB3 PRO 2 HB2 PRO 2 4.787 -5.395 -4.652 9 HG2 PRO 2 HG3 PRO 2 5.327 -5.578 -7.264 10 HG3 PRO 2 HG2 PRO 2 4.653 -4.100 -6.554 11 HD2 PRO 2 HD3 PRO 2 7.459 -4.685 -7.409 12 HD3 PRO 2 HD2 PRO 2 6.528 -3.180 -7.546 13 H THR 3 H THR 3 7.290 -3.932 -2.086 14 HA THR 3 HA THR 3 9.515 -5.854 -2.164 15 HB THR 3 HB THR 3 10.341 -4.580 -0.136 16 HG1 THR 3 HG1 THR 3 9.432 -2.308 -0.202 17 HG21 THR 3 HG21 THR 3 11.276 -2.739 -1.459 18 HG22 THR 3 HG22 THR 3 10.104 -3.062 -2.736 19 HG23 THR 3 HG23 THR 3 11.331 -4.265 -2.342 20 H SER 4 H SER 4 9.592 -7.514 -0.776 21 HA SER 4 HA SER 4 7.528 -7.688 1.303 22 HB2 SER 4 HB3 SER 4 9.308 -9.901 0.243 23 HB3 SER 4 HB2 SER 4 7.902 -10.081 1.292 24 HG SER 4 HG SER 4 6.959 -10.419 -0.581 25 H GLU 5 H GLU 5 8.361 -6.672 3.067 26 HA GLU 5 HA GLU 5 11.206 -7.025 3.635 27 HB2 GLU 5 HB3 GLU 5 9.205 -5.111 4.845 28 HB3 GLU 5 HB2 GLU 5 10.925 -5.155 5.213 29 HG2 GLU 5 HG3 GLU 5 11.373 -4.697 2.799 30 HG3 GLU 5 HG2 GLU 5 9.638 -4.474 2.580 31 H GLY 6 H GLY 6 11.680 -8.709 4.801 32 HA2 GLY 6 HA3 GLY 6 10.579 -9.000 7.439 33 HA3 GLY 6 HA2 GLY 6 10.150 -10.317 6.354 34 H CYS 7 H CYS 7 11.477 -11.199 8.359 35 HA CYS 7 HA CYS 7 14.332 -11.238 7.703 36 HB2 CYS 7 HB3 CYS 7 12.968 -12.546 10.059 37 HB3 CYS 7 HB2 CYS 7 14.677 -12.160 9.876 38 H GLN 8 H GLN 8 15.410 -13.157 7.182 39 HA GLN 8 HA GLN 8 13.690 -15.231 6.070 40 HB2 GLN 8 HB3 GLN 8 15.697 -16.105 5.029 41 HB3 GLN 8 HB2 GLN 8 15.599 -14.375 4.745 42 HG2 GLN 8 HG3 GLN 8 17.327 -13.904 6.230 43 HG3 GLN 8 HG2 GLN 8 17.208 -15.475 7.017 44 HE21 GLN 8 HE21 GLN 8 17.087 -16.989 4.556 45 HE22 GLN 8 HE22 GLN 8 18.679 -16.951 3.883 46 H ILE 9 H ILE 9 14.910 -17.535 6.281 47 HA ILE 9 HA ILE 9 14.821 -18.137 9.123 48 HB ILE 9 HB ILE 9 15.023 -19.932 6.697 49 HG12 ILE 9 HG13 ILE 9 12.763 -19.422 8.649 50 HG13 ILE 9 HG12 ILE 9 12.840 -18.843 6.989 51 HG21 ILE 9 HG21 ILE 9 16.178 -20.974 8.558 52 HG22 ILE 9 HG22 ILE 9 14.653 -21.806 8.248 53 HG23 ILE 9 HG23 ILE 9 14.789 -20.690 9.607 54 HD11 ILE 9 HD11 ILE 9 12.665 -21.715 7.878 55 HD12 ILE 9 HD12 ILE 9 12.804 -21.176 6.205 56 HD13 ILE 9 HD13 ILE 9 11.376 -20.755 7.151 57 H ILE 10 H ILE 10 16.562 -18.347 10.338 58 HA ILE 10 HA ILE 10 19.196 -18.038 9.211 59 HB ILE 10 HB ILE 10 18.589 -18.658 12.097 60 HG12 ILE 10 HG13 ILE 10 18.549 -15.895 10.872 61 HG13 ILE 10 HG12 ILE 10 17.093 -16.813 11.248 62 HG21 ILE 10 HG21 ILE 10 20.573 -17.260 12.492 63 HG22 ILE 10 HG22 ILE 10 20.748 -17.035 10.751 64 HG23 ILE 10 HG23 ILE 10 20.929 -18.641 11.456 65 HD11 ILE 10 HD11 ILE 10 17.573 -15.217 12.997 66 HD12 ILE 10 HD12 ILE 10 19.178 -15.912 13.221 67 HD13 ILE 10 HD13 ILE 10 17.745 -16.864 13.604 68 H HIS 11 H HIS 11 20.897 -19.564 9.325 69 HA HIS 11 HA HIS 11 20.276 -22.307 9.245 70 HB2 HIS 11 HB3 HIS 11 22.637 -22.713 9.213 71 HB3 HIS 11 HB2 HIS 11 22.375 -21.216 8.326 72 HD1 HIS 11 HD1 HIS 11 24.112 -22.623 11.279 73 HD2 HIS 11 HD2 HIS 11 23.274 -18.869 9.695 74 HE1 HIS 11 HE1 HIS 11 25.612 -21.023 12.501 75 HE2 HIS 11 HE2 HIS 11 25.187 -18.778 11.434 76 HA PRO 12 HA PRO 12 19.785 -23.271 13.546 77 HB2 PRO 12 HB3 PRO 12 20.837 -25.948 12.884 78 HB3 PRO 12 HB2 PRO 12 19.256 -25.489 13.524 79 HG2 PRO 12 HG3 PRO 12 19.544 -26.331 10.999 80 HG3 PRO 12 HG2 PRO 12 18.380 -25.066 11.431 81 HD2 PRO 12 HD3 PRO 12 21.091 -24.798 10.181 82 HD3 PRO 12 HD2 PRO 12 19.582 -23.943 9.794 83 HA PRO 13 HA PRO 13 23.936 -23.135 15.237 84 HB2 PRO 13 HB3 PRO 13 22.818 -23.784 17.837 85 HB3 PRO 13 HB2 PRO 13 23.449 -22.238 17.270 86 HG2 PRO 13 HG3 PRO 13 20.813 -22.676 17.810 87 HG3 PRO 13 HG2 PRO 13 21.384 -21.485 16.628 88 HD2 PRO 13 HD3 PRO 13 20.316 -24.248 16.175 89 HD3 PRO 13 HD2 PRO 13 20.008 -22.756 15.259 90 H TRP 14 H TRP 14 23.901 -24.838 17.857 91 HA TRP 14 HA TRP 14 24.913 -27.245 16.665 92 HB2 TRP 14 HB3 TRP 14 25.482 -25.976 18.977 93 HB3 TRP 14 HB2 TRP 14 24.335 -27.170 19.579 94 HD1 TRP 14 HD1 TRP 14 25.424 -29.362 20.307 95 HE1 TRP 14 HE1 TRP 14 27.587 -30.640 19.731 96 HE3 TRP 14 HE3 TRP 14 27.275 -26.237 16.711 97 HZ2 TRP 14 HZ2 TRP 14 29.786 -30.346 17.990 98 HZ3 TRP 14 HZ3 TRP 14 29.412 -26.806 15.639 99 HH2 TRP 14 HH2 TRP 14 30.642 -28.815 16.263 100 H GLU 15 H GLU 15 24.053 -29.381 17.986 101 HA GLU 15 HA GLU 15 21.773 -30.183 16.758 102 HB2 GLU 15 HB3 GLU 15 22.898 -31.109 19.388 103 HB3 GLU 15 HB2 GLU 15 21.507 -31.879 18.643 104 HG2 GLU 15 HG3 GLU 15 23.255 -33.207 17.958 105 HG3 GLU 15 HG2 GLU 15 23.025 -32.130 16.583 106 H GLY 16 H GLY 16 19.981 -29.017 16.708 107 HA2 GLY 16 HA3 GLY 16 18.067 -29.164 18.714 108 HA3 GLY 16 HA2 GLY 16 18.867 -27.604 18.870 109 H GLY 17 H GLY 17 17.141 -26.345 18.224 110 HA2 GLY 17 HA3 GLY 17 16.919 -25.967 15.414 111 HA3 GLY 17 HA2 GLY 17 15.483 -26.759 16.044 112 H ILE 18 H ILE 18 14.593 -24.675 15.123 113 HA ILE 18 HA ILE 18 14.672 -22.617 17.214 114 HB ILE 18 HB ILE 18 14.489 -22.319 14.233 115 HG12 ILE 18 HG13 ILE 18 16.119 -21.028 16.419 116 HG13 ILE 18 HG12 ILE 18 16.684 -22.252 15.286 117 HG21 ILE 18 HG21 ILE 18 13.867 -19.966 14.537 118 HG22 ILE 18 HG22 ILE 18 13.689 -20.236 16.272 119 HG23 ILE 18 HG23 ILE 18 12.608 -21.044 15.138 120 HD11 ILE 18 HD11 ILE 18 16.362 -20.674 13.435 121 HD12 ILE 18 HD12 ILE 18 17.496 -20.066 14.641 122 HD13 ILE 18 HD13 ILE 18 15.845 -19.445 14.589 123 H ARG 19 H ARG 19 12.893 -22.261 18.242 124 HA ARG 19 HA ARG 19 10.398 -23.414 17.229 125 HB2 ARG 19 HB3 ARG 19 11.554 -23.654 19.659 126 HB3 ARG 19 HB2 ARG 19 10.540 -22.244 19.945 127 HG2 ARG 19 HG3 ARG 19 9.288 -24.161 20.594 128 HG3 ARG 19 HG2 ARG 19 8.590 -23.552 19.089 129 HD2 ARG 19 HD3 ARG 19 10.254 -25.254 17.992 130 HD3 ARG 19 HD2 ARG 19 10.200 -26.017 19.580 131 HE ARG 19 HE ARG 19 7.625 -25.442 18.376 132 HH11 ARG 19 HH11 ARG 19 10.113 -27.829 19.001 133 HH12 ARG 19 HH12 ARG 19 9.144 -29.169 18.466 134 HH21 ARG 19 HH21 ARG 19 6.340 -27.179 17.711 135 HH22 ARG 19 HH22 ARG 19 6.969 -28.800 17.749 136 H TYR 20 H TYR 20 9.104 -22.042 16.194 137 HA TYR 20 HA TYR 20 9.603 -19.223 16.307 138 HB2 TYR 20 HB3 TYR 20 7.509 -20.831 14.834 139 HB3 TYR 20 HB2 TYR 20 7.760 -19.099 14.630 140 HD1 TYR 20 HD1 TYR 20 9.293 -22.427 14.126 141 HD2 TYR 20 HD2 TYR 20 9.552 -18.264 13.286 142 HE1 TYR 20 HE1 TYR 20 11.023 -22.879 12.441 143 HE2 TYR 20 HE2 TYR 20 11.283 -18.706 11.600 144 HH TYR 20 HH TYR 20 12.920 -20.408 11.042 145 H ARG 21 H ARG 21 7.158 -18.024 16.107 146 HA ARG 21 HA ARG 21 6.435 -18.043 18.919 147 HB2 ARG 21 HB3 ARG 21 6.968 -15.937 17.636 148 HB3 ARG 21 HB2 ARG 21 5.469 -16.175 16.751 149 HG2 ARG 21 HG3 ARG 21 4.180 -15.917 18.765 150 HG3 ARG 21 HG2 ARG 21 5.652 -15.838 19.737 151 HD2 ARG 21 HD3 ARG 21 6.310 -13.800 18.535 152 HD3 ARG 21 HD2 ARG 21 4.813 -13.873 17.610 153 HE ARG 21 HE ARG 21 3.940 -13.864 20.165 154 HH11 ARG 21 HH11 ARG 21 6.154 -11.789 18.405 155 HH12 ARG 21 HH12 ARG 21 5.787 -10.388 19.352 156 HH21 ARG 21 HH21 ARG 21 3.455 -12.004 21.403 157 HH22 ARG 21 HH22 ARG 21 4.255 -10.500 21.041 158 H GLY 22 H GLY 22 4.918 -18.518 15.771 159 HA2 GLY 22 HA3 GLY 22 2.828 -20.096 17.051 160 HA3 GLY 22 HA2 GLY 22 2.292 -18.659 16.192 161 H LEU 23 H LEU 23 4.551 -21.358 15.612 162 HA LEU 23 HA LEU 23 3.181 -21.846 13.069 163 HB2 LEU 23 HB3 LEU 23 6.158 -21.545 13.443 164 HB3 LEU 23 HB2 LEU 23 5.440 -22.306 12.035 165 HG LEU 23 HG LEU 23 5.036 -19.434 12.886 166 HD11 LEU 23 HD11 LEU 23 7.267 -19.830 12.023 167 HD12 LEU 23 HD12 LEU 23 6.312 -18.903 10.867 168 HD13 LEU 23 HD13 LEU 23 6.598 -20.623 10.598 169 HD21 LEU 23 HD21 LEU 23 3.050 -20.272 11.802 170 HD22 LEU 23 HD22 LEU 23 4.011 -20.941 10.483 171 HD23 LEU 23 HD23 LEU 23 3.914 -19.194 10.704 172 H THR 24 H THR 24 2.677 -23.873 12.788 173 HA THR 24 HA THR 24 3.847 -25.939 14.489 174 HB THR 24 HB THR 24 1.351 -25.727 14.284 175 HG1 THR 24 HG1 THR 24 1.769 -27.723 14.929 176 HG21 THR 24 HG21 THR 24 1.852 -26.718 11.473 177 HG22 THR 24 HG22 THR 24 1.212 -25.137 11.916 178 HG23 THR 24 HG23 THR 24 0.273 -26.593 12.249 179 H ARG 25 H ARG 25 3.729 -28.192 13.111 180 HA ARG 25 HA ARG 25 5.952 -28.180 11.391 181 HB2 ARG 25 HB3 ARG 25 3.784 -30.182 11.959 182 HB3 ARG 25 HB2 ARG 25 5.035 -30.511 10.773 183 HG2 ARG 25 HG3 ARG 25 5.562 -29.846 13.658 184 HG3 ARG 25 HG2 ARG 25 5.492 -31.481 12.996 185 HD2 ARG 25 HD3 ARG 25 7.260 -30.550 11.310 186 HD3 ARG 25 HD2 ARG 25 7.521 -29.335 12.562 187 HE ARG 25 HE ARG 25 7.597 -31.817 13.810 188 HH11 ARG 25 HH11 ARG 25 9.423 -29.972 11.469 189 HH12 ARG 25 HH12 ARG 25 10.898 -30.863 11.720 190 HH21 ARG 25 HH21 ARG 25 9.519 -33.008 14.145 191 HH22 ARG 25 HH22 ARG 25 10.963 -32.578 13.269 192 H ASP 26 H ASP 26 5.407 -29.691 9.201 193 HA ASP 26 HA ASP 26 4.828 -29.585 7.011 194 HB2 ASP 26 HB3 ASP 26 2.508 -29.723 7.618 195 HB3 ASP 26 HB2 ASP 26 2.467 -28.021 8.066 196 H GLN 27 H GLN 27 4.784 -26.582 8.769 197 HA GLN 27 HA GLN 27 5.445 -24.988 6.431 198 HB2 GLN 27 HB3 GLN 27 5.086 -24.272 9.346 199 HB3 GLN 27 HB2 GLN 27 5.329 -23.112 8.047 200 HG2 GLN 27 HG3 GLN 27 3.241 -23.584 7.087 201 HG3 GLN 27 HG2 GLN 27 3.055 -25.060 8.032 202 HE21 GLN 27 HE21 GLN 27 3.872 -23.910 10.533 203 HE22 GLN 27 HE22 GLN 27 2.585 -22.870 11.047 204 H VAL 28 H VAL 28 7.088 -23.124 7.313 205 HA VAL 28 HA VAL 28 9.184 -22.453 7.732 206 HB VAL 28 HB VAL 28 10.275 -23.059 9.701 207 HG11 VAL 28 HG11 VAL 28 8.134 -22.019 10.106 208 HG12 VAL 28 HG12 VAL 28 8.512 -23.167 11.390 209 HG13 VAL 28 HG13 VAL 28 7.347 -23.597 10.137 210 HG21 VAL 28 HG21 VAL 28 10.525 -25.454 9.356 211 HG22 VAL 28 HG22 VAL 28 8.813 -25.697 9.699 212 HG23 VAL 28 HG23 VAL 28 9.892 -25.119 10.968 213 H LYS 29 H LYS 29 8.637 -24.963 5.961 214 HA LYS 29 HA LYS 29 11.234 -26.169 5.764 215 HB2 LYS 29 HB3 LYS 29 10.289 -27.157 3.664 216 HB3 LYS 29 HB2 LYS 29 9.329 -27.466 5.104 217 HG2 LYS 29 HG3 LYS 29 7.923 -25.465 4.415 218 HG3 LYS 29 HG2 LYS 29 8.754 -25.557 2.861 219 HD2 LYS 29 HD3 LYS 29 7.901 -27.740 2.447 220 HD3 LYS 29 HD2 LYS 29 7.297 -27.883 4.101 221 HE2 LYS 29 HE3 LYS 29 5.828 -25.880 3.581 222 HE3 LYS 29 HE2 LYS 29 6.274 -26.116 1.890 223 HZ1 LYS 29 HZ1 LYS 29 4.150 -27.193 2.596 224 HZ2 LYS 29 HZ2 LYS 29 5.063 -28.238 3.566 225 HZ3 LYS 29 HZ3 LYS 29 5.275 -28.247 1.886 226 H ALA 30 H ALA 30 9.602 -23.455 4.382 227 HA ALA 30 HA ALA 30 12.033 -22.344 3.405 228 HB1 ALA 30 HB1 ALA 30 11.575 -23.883 1.551 229 HB2 ALA 30 HB2 ALA 30 11.436 -22.201 1.042 230 HB3 ALA 30 HB3 ALA 30 9.981 -23.154 1.340 231 H ILE 31 H ILE 31 11.420 -20.646 4.735 232 HA ILE 31 HA ILE 31 9.085 -19.101 3.817 233 HB ILE 31 HB ILE 31 10.546 -18.863 6.458 234 HG12 ILE 31 HG13 ILE 31 7.833 -20.049 5.822 235 HG13 ILE 31 HG12 ILE 31 9.263 -20.963 6.283 236 HG21 ILE 31 HG21 ILE 31 9.588 -16.756 5.721 237 HG22 ILE 31 HG22 ILE 31 8.670 -17.399 7.085 238 HG23 ILE 31 HG23 ILE 31 8.033 -17.538 5.446 239 HD11 ILE 31 HD11 ILE 31 7.762 -20.737 8.156 240 HD12 ILE 31 HD12 ILE 31 7.784 -18.981 7.994 241 HD13 ILE 31 HD13 ILE 31 9.249 -19.839 8.467 242 H ASN 32 H ASN 32 9.470 -17.249 2.801 243 HA ASN 32 HA ASN 32 12.214 -16.561 2.239 244 HB2 ASN 32 HB3 ASN 32 9.614 -15.315 1.309 245 HB3 ASN 32 HB2 ASN 32 11.207 -14.861 0.717 246 HD21 ASN 32 HD21 ASN 32 10.691 -15.410 -1.392 247 HD22 ASN 32 HD22 ASN 32 10.535 -17.063 -1.905 248 H PHE 33 H PHE 33 9.427 -15.025 3.796 249 HA PHE 33 HA PHE 33 11.246 -13.350 5.343 250 HB2 PHE 33 HB3 PHE 33 9.013 -12.217 3.649 251 HB3 PHE 33 HB2 PHE 33 9.919 -11.306 4.847 252 HD1 PHE 33 HD1 PHE 33 9.783 -12.430 1.463 253 HD2 PHE 33 HD2 PHE 33 12.412 -11.024 4.493 254 HE1 PHE 33 HE1 PHE 33 11.444 -11.850 -0.254 255 HE2 PHE 33 HE2 PHE 33 14.079 -10.444 2.783 256 HZ PHE 33 HZ PHE 33 13.594 -10.852 0.406 257 H LEU 34 H LEU 34 10.663 -13.577 7.390 258 HA LEU 34 HA LEU 34 7.993 -14.309 8.186 259 HB2 LEU 34 HB3 LEU 34 10.519 -13.622 9.675 260 HB3 LEU 34 HB2 LEU 34 8.996 -13.757 10.526 261 HG LEU 34 HG LEU 34 10.153 -15.814 10.793 262 HD11 LEU 34 HD11 LEU 34 8.022 -16.177 8.699 263 HD12 LEU 34 HD12 LEU 34 7.759 -16.009 10.435 264 HD13 LEU 34 HD13 LEU 34 8.614 -17.418 9.806 265 HD21 LEU 34 HD21 LEU 34 11.726 -15.635 8.953 266 HD22 LEU 34 HD22 LEU 34 10.428 -15.923 7.794 267 HD23 LEU 34 HD23 LEU 34 10.902 -17.196 8.920 268 HA PRO 35 HA PRO 35 6.262 -10.240 8.665 269 HB2 PRO 35 HB3 PRO 35 4.742 -10.605 10.917 270 HB3 PRO 35 HB2 PRO 35 4.268 -11.153 9.305 271 HG2 PRO 35 HG3 PRO 35 5.506 -12.701 11.547 272 HG3 PRO 35 HG2 PRO 35 4.206 -13.178 10.439 273 HD2 PRO 35 HD3 PRO 35 6.740 -14.033 10.125 274 HD3 PRO 35 HD2 PRO 35 5.680 -13.704 8.739 275 H VAL 36 H VAL 36 6.236 -8.371 10.074 276 HA VAL 36 HA VAL 36 8.695 -8.122 11.489 277 HB VAL 36 HB VAL 36 7.718 -6.270 10.180 278 HG11 VAL 36 HG11 VAL 36 5.370 -6.581 10.746 279 HG12 VAL 36 HG12 VAL 36 5.896 -4.934 11.094 280 HG13 VAL 36 HG13 VAL 36 5.700 -6.089 12.410 281 HG21 VAL 36 HG21 VAL 36 9.392 -5.773 11.863 282 HG22 VAL 36 HG22 VAL 36 8.143 -5.651 13.100 283 HG23 VAL 36 HG23 VAL 36 8.202 -4.474 11.788 284 H ASP 37 H ASP 37 9.076 -7.765 13.647 285 HA ASP 37 HA ASP 37 8.863 -7.914 15.887 286 HB2 ASP 37 HB3 ASP 37 6.966 -6.333 15.637 287 HB3 ASP 37 HB2 ASP 37 5.872 -7.701 15.465 288 H TYR 38 H TYR 38 8.161 -10.224 13.827 289 HA TYR 38 HA TYR 38 6.966 -12.196 15.515 290 HB2 TYR 38 HB3 TYR 38 7.175 -12.235 12.939 291 HB3 TYR 38 HB2 TYR 38 8.818 -12.807 13.216 292 HD1 TYR 38 HD1 TYR 38 9.239 -15.051 13.972 293 HD2 TYR 38 HD2 TYR 38 5.251 -13.610 13.619 294 HE1 TYR 38 HE1 TYR 38 8.386 -17.342 14.239 295 HE2 TYR 38 HE2 TYR 38 4.393 -15.895 13.881 296 HH TYR 38 HH TYR 38 5.183 -18.203 13.552 297 H GLU 39 H GLU 39 7.981 -13.711 16.836 298 HA GLU 39 HA GLU 39 10.854 -13.262 17.259 299 HB2 GLU 39 HB3 GLU 39 8.804 -13.659 19.448 300 HB3 GLU 39 HB2 GLU 39 10.527 -13.373 19.665 301 HG2 GLU 39 HG3 GLU 39 10.247 -11.171 18.570 302 HG3 GLU 39 HG2 GLU 39 8.511 -11.457 18.519 303 H ILE 40 H ILE 40 12.010 -15.019 18.234 304 HA ILE 40 HA ILE 40 10.703 -17.633 17.929 305 HB ILE 40 HB ILE 40 12.790 -18.506 16.871 306 HG12 ILE 40 HG13 ILE 40 13.434 -15.566 16.552 307 HG13 ILE 40 HG12 ILE 40 14.306 -16.696 17.583 308 HG21 ILE 40 HG21 ILE 40 10.822 -18.051 15.538 309 HG22 ILE 40 HG22 ILE 40 12.278 -17.644 14.632 310 HG23 ILE 40 HG23 ILE 40 11.306 -16.364 15.357 311 HD11 ILE 40 HD11 ILE 40 14.113 -16.818 14.582 312 HD12 ILE 40 HD12 ILE 40 14.986 -17.957 15.609 313 HD13 ILE 40 HD13 ILE 40 15.503 -16.274 15.522 314 H GLU 41 H GLU 41 11.905 -19.409 18.901 315 HA GLU 41 HA GLU 41 13.611 -18.580 21.160 316 HB2 GLU 41 HB3 GLU 41 11.410 -19.295 21.955 317 HB3 GLU 41 HB2 GLU 41 11.550 -20.796 21.051 318 HG2 GLU 41 HG3 GLU 41 13.517 -21.386 22.446 319 HG3 GLU 41 HG2 GLU 41 13.211 -19.944 23.411 320 H TYR 42 H TYR 42 15.323 -19.963 21.689 321 HA TYR 42 HA TYR 42 16.172 -21.766 19.554 322 HB2 TYR 42 HB3 TYR 42 17.658 -20.608 21.919 323 HB3 TYR 42 HB2 TYR 42 18.360 -21.752 20.783 324 HD1 TYR 42 HD1 TYR 42 19.166 -21.041 18.666 325 HD2 TYR 42 HD2 TYR 42 17.018 -18.329 21.135 326 HE1 TYR 42 HE1 TYR 42 19.851 -19.181 17.210 327 HE2 TYR 42 HE2 TYR 42 17.694 -16.463 19.687 328 HH TYR 42 HH TYR 42 19.157 -16.938 16.632 329 H VAL 43 H VAL 43 15.254 -23.728 19.833 330 HA VAL 43 HA VAL 43 15.268 -24.896 22.526 331 HB VAL 43 HB VAL 43 13.771 -26.653 21.542 332 HG11 VAL 43 HG11 VAL 43 12.869 -24.790 22.813 333 HG12 VAL 43 HG12 VAL 43 11.784 -25.216 21.489 334 HG13 VAL 43 HG13 VAL 43 12.821 -23.796 21.355 335 HG21 VAL 43 HG21 VAL 43 12.651 -26.143 19.410 336 HG22 VAL 43 HG22 VAL 43 14.378 -26.432 19.199 337 HG23 VAL 43 HG23 VAL 43 13.750 -24.784 19.169 338 H CYS 44 H CYS 44 16.234 -26.853 22.954 339 HA CYS 44 HA CYS 44 18.347 -27.613 21.097 340 HB2 CYS 44 HB3 CYS 44 18.791 -27.179 23.542 341 HB3 CYS 44 HB2 CYS 44 17.833 -28.605 23.913 342 H ARG 45 H ARG 45 18.766 -30.176 21.231 343 HA ARG 45 HA ARG 45 16.647 -31.355 19.798 344 HB2 ARG 45 HB3 ARG 45 19.316 -32.116 20.662 345 HB3 ARG 45 HB2 ARG 45 18.197 -33.472 20.728 346 HG2 ARG 45 HG3 ARG 45 18.753 -31.741 18.328 347 HG3 ARG 45 HG2 ARG 45 19.334 -33.388 18.589 348 HD2 ARG 45 HD3 ARG 45 16.986 -34.165 18.668 349 HD3 ARG 45 HD2 ARG 45 16.456 -32.523 18.311 350 HE ARG 45 HE ARG 45 18.205 -33.988 16.441 351 HH11 ARG 45 HH11 ARG 45 15.211 -32.295 17.150 352 HH12 ARG 45 HH12 ARG 45 14.702 -32.234 15.487 353 HH21 ARG 45 HH21 ARG 45 17.507 -33.958 14.259 354 HH22 ARG 45 HH22 ARG 45 16.005 -33.195 13.841 355 H GLY 46 H GLY 46 14.900 -32.433 20.397 356 HA2 GLY 46 HA3 GLY 46 13.373 -33.560 21.680 357 HA3 GLY 46 HA2 GLY 46 14.732 -34.154 22.625 358 H GLU 47 H GLU 47 14.180 -33.850 24.698 359 HA GLU 47 HA GLU 47 13.056 -31.253 25.441 360 HB2 GLU 47 HB3 GLU 47 12.658 -32.290 27.674 361 HB3 GLU 47 HB2 GLU 47 11.792 -33.053 26.352 362 HG2 GLU 47 HG3 GLU 47 13.234 -34.924 26.364 363 HG3 GLU 47 HG2 GLU 47 14.383 -34.119 27.433 364 H ARG 48 H ARG 48 14.944 -30.101 25.120 365 HA ARG 48 HA ARG 48 16.698 -30.140 27.440 366 HB2 ARG 48 HB3 ARG 48 17.632 -30.381 24.588 367 HB3 ARG 48 HB2 ARG 48 18.661 -29.693 25.836 368 HG2 ARG 48 HG3 ARG 48 17.458 -32.449 25.958 369 HG3 ARG 48 HG2 ARG 48 19.089 -32.090 25.388 370 HD2 ARG 48 HD3 ARG 48 19.731 -31.247 27.526 371 HD3 ARG 48 HD2 ARG 48 18.071 -31.322 28.112 372 HE ARG 48 HE ARG 48 18.813 -33.900 27.333 373 HH11 ARG 48 HH11 ARG 48 19.728 -31.527 29.742 374 HH12 ARG 48 HH12 ARG 48 20.116 -32.710 30.952 375 HH21 ARG 48 HH21 ARG 48 19.376 -35.466 28.916 376 HH22 ARG 48 HH22 ARG 48 19.926 -34.935 30.480 377 H GLU 49 H GLU 49 17.110 -28.148 28.159 378 HA GLU 49 HA GLU 49 16.140 -25.918 26.530 379 HB2 GLU 49 HB3 GLU 49 16.724 -26.041 29.493 380 HB3 GLU 49 HB2 GLU 49 16.127 -24.629 28.638 381 HG2 GLU 49 HG3 GLU 49 14.265 -25.572 29.701 382 HG3 GLU 49 HG2 GLU 49 14.119 -26.018 28.002 383 H VAL 50 H VAL 50 17.363 -24.045 26.280 384 HA VAL 50 HA VAL 50 20.201 -24.278 27.027 385 HB VAL 50 HB VAL 50 20.731 -22.726 25.194 386 HG11 VAL 50 HG11 VAL 50 19.158 -25.150 24.343 387 HG12 VAL 50 HG12 VAL 50 20.881 -25.076 24.714 388 HG13 VAL 50 HG13 VAL 50 20.249 -24.241 23.297 389 HG21 VAL 50 HG21 VAL 50 19.080 -22.114 23.514 390 HG22 VAL 50 HG22 VAL 50 18.599 -21.513 25.100 391 HG23 VAL 50 HG23 VAL 50 17.819 -22.944 24.428 392 H VAL 51 H VAL 51 20.784 -22.949 28.658 393 HA VAL 51 HA VAL 51 18.997 -20.778 29.351 394 HB VAL 51 HB VAL 51 19.885 -22.060 31.188 395 HG11 VAL 51 HG11 VAL 51 21.955 -22.823 30.174 396 HG12 VAL 51 HG12 VAL 51 22.248 -22.102 31.756 397 HG13 VAL 51 HG13 VAL 51 22.625 -21.196 30.291 398 HG21 VAL 51 HG21 VAL 51 20.810 -20.276 32.581 399 HG22 VAL 51 HG22 VAL 51 19.452 -19.705 31.611 400 HG23 VAL 51 HG23 VAL 51 21.104 -19.301 31.141 401 H GLY 52 H GLY 52 19.108 -19.296 27.831 402 HA2 GLY 52 HA3 GLY 52 21.466 -17.623 27.695 403 HA3 GLY 52 HA2 GLY 52 21.019 -18.415 26.186 404 HA PRO 53 HA PRO 53 18.356 -14.565 26.682 405 HB2 PRO 53 HB3 PRO 53 19.570 -12.994 24.834 406 HB3 PRO 53 HB2 PRO 53 20.033 -12.973 26.539 407 HG2 PRO 53 HG3 PRO 53 21.346 -14.350 24.234 408 HG3 PRO 53 HG2 PRO 53 22.089 -13.478 25.587 409 HD2 PRO 53 HD3 PRO 53 21.908 -16.199 25.456 410 HD3 PRO 53 HD2 PRO 53 21.956 -15.293 26.983 411 H LYS 54 H LYS 54 17.570 -16.808 25.561 412 HA LYS 54 HA LYS 54 17.690 -16.801 22.695 413 HB2 LYS 54 HB3 LYS 54 16.113 -18.776 22.932 414 HB3 LYS 54 HB2 LYS 54 17.694 -18.948 23.678 415 HG2 LYS 54 HG3 LYS 54 16.800 -18.636 25.852 416 HG3 LYS 54 HG2 LYS 54 15.247 -18.099 25.206 417 HD2 LYS 54 HD3 LYS 54 14.849 -20.333 24.295 418 HD3 LYS 54 HD2 LYS 54 16.413 -20.869 24.911 419 HE2 LYS 54 HE3 LYS 54 15.697 -20.554 27.174 420 HE3 LYS 54 HE2 LYS 54 14.196 -19.792 26.647 421 HZ1 LYS 54 HZ1 LYS 54 14.937 -22.603 26.034 422 HZ2 LYS 54 HZ2 LYS 54 13.441 -21.855 25.744 423 HZ3 LYS 54 HZ3 LYS 54 13.953 -22.145 27.335 424 H VAL 55 H VAL 55 16.744 -14.768 22.269 425 HA VAL 55 HA VAL 55 14.027 -15.144 21.471 426 HB VAL 55 HB VAL 55 13.541 -14.264 23.676 427 HG11 VAL 55 HG11 VAL 55 14.314 -12.021 24.369 428 HG12 VAL 55 HG12 VAL 55 15.368 -11.979 22.954 429 HG13 VAL 55 HG13 VAL 55 15.625 -13.190 24.211 430 HG21 VAL 55 HG21 VAL 55 12.099 -13.530 21.870 431 HG22 VAL 55 HG22 VAL 55 13.159 -12.156 21.557 432 HG23 VAL 55 HG23 VAL 55 12.270 -12.256 23.077 433 H ARG 56 H ARG 56 13.818 -14.239 19.512 434 HA ARG 56 HA ARG 56 15.622 -12.028 18.809 435 HB2 ARG 56 HB3 ARG 56 14.944 -14.348 16.990 436 HB3 ARG 56 HB2 ARG 56 15.980 -12.984 16.599 437 HG2 ARG 56 HG3 ARG 56 16.528 -15.113 18.652 438 HG3 ARG 56 HG2 ARG 56 17.309 -14.933 17.081 439 HD2 ARG 56 HD3 ARG 56 18.298 -12.849 17.752 440 HD3 ARG 56 HD2 ARG 56 17.403 -12.867 19.270 441 HE ARG 56 HE ARG 56 19.361 -14.973 18.646 442 HH11 ARG 56 HH11 ARG 56 18.166 -12.413 20.721 443 HH12 ARG 56 HH12 ARG 56 19.310 -12.728 21.986 444 HH21 ARG 56 HH21 ARG 56 20.867 -15.388 20.311 445 HH22 ARG 56 HH22 ARG 56 20.863 -14.416 21.742 446 H LYS 57 H LYS 57 14.531 -10.329 18.071 447 HA LYS 57 HA LYS 57 11.764 -10.749 17.206 448 HB2 LYS 57 HB3 LYS 57 12.158 -9.113 19.014 449 HB3 LYS 57 HB2 LYS 57 13.198 -8.189 17.939 450 HG2 LYS 57 HG3 LYS 57 11.238 -7.885 16.428 451 HG3 LYS 57 HG2 LYS 57 10.238 -8.648 17.665 452 HD2 LYS 57 HD3 LYS 57 11.884 -6.148 18.037 453 HD3 LYS 57 HD2 LYS 57 10.144 -6.191 17.765 454 HE2 LYS 57 HE3 LYS 57 11.587 -7.417 20.113 455 HE3 LYS 57 HE2 LYS 57 10.699 -5.895 20.137 456 HZ1 LYS 57 HZ1 LYS 57 8.763 -7.372 19.287 457 HZ2 LYS 57 HZ2 LYS 57 9.152 -7.349 20.936 458 HZ3 LYS 57 HZ3 LYS 57 9.667 -8.643 19.970 459 H CYS 58 H CYS 58 11.193 -10.503 15.146 460 HA CYS 58 HA CYS 58 13.174 -9.828 13.169 461 HB2 CYS 58 HB3 CYS 58 11.470 -11.572 12.753 462 HB3 CYS 58 HB2 CYS 58 10.207 -10.350 12.861 463 H LEU 59 H LEU 59 13.329 -7.959 12.010 464 HA LEU 59 HA LEU 59 11.565 -5.755 12.861 465 HB2 LEU 59 HB3 LEU 59 14.458 -5.650 12.001 466 HB3 LEU 59 HB2 LEU 59 13.473 -4.253 12.387 467 HG LEU 59 HG LEU 59 14.286 -6.431 14.319 468 HD11 LEU 59 HD11 LEU 59 15.603 -4.662 15.376 469 HD12 LEU 59 HD12 LEU 59 15.139 -3.549 14.090 470 HD13 LEU 59 HD13 LEU 59 16.129 -4.960 13.719 471 HD21 LEU 59 HD21 LEU 59 12.065 -5.536 14.820 472 HD22 LEU 59 HD22 LEU 59 12.718 -3.897 14.787 473 HD23 LEU 59 HD23 LEU 59 13.250 -5.035 16.025 474 H ALA 60 H ALA 60 11.895 -3.854 11.104 475 HA ALA 60 HA ALA 60 10.669 -4.793 8.731 476 HB1 ALA 60 HB1 ALA 60 10.821 -2.495 7.956 477 HB2 ALA 60 HB2 ALA 60 11.963 -2.118 9.246 478 HB3 ALA 60 HB3 ALA 60 10.299 -2.542 9.641 479 H ASN 61 H ASN 61 13.973 -4.186 9.641 480 HA ASN 61 HA ASN 61 14.988 -4.438 6.957 481 HB2 ASN 61 HB3 ASN 61 17.208 -4.482 8.008 482 HB3 ASN 61 HB2 ASN 61 16.252 -3.133 8.608 483 HD21 ASN 61 HD21 ASN 61 17.742 -6.162 9.383 484 HD22 ASN 61 HD22 ASN 61 17.531 -6.059 11.097 485 H GLY 62 H GLY 62 16.234 -6.222 6.192 486 HA2 GLY 62 HA3 GLY 62 14.942 -8.697 6.837 487 HA3 GLY 62 HA2 GLY 62 16.181 -8.451 5.619 488 H SER 63 H SER 63 15.881 -8.439 9.175 489 HA SER 63 HA SER 63 17.570 -10.668 9.510 490 HB2 SER 63 HB3 SER 63 19.302 -8.951 8.851 491 HB3 SER 63 HB2 SER 63 18.881 -8.056 10.308 492 HG SER 63 HG SER 63 20.706 -9.547 10.466 493 H TRP 64 H TRP 64 17.641 -11.329 11.663 494 HA TRP 64 HA TRP 64 15.600 -10.214 13.345 495 HB2 TRP 64 HB3 TRP 64 17.590 -12.434 13.903 496 HB3 TRP 64 HB2 TRP 64 16.176 -12.050 14.881 497 HD1 TRP 64 HD1 TRP 64 17.079 -13.443 11.392 498 HE1 TRP 64 HE1 TRP 64 15.107 -14.872 10.547 499 HE3 TRP 64 HE3 TRP 64 13.736 -12.510 15.154 500 HZ2 TRP 64 HZ2 TRP 64 12.486 -15.512 11.374 501 HZ3 TRP 64 HZ3 TRP 64 11.522 -13.575 15.047 502 HH2 TRP 64 HH2 TRP 64 10.911 -15.045 13.195 503 H THR 65 H THR 65 16.035 -9.580 15.591 504 HA THR 65 HA THR 65 17.623 -7.350 15.688 505 HB THR 65 HB THR 65 17.411 -7.572 18.224 506 HG1 THR 65 HG1 THR 65 17.010 -9.606 18.753 507 HG21 THR 65 HG21 THR 65 15.877 -6.261 16.854 508 HG22 THR 65 HG22 THR 65 15.009 -7.081 18.150 509 HG23 THR 65 HG23 THR 65 14.933 -7.708 16.502 510 H ASP 66 H ASP 66 18.472 -10.570 16.924 511 HA ASP 66 HA ASP 66 21.225 -9.590 17.318 512 HB2 ASP 66 HB3 ASP 66 20.015 -11.696 19.093 513 HB3 ASP 66 HB2 ASP 66 21.420 -10.682 19.391 514 H MET 67 H MET 67 22.504 -10.699 15.861 515 HA MET 67 HA MET 67 22.108 -13.629 15.943 516 HB2 MET 67 HB3 MET 67 23.180 -12.021 13.615 517 HB3 MET 67 HB2 MET 67 23.060 -13.773 13.678 518 HG2 MET 67 HG3 MET 67 20.592 -13.517 13.895 519 HG3 MET 67 HG2 MET 67 20.807 -11.788 13.642 520 HE1 MET 67 HE1 MET 67 18.939 -13.745 11.879 521 HE2 MET 67 HE2 MET 67 19.258 -13.107 10.267 522 HE3 MET 67 HE3 MET 67 19.046 -12.003 11.625 523 H ASP 68 H ASP 68 23.555 -13.263 17.862 524 HA ASP 68 HA ASP 68 25.897 -14.618 17.059 525 HB2 ASP 68 HB3 ASP 68 26.684 -12.225 16.814 526 HB3 ASP 68 HB2 ASP 68 26.439 -12.039 18.549 527 H THR 69 H THR 69 24.956 -16.226 18.386 528 HA THR 69 HA THR 69 25.602 -15.953 21.180 529 HB THR 69 HB THR 69 22.684 -16.347 20.467 530 HG1 THR 69 HG1 THR 69 24.145 -14.115 20.949 531 HG21 THR 69 HG21 THR 69 24.056 -16.195 23.153 532 HG22 THR 69 HG22 THR 69 23.360 -17.643 22.426 533 HG23 THR 69 HG23 THR 69 22.315 -16.300 22.890 534 HA PRO 70 HA PRO 70 25.840 -20.362 20.225 535 HB2 PRO 70 HB3 PRO 70 27.787 -20.875 22.035 536 HB3 PRO 70 HB2 PRO 70 28.132 -20.266 20.414 537 HG2 PRO 70 HG3 PRO 70 28.090 -18.820 23.015 538 HG3 PRO 70 HG2 PRO 70 29.149 -18.588 21.613 539 HD2 PRO 70 HD3 PRO 70 26.970 -16.999 22.233 540 HD3 PRO 70 HD2 PRO 70 27.695 -17.141 20.621 541 H SER 71 H SER 71 23.776 -20.692 21.105 542 HA SER 71 HA SER 71 23.208 -20.433 23.872 543 HB2 SER 71 HB3 SER 71 21.108 -21.721 23.219 544 HB3 SER 71 HB2 SER 71 21.391 -20.214 22.344 545 HG SER 71 HG SER 71 22.025 -22.831 21.430 546 H ARG 72 H ARG 72 24.075 -21.697 25.376 547 HA ARG 72 HA ARG 72 25.121 -24.283 24.701 548 HB2 ARG 72 HB3 ARG 72 25.877 -24.359 27.052 549 HB3 ARG 72 HB2 ARG 72 26.404 -22.913 26.208 550 HG2 ARG 72 HG3 ARG 72 24.557 -21.664 27.297 551 HG3 ARG 72 HG2 ARG 72 24.176 -23.122 28.222 552 HD2 ARG 72 HD3 ARG 72 26.478 -23.110 29.116 553 HD3 ARG 72 HD2 ARG 72 26.785 -21.607 28.250 554 HE ARG 72 HE ARG 72 24.953 -21.938 30.532 555 HH11 ARG 72 HH11 ARG 72 26.808 -19.885 28.371 556 HH12 ARG 72 HH12 ARG 72 26.647 -18.478 29.385 557 HH21 ARG 72 HH21 ARG 72 24.747 -20.092 31.847 558 HH22 ARG 72 HH22 ARG 72 25.466 -18.590 31.344 559 H CYS 73 H CYS 73 24.044 -26.074 24.707 560 HA CYS 73 HA CYS 73 21.426 -26.286 25.906 561 HB2 CYS 73 HB3 CYS 73 21.956 -27.278 23.691 562 HB3 CYS 73 HB2 CYS 73 23.106 -28.360 24.466 563 H VAL 74 H VAL 74 21.242 -26.663 28.028 564 HA VAL 74 HA VAL 74 22.781 -28.759 29.274 565 HB VAL 74 HB VAL 74 24.402 -26.977 29.430 566 HG11 VAL 74 HG11 VAL 74 22.917 -25.066 29.153 567 HG12 VAL 74 HG12 VAL 74 23.937 -24.872 30.580 568 HG13 VAL 74 HG13 VAL 74 22.247 -25.341 30.761 569 HG21 VAL 74 HG21 VAL 74 24.222 -28.461 31.356 570 HG22 VAL 74 HG22 VAL 74 23.029 -27.386 32.084 571 HG23 VAL 74 HG23 VAL 74 24.689 -26.834 31.853 572 H ARG 75 H ARG 75 21.620 -29.724 30.772 573 HA ARG 75 HA ARG 75 19.723 -28.209 32.384 574 HB2 ARG 75 HB3 ARG 75 18.290 -29.080 30.637 575 HB3 ARG 75 HB2 ARG 75 18.989 -30.687 30.807 576 HG2 ARG 75 HG3 ARG 75 18.138 -30.518 33.253 577 HG3 ARG 75 HG2 ARG 75 17.094 -29.248 32.614 578 HD2 ARG 75 HD3 ARG 75 17.250 -31.977 31.373 579 HD3 ARG 75 HD2 ARG 75 16.156 -31.616 32.702 580 HE ARG 75 HE ARG 75 15.757 -29.708 30.675 581 HH11 ARG 75 HH11 ARG 75 15.349 -33.151 31.217 582 HH12 ARG 75 HH12 ARG 75 13.936 -33.279 30.204 583 HH21 ARG 75 HH21 ARG 75 13.892 -29.866 29.350 584 HH22 ARG 75 HH22 ARG 75 13.082 -31.403 29.187 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 2.459 -0.430 2.722 2 H2 GLY 1 HT2 GLY 1 1.432 -1.377 3.684 3 H3 GLY 1 HT3 GLY 1 0.925 0.147 3.138 4 HA2 GLY 1 HA2 GLY 1 -0.105 -1.650 1.869 5 HA3 GLY 1 HA3 GLY 1 0.892 -0.595 0.874 6 HA PRO 2 HA PRO 2 2.459 -4.663 -0.290 7 HB2 PRO 2 HB3 PRO 2 3.452 -3.943 -2.679 8 HB3 PRO 2 HB2 PRO 2 1.716 -4.137 -2.414 9 HG2 PRO 2 HG3 PRO 2 3.353 -1.637 -2.508 10 HG3 PRO 2 HG2 PRO 2 1.752 -1.952 -3.203 11 HD2 PRO 2 HD3 PRO 2 2.170 -0.621 -0.841 12 HD3 PRO 2 HD2 PRO 2 0.682 -1.502 -1.233 13 H THR 3 H THR 3 3.979 -2.765 1.431 14 HA THR 3 HA THR 3 6.660 -2.717 0.394 15 HB THR 3 HB THR 3 7.141 -2.099 2.883 16 HG1 THR 3 HG1 THR 3 5.375 -2.383 4.043 17 HG21 THR 3 HG21 THR 3 7.221 -0.507 1.040 18 HG22 THR 3 HG22 THR 3 6.455 0.227 2.449 19 HG23 THR 3 HG23 THR 3 5.468 -0.328 1.096 20 H SER 4 H SER 4 8.479 -3.724 1.659 21 HA SER 4 HA SER 4 7.663 -6.401 2.583 22 HB2 SER 4 HB3 SER 4 10.044 -5.757 0.825 23 HB3 SER 4 HB2 SER 4 9.592 -7.357 1.414 24 HG SER 4 HG SER 4 7.474 -6.782 0.312 25 H GLU 5 H GLU 5 7.942 -6.084 4.728 26 HA GLU 5 HA GLU 5 10.715 -5.613 5.610 27 HB2 GLU 5 HB3 GLU 5 8.103 -4.881 6.904 28 HB3 GLU 5 HB2 GLU 5 9.522 -5.174 7.893 29 HG2 GLU 5 HG3 GLU 5 9.366 -2.846 7.562 30 HG3 GLU 5 HG2 GLU 5 10.703 -3.417 6.571 31 H GLY 6 H GLY 6 11.501 -7.662 5.745 32 HA2 GLY 6 HA3 GLY 6 10.323 -9.408 7.717 33 HA3 GLY 6 HA2 GLY 6 10.209 -10.008 6.071 34 H CYS 7 H CYS 7 11.649 -10.961 8.468 35 HA CYS 7 HA CYS 7 14.441 -10.801 7.752 36 HB2 CYS 7 HB3 CYS 7 13.085 -12.665 9.717 37 HB3 CYS 7 HB2 CYS 7 14.804 -12.291 9.629 38 H GLN 8 H GLN 8 15.696 -12.705 7.212 39 HA GLN 8 HA GLN 8 14.341 -14.343 5.246 40 HB2 GLN 8 HB3 GLN 8 16.652 -15.218 4.815 41 HB3 GLN 8 HB2 GLN 8 16.471 -13.485 4.584 42 HG2 GLN 8 HG3 GLN 8 17.647 -12.987 6.543 43 HG3 GLN 8 HG2 GLN 8 17.475 -14.624 7.168 44 HE21 GLN 8 HE21 GLN 8 18.222 -15.973 4.759 45 HE22 GLN 8 HE22 GLN 8 19.915 -15.723 4.535 46 H ILE 9 H ILE 9 15.350 -16.703 5.167 47 HA ILE 9 HA ILE 9 14.613 -18.007 7.651 48 HB ILE 9 HB ILE 9 15.468 -19.158 4.985 49 HG12 ILE 9 HG13 ILE 9 12.765 -19.008 6.335 50 HG13 ILE 9 HG12 ILE 9 13.269 -18.104 4.909 51 HG21 ILE 9 HG21 ILE 9 16.111 -20.667 6.772 52 HG22 ILE 9 HG22 ILE 9 14.737 -21.332 5.884 53 HG23 ILE 9 HG23 ILE 9 14.490 -20.580 7.458 54 HD11 ILE 9 HD11 ILE 9 11.839 -19.999 4.343 55 HD12 ILE 9 HD12 ILE 9 13.003 -21.096 5.084 56 HD13 ILE 9 HD13 ILE 9 13.452 -20.173 3.651 57 H ILE 10 H ILE 10 16.052 -18.359 9.155 58 HA ILE 10 HA ILE 10 18.886 -18.187 8.546 59 HB ILE 10 HB ILE 10 19.140 -18.242 11.045 60 HG12 ILE 10 HG13 ILE 10 16.115 -18.113 10.932 61 HG13 ILE 10 HG12 ILE 10 17.075 -19.418 11.620 62 HG21 ILE 10 HG21 ILE 10 17.354 -16.110 9.877 63 HG22 ILE 10 HG22 ILE 10 19.115 -16.158 9.784 64 HG23 ILE 10 HG23 ILE 10 18.318 -15.949 11.344 65 HD11 ILE 10 HD11 ILE 10 16.114 -17.967 13.334 66 HD12 ILE 10 HD12 ILE 10 16.975 -16.589 12.650 67 HD13 ILE 10 HD13 ILE 10 17.876 -17.928 13.360 68 H HIS 11 H HIS 11 20.392 -19.782 9.198 69 HA HIS 11 HA HIS 11 19.300 -22.449 8.803 70 HB2 HIS 11 HB3 HIS 11 22.103 -21.335 8.739 71 HB3 HIS 11 HB2 HIS 11 21.771 -23.062 8.636 72 HD1 HIS 11 HD1 HIS 11 21.795 -23.852 6.304 73 HD2 HIS 11 HD2 HIS 11 20.382 -19.947 6.585 74 HE1 HIS 11 HE1 HIS 11 21.271 -23.148 3.946 75 HE2 HIS 11 HE2 HIS 11 20.222 -20.863 4.166 76 HA PRO 12 HA PRO 12 19.635 -23.714 13.024 77 HB2 PRO 12 HB3 PRO 12 20.112 -26.431 12.011 78 HB3 PRO 12 HB2 PRO 12 18.753 -25.812 12.951 79 HG2 PRO 12 HG3 PRO 12 18.495 -26.492 10.362 80 HG3 PRO 12 HG2 PRO 12 17.587 -25.146 11.077 81 HD2 PRO 12 HD3 PRO 12 20.052 -25.076 9.380 82 HD3 PRO 12 HD2 PRO 12 18.616 -24.032 9.319 83 HA PRO 13 HA PRO 13 24.052 -24.150 13.496 84 HB2 PRO 13 HB3 PRO 13 24.169 -23.587 16.098 85 HB3 PRO 13 HB2 PRO 13 23.715 -22.346 14.925 86 HG2 PRO 13 HG3 PRO 13 21.993 -23.923 16.782 87 HG3 PRO 13 HG2 PRO 13 21.856 -22.225 16.294 88 HD2 PRO 13 HD3 PRO 13 20.405 -24.365 15.229 89 HD3 PRO 13 HD2 PRO 13 20.571 -22.756 14.501 90 H TRP 14 H TRP 14 25.004 -25.002 16.058 91 HA TRP 14 HA TRP 14 25.113 -27.790 15.748 92 HB2 TRP 14 HB3 TRP 14 26.724 -26.137 16.965 93 HB3 TRP 14 HB2 TRP 14 25.702 -26.446 18.366 94 HD1 TRP 14 HD1 TRP 14 26.730 -28.258 19.865 95 HE1 TRP 14 HE1 TRP 14 28.107 -30.410 19.496 96 HE3 TRP 14 HE3 TRP 14 27.087 -28.122 14.764 97 HZ2 TRP 14 HZ2 TRP 14 29.185 -31.844 17.329 98 HZ3 TRP 14 HZ3 TRP 14 28.306 -29.927 13.624 99 HH2 TRP 14 HH2 TRP 14 29.334 -31.749 14.883 100 H GLU 15 H GLU 15 24.747 -29.058 18.056 101 HA GLU 15 HA GLU 15 22.259 -30.046 17.966 102 HB2 GLU 15 HB3 GLU 15 23.842 -29.737 20.519 103 HB3 GLU 15 HB2 GLU 15 22.585 -30.928 20.216 104 HG2 GLU 15 HG3 GLU 15 25.222 -30.737 18.779 105 HG3 GLU 15 HG2 GLU 15 24.801 -31.908 20.029 106 H GLY 16 H GLY 16 20.505 -28.823 17.810 107 HA2 GLY 16 HA3 GLY 16 19.098 -27.909 20.004 108 HA3 GLY 16 HA2 GLY 16 19.978 -26.516 19.382 109 H GLY 17 H GLY 17 17.566 -25.887 19.132 110 HA2 GLY 17 HA3 GLY 17 16.962 -26.210 16.314 111 HA3 GLY 17 HA2 GLY 17 15.758 -26.882 17.406 112 H ILE 18 H ILE 18 14.480 -25.208 16.162 113 HA ILE 18 HA ILE 18 14.602 -22.683 17.640 114 HB ILE 18 HB ILE 18 14.389 -23.028 14.665 115 HG12 ILE 18 HG13 ILE 18 15.982 -21.252 16.509 116 HG13 ILE 18 HG12 ILE 18 16.586 -22.666 15.648 117 HG21 ILE 18 HG21 ILE 18 13.553 -20.560 16.199 118 HG22 ILE 18 HG22 ILE 18 12.464 -21.642 15.332 119 HG23 ILE 18 HG23 ILE 18 13.667 -20.707 14.445 120 HD11 ILE 18 HD11 ILE 18 16.210 -21.532 13.517 121 HD12 ILE 18 HD12 ILE 18 17.300 -20.621 14.562 122 HD13 ILE 18 HD13 ILE 18 15.621 -20.112 14.380 123 H ARG 19 H ARG 19 12.755 -21.838 18.295 124 HA ARG 19 HA ARG 19 10.308 -23.390 17.752 125 HB2 ARG 19 HB3 ARG 19 11.414 -23.489 20.051 126 HB3 ARG 19 HB2 ARG 19 10.925 -21.813 20.241 127 HG2 ARG 19 HG3 ARG 19 9.359 -23.368 21.321 128 HG3 ARG 19 HG2 ARG 19 8.589 -22.418 20.050 129 HD2 ARG 19 HD3 ARG 19 7.933 -24.816 20.043 130 HD3 ARG 19 HD2 ARG 19 8.669 -24.279 18.533 131 HE ARG 19 HE ARG 19 10.777 -25.320 19.482 132 HH11 ARG 19 HH11 ARG 19 7.578 -26.478 20.325 133 HH12 ARG 19 HH12 ARG 19 8.111 -28.111 20.598 134 HH21 ARG 19 HH21 ARG 19 11.454 -27.496 19.794 135 HH22 ARG 19 HH22 ARG 19 10.290 -28.685 20.286 136 H TYR 20 H TYR 20 8.835 -22.255 16.651 137 HA TYR 20 HA TYR 20 9.110 -19.383 16.410 138 HB2 TYR 20 HB3 TYR 20 7.142 -21.308 15.146 139 HB3 TYR 20 HB2 TYR 20 7.262 -19.594 14.765 140 HD1 TYR 20 HD1 TYR 20 8.852 -22.877 14.401 141 HD2 TYR 20 HD2 TYR 20 9.100 -18.739 13.434 142 HE1 TYR 20 HE1 TYR 20 10.543 -23.384 12.691 143 HE2 TYR 20 HE2 TYR 20 10.796 -19.235 11.722 144 HH TYR 20 HH TYR 20 12.442 -20.996 11.210 145 H ARG 21 H ARG 21 6.588 -18.443 16.149 146 HA ARG 21 HA ARG 21 5.639 -18.559 18.907 147 HB2 ARG 21 HB3 ARG 21 6.042 -16.338 17.928 148 HB3 ARG 21 HB2 ARG 21 4.890 -16.687 16.646 149 HG2 ARG 21 HG3 ARG 21 3.183 -17.013 18.521 150 HG3 ARG 21 HG2 ARG 21 4.366 -16.220 19.560 151 HD2 ARG 21 HD3 ARG 21 3.292 -15.048 17.001 152 HD3 ARG 21 HD2 ARG 21 2.639 -14.693 18.597 153 HE ARG 21 HE ARG 21 5.070 -13.922 19.051 154 HH11 ARG 21 HH11 ARG 21 3.429 -13.672 15.969 155 HH12 ARG 21 HH12 ARG 21 4.151 -12.145 15.548 156 HH21 ARG 21 HH21 ARG 21 6.038 -11.901 18.517 157 HH22 ARG 21 HH22 ARG 21 5.644 -11.138 17.001 158 H GLY 22 H GLY 22 4.264 -18.631 15.625 159 HA2 GLY 22 HA3 GLY 22 2.282 -20.571 16.564 160 HA3 GLY 22 HA2 GLY 22 1.694 -19.066 15.871 161 H LEU 23 H LEU 23 3.974 -21.686 15.128 162 HA LEU 23 HA LEU 23 2.770 -21.888 12.471 163 HB2 LEU 23 HB3 LEU 23 5.721 -21.616 13.036 164 HB3 LEU 23 HB2 LEU 23 5.099 -22.277 11.536 165 HG LEU 23 HG LEU 23 4.574 -19.483 12.555 166 HD11 LEU 23 HD11 LEU 23 6.040 -18.769 10.743 167 HD12 LEU 23 HD12 LEU 23 6.374 -20.454 10.343 168 HD13 LEU 23 HD13 LEU 23 6.897 -19.795 11.892 169 HD21 LEU 23 HD21 LEU 23 2.747 -20.374 11.188 170 HD22 LEU 23 HD22 LEU 23 3.898 -20.776 9.913 171 HD23 LEU 23 HD23 LEU 23 3.616 -19.091 10.350 172 H THR 24 H THR 24 2.088 -23.892 12.257 173 HA THR 24 HA THR 24 3.141 -26.012 13.905 174 HB THR 24 HB THR 24 0.700 -25.786 13.320 175 HG1 THR 24 HG1 THR 24 1.460 -27.762 14.105 176 HG21 THR 24 HG21 THR 24 1.639 -26.810 10.634 177 HG22 THR 24 HG22 THR 24 0.899 -25.240 10.952 178 HG23 THR 24 HG23 THR 24 -0.042 -26.716 11.160 179 H ARG 25 H ARG 25 3.318 -28.248 12.503 180 HA ARG 25 HA ARG 25 5.780 -27.827 11.080 181 HB2 ARG 25 HB3 ARG 25 4.271 -30.364 11.699 182 HB3 ARG 25 HB2 ARG 25 5.881 -30.294 10.992 183 HG2 ARG 25 HG3 ARG 25 6.702 -29.153 13.000 184 HG3 ARG 25 HG2 ARG 25 5.090 -29.270 13.710 185 HD2 ARG 25 HD3 ARG 25 5.231 -31.730 13.512 186 HD3 ARG 25 HD2 ARG 25 6.884 -31.560 12.921 187 HE ARG 25 HE ARG 25 6.967 -30.239 15.260 188 HH11 ARG 25 HH11 ARG 25 5.742 -33.399 14.391 189 HH12 ARG 25 HH12 ARG 25 6.075 -34.090 15.956 190 HH21 ARG 25 HH21 ARG 25 7.384 -31.148 17.329 191 HH22 ARG 25 HH22 ARG 25 7.012 -32.821 17.606 192 H ASP 26 H ASP 26 5.814 -29.856 9.223 193 HA ASP 26 HA ASP 26 5.604 -30.080 6.987 194 HB2 ASP 26 HB3 ASP 26 3.326 -30.740 7.208 195 HB3 ASP 26 HB2 ASP 26 2.807 -29.086 7.525 196 H GLN 27 H GLN 27 4.318 -26.999 8.143 197 HA GLN 27 HA GLN 27 5.172 -25.459 5.911 198 HB2 GLN 27 HB3 GLN 27 4.608 -24.668 8.772 199 HB3 GLN 27 HB2 GLN 27 4.818 -23.541 7.440 200 HG2 GLN 27 HG3 GLN 27 2.838 -24.335 6.367 201 HG3 GLN 27 HG2 GLN 27 2.673 -25.646 7.533 202 HE21 GLN 27 HE21 GLN 27 3.365 -24.016 9.820 203 HE22 GLN 27 HE22 GLN 27 2.000 -22.994 10.122 204 H VAL 28 H VAL 28 6.606 -23.406 6.855 205 HA VAL 28 HA VAL 28 8.685 -22.625 7.141 206 HB VAL 28 HB VAL 28 9.889 -23.091 9.084 207 HG11 VAL 28 HG11 VAL 28 7.009 -23.723 9.666 208 HG12 VAL 28 HG12 VAL 28 7.741 -22.123 9.548 209 HG13 VAL 28 HG13 VAL 28 8.204 -23.212 10.857 210 HG21 VAL 28 HG21 VAL 28 10.231 -25.489 8.833 211 HG22 VAL 28 HG22 VAL 28 8.553 -25.788 9.288 212 HG23 VAL 28 HG23 VAL 28 9.676 -25.095 10.459 213 H LYS 29 H LYS 29 8.173 -25.337 5.586 214 HA LYS 29 HA LYS 29 10.911 -26.134 5.115 215 HB2 LYS 29 HB3 LYS 29 9.945 -27.548 3.332 216 HB3 LYS 29 HB2 LYS 29 9.113 -27.785 4.864 217 HG2 LYS 29 HG3 LYS 29 7.352 -26.205 4.071 218 HG3 LYS 29 HG2 LYS 29 8.150 -26.195 2.499 219 HD2 LYS 29 HD3 LYS 29 7.778 -28.566 2.243 220 HD3 LYS 29 HD2 LYS 29 7.117 -28.673 3.876 221 HE2 LYS 29 HE3 LYS 29 5.337 -27.051 3.141 222 HE3 LYS 29 HE2 LYS 29 5.937 -27.249 1.495 223 HZ1 LYS 29 HZ1 LYS 29 5.500 -29.664 1.737 224 HZ2 LYS 29 HZ2 LYS 29 4.100 -28.708 1.820 225 HZ3 LYS 29 HZ3 LYS 29 4.766 -29.354 3.239 226 H ALA 30 H ALA 30 8.697 -23.791 4.060 227 HA ALA 30 HA ALA 30 10.676 -22.561 2.375 228 HB1 ALA 30 HB1 ALA 30 9.609 -24.058 0.775 229 HB2 ALA 30 HB2 ALA 30 9.218 -22.377 0.411 230 HB3 ALA 30 HB3 ALA 30 8.026 -23.408 1.204 231 H ILE 31 H ILE 31 10.673 -20.753 3.557 232 HA ILE 31 HA ILE 31 8.142 -19.250 3.738 233 HB ILE 31 HB ILE 31 10.510 -19.017 5.616 234 HG12 ILE 31 HG13 ILE 31 7.798 -20.263 6.122 235 HG13 ILE 31 HG12 ILE 31 9.301 -21.155 5.915 236 HG21 ILE 31 HG21 ILE 31 9.296 -16.935 5.375 237 HG22 ILE 31 HG22 ILE 31 8.988 -17.629 6.966 238 HG23 ILE 31 HG23 ILE 31 7.770 -17.759 5.697 239 HD11 ILE 31 HD11 ILE 31 10.200 -20.092 7.927 240 HD12 ILE 31 HD12 ILE 31 8.710 -20.975 8.256 241 HD13 ILE 31 HD13 ILE 31 8.684 -19.217 8.132 242 H ASN 32 H ASN 32 8.240 -17.070 3.151 243 HA ASN 32 HA ASN 32 10.514 -16.412 1.472 244 HB2 ASN 32 HB3 ASN 32 8.026 -16.098 0.858 245 HB3 ASN 32 HB2 ASN 32 8.093 -14.681 1.901 246 HD21 ASN 32 HD21 ASN 32 7.708 -15.058 -0.997 247 HD22 ASN 32 HD22 ASN 32 8.877 -14.020 -1.749 248 H PHE 33 H PHE 33 8.595 -14.549 3.834 249 HA PHE 33 HA PHE 33 11.071 -13.703 5.137 250 HB2 PHE 33 HB3 PHE 33 9.009 -11.799 4.019 251 HB3 PHE 33 HB2 PHE 33 10.206 -11.331 5.216 252 HD1 PHE 33 HD1 PHE 33 9.461 -11.252 1.854 253 HD2 PHE 33 HD2 PHE 33 12.699 -12.062 4.486 254 HE1 PHE 33 HE1 PHE 33 11.051 -10.734 0.046 255 HE2 PHE 33 HE2 PHE 33 14.296 -11.545 2.690 256 HZ PHE 33 HZ PHE 33 13.471 -10.877 0.468 257 H LEU 34 H LEU 34 10.853 -13.415 7.309 258 HA LEU 34 HA LEU 34 8.300 -14.052 8.522 259 HB2 LEU 34 HB3 LEU 34 11.023 -13.416 9.658 260 HB3 LEU 34 HB2 LEU 34 9.612 -13.606 10.678 261 HG LEU 34 HG LEU 34 10.822 -15.650 10.738 262 HD11 LEU 34 HD11 LEU 34 8.405 -15.887 10.657 263 HD12 LEU 34 HD12 LEU 34 9.195 -17.249 9.862 264 HD13 LEU 34 HD13 LEU 34 8.458 -15.971 8.898 265 HD21 LEU 34 HD21 LEU 34 10.762 -15.611 7.727 266 HD22 LEU 34 HD22 LEU 34 11.325 -16.958 8.712 267 HD23 LEU 34 HD23 LEU 34 12.178 -15.415 8.757 268 HA PRO 35 HA PRO 35 6.860 -9.869 8.615 269 HB2 PRO 35 HB3 PRO 35 5.220 -10.103 10.833 270 HB3 PRO 35 HB2 PRO 35 4.761 -10.544 9.188 271 HG2 PRO 35 HG3 PRO 35 5.722 -12.285 11.419 272 HG3 PRO 35 HG2 PRO 35 4.457 -12.598 10.214 273 HD2 PRO 35 HD3 PRO 35 6.893 -13.699 10.005 274 HD3 PRO 35 HD2 PRO 35 5.993 -13.166 8.570 275 H VAL 36 H VAL 36 7.529 -8.005 9.536 276 HA VAL 36 HA VAL 36 9.535 -8.068 11.523 277 HB VAL 36 HB VAL 36 9.655 -6.363 9.856 278 HG11 VAL 36 HG11 VAL 36 7.018 -5.327 10.881 279 HG12 VAL 36 HG12 VAL 36 7.295 -6.127 9.335 280 HG13 VAL 36 HG13 VAL 36 8.023 -4.553 9.656 281 HG21 VAL 36 HG21 VAL 36 10.566 -5.766 12.029 282 HG22 VAL 36 HG22 VAL 36 9.004 -5.110 12.520 283 HG23 VAL 36 HG23 VAL 36 9.913 -4.341 11.219 284 H ASP 37 H ASP 37 8.628 -9.090 13.236 285 HA ASP 37 HA ASP 37 7.884 -7.721 15.453 286 HB2 ASP 37 HB3 ASP 37 5.757 -7.061 14.487 287 HB3 ASP 37 HB2 ASP 37 5.417 -8.720 14.000 288 H TYR 38 H TYR 38 7.595 -10.542 13.500 289 HA TYR 38 HA TYR 38 6.723 -12.434 15.338 290 HB2 TYR 38 HB3 TYR 38 7.112 -12.574 12.756 291 HB3 TYR 38 HB2 TYR 38 8.714 -13.146 13.214 292 HD1 TYR 38 HD1 TYR 38 8.996 -15.319 14.292 293 HD2 TYR 38 HD2 TYR 38 5.142 -13.897 13.199 294 HE1 TYR 38 HE1 TYR 38 8.079 -17.580 14.606 295 HE2 TYR 38 HE2 TYR 38 4.215 -16.151 13.509 296 HH TYR 38 HH TYR 38 5.027 -18.501 13.497 297 H GLU 39 H GLU 39 7.683 -13.736 16.784 298 HA GLU 39 HA GLU 39 10.512 -13.204 17.396 299 HB2 GLU 39 HB3 GLU 39 8.241 -13.652 19.350 300 HB3 GLU 39 HB2 GLU 39 9.932 -13.410 19.777 301 HG2 GLU 39 HG3 GLU 39 9.894 -11.172 19.221 302 HG3 GLU 39 HG2 GLU 39 8.500 -11.349 18.156 303 H ILE 40 H ILE 40 11.774 -14.943 17.873 304 HA ILE 40 HA ILE 40 10.462 -17.575 18.040 305 HB ILE 40 HB ILE 40 12.359 -18.568 16.810 306 HG12 ILE 40 HG13 ILE 40 13.114 -15.701 16.216 307 HG13 ILE 40 HG12 ILE 40 14.009 -16.790 17.269 308 HG21 ILE 40 HG21 ILE 40 11.686 -17.816 14.575 309 HG22 ILE 40 HG22 ILE 40 10.848 -16.443 15.300 310 HG23 ILE 40 HG23 ILE 40 10.300 -18.087 15.634 311 HD11 ILE 40 HD11 ILE 40 14.455 -18.252 15.366 312 HD12 ILE 40 HD12 ILE 40 15.058 -16.616 15.098 313 HD13 ILE 40 HD13 ILE 40 13.570 -17.146 14.317 314 H GLU 41 H GLU 41 11.691 -19.213 19.149 315 HA GLU 41 HA GLU 41 13.622 -18.091 21.075 316 HB2 GLU 41 HB3 GLU 41 11.393 -18.688 22.053 317 HB3 GLU 41 HB2 GLU 41 11.678 -20.355 21.572 318 HG2 GLU 41 HG3 GLU 41 13.677 -20.403 22.993 319 HG3 GLU 41 HG2 GLU 41 13.335 -18.751 23.501 320 H TYR 42 H TYR 42 15.316 -19.459 21.751 321 HA TYR 42 HA TYR 42 16.027 -21.517 19.796 322 HB2 TYR 42 HB3 TYR 42 17.691 -20.000 21.805 323 HB3 TYR 42 HB2 TYR 42 18.313 -21.334 20.840 324 HD1 TYR 42 HD1 TYR 42 17.853 -21.050 18.221 325 HD2 TYR 42 HD2 TYR 42 18.062 -17.870 21.041 326 HE1 TYR 42 HE1 TYR 42 18.419 -19.488 16.407 327 HE2 TYR 42 HE2 TYR 42 18.628 -16.304 19.238 328 HH TYR 42 HH TYR 42 18.379 -17.139 15.916 329 H VAL 43 H VAL 43 15.148 -23.402 20.438 330 HA VAL 43 HA VAL 43 15.533 -24.261 23.210 331 HB VAL 43 HB VAL 43 14.124 -26.214 22.591 332 HG11 VAL 43 HG11 VAL 43 12.914 -23.515 22.004 333 HG12 VAL 43 HG12 VAL 43 13.098 -24.257 23.594 334 HG13 VAL 43 HG13 VAL 43 12.011 -24.978 22.407 335 HG21 VAL 43 HG21 VAL 43 14.625 -26.338 20.216 336 HG22 VAL 43 HG22 VAL 43 13.837 -24.782 19.950 337 HG23 VAL 43 HG23 VAL 43 12.887 -26.174 20.468 338 H CYS 44 H CYS 44 16.334 -26.533 23.534 339 HA CYS 44 HA CYS 44 18.635 -26.980 21.812 340 HB2 CYS 44 HB3 CYS 44 18.831 -27.007 24.316 341 HB3 CYS 44 HB2 CYS 44 17.854 -28.467 24.328 342 H ARG 45 H ARG 45 19.095 -29.520 21.567 343 HA ARG 45 HA ARG 45 17.051 -30.313 19.725 344 HB2 ARG 45 HB3 ARG 45 19.700 -30.611 19.685 345 HB3 ARG 45 HB2 ARG 45 19.285 -32.148 20.428 346 HG2 ARG 45 HG3 ARG 45 18.149 -31.166 17.820 347 HG3 ARG 45 HG2 ARG 45 19.537 -32.242 17.965 348 HD2 ARG 45 HD3 ARG 45 18.209 -33.962 18.929 349 HD3 ARG 45 HD2 ARG 45 16.837 -32.871 19.133 350 HE ARG 45 HE ARG 45 16.935 -32.773 16.563 351 HH11 ARG 45 HH11 ARG 45 17.661 -35.610 18.504 352 HH12 ARG 45 HH12 ARG 45 17.236 -36.732 17.240 353 HH21 ARG 45 HH21 ARG 45 16.342 -34.240 14.927 354 HH22 ARG 45 HH22 ARG 45 16.460 -35.949 15.221 355 H GLY 46 H GLY 46 15.298 -31.390 20.265 356 HA2 GLY 46 HA3 GLY 46 14.204 -33.362 20.895 357 HA3 GLY 46 HA2 GLY 46 15.573 -33.772 21.917 358 H GLU 47 H GLU 47 15.581 -33.165 24.028 359 HA GLU 47 HA GLU 47 13.205 -31.753 25.017 360 HB2 GLU 47 HB3 GLU 47 13.004 -33.482 26.801 361 HB3 GLU 47 HB2 GLU 47 12.689 -34.101 25.187 362 HG2 GLU 47 HG3 GLU 47 14.940 -35.043 25.102 363 HG3 GLU 47 HG2 GLU 47 15.265 -34.416 26.716 364 H ARG 48 H ARG 48 16.151 -31.169 24.744 365 HA ARG 48 HA ARG 48 16.934 -30.921 27.548 366 HB2 ARG 48 HB3 ARG 48 18.435 -30.503 24.967 367 HB3 ARG 48 HB2 ARG 48 19.111 -30.113 26.542 368 HG2 ARG 48 HG3 ARG 48 18.169 -32.839 25.681 369 HG3 ARG 48 HG2 ARG 48 19.851 -32.296 25.720 370 HD2 ARG 48 HD3 ARG 48 19.656 -31.908 28.132 371 HD3 ARG 48 HD2 ARG 48 17.986 -32.473 28.085 372 HE ARG 48 HE ARG 48 18.896 -34.662 27.388 373 HH11 ARG 48 HH11 ARG 48 21.010 -32.360 28.977 374 HH12 ARG 48 HH12 ARG 48 22.070 -33.583 29.624 375 HH21 ARG 48 HH21 ARG 48 20.266 -36.271 28.253 376 HH22 ARG 48 HH22 ARG 48 21.633 -35.807 29.218 377 H GLU 49 H GLU 49 17.245 -28.984 28.559 378 HA GLU 49 HA GLU 49 16.116 -26.634 27.255 379 HB2 GLU 49 HB3 GLU 49 16.666 -27.412 30.084 380 HB3 GLU 49 HB2 GLU 49 16.591 -25.704 29.684 381 HG2 GLU 49 HG3 GLU 49 14.464 -26.505 30.512 382 HG3 GLU 49 HG2 GLU 49 14.330 -25.991 28.834 383 H VAL 50 H VAL 50 17.178 -24.622 27.259 384 HA VAL 50 HA VAL 50 20.114 -24.764 27.515 385 HB VAL 50 HB VAL 50 20.315 -23.055 25.789 386 HG11 VAL 50 HG11 VAL 50 18.590 -25.354 24.885 387 HG12 VAL 50 HG12 VAL 50 20.348 -25.355 25.030 388 HG13 VAL 50 HG13 VAL 50 19.561 -24.329 23.830 389 HG21 VAL 50 HG21 VAL 50 18.385 -22.303 24.490 390 HG22 VAL 50 HG22 VAL 50 18.235 -21.855 26.189 391 HG23 VAL 50 HG23 VAL 50 17.313 -23.216 25.549 392 H VAL 51 H VAL 51 21.157 -22.931 28.418 393 HA VAL 51 HA VAL 51 19.318 -20.983 29.631 394 HB VAL 51 HB VAL 51 20.392 -22.194 31.401 395 HG11 VAL 51 HG11 VAL 51 23.026 -21.503 30.116 396 HG12 VAL 51 HG12 VAL 51 22.290 -23.103 30.196 397 HG13 VAL 51 HG13 VAL 51 22.821 -22.302 31.674 398 HG21 VAL 51 HG21 VAL 51 21.584 -20.385 32.577 399 HG22 VAL 51 HG22 VAL 51 20.101 -19.823 31.800 400 HG23 VAL 51 HG23 VAL 51 21.667 -19.482 31.063 401 H GLY 52 H GLY 52 19.262 -19.473 28.086 402 HA2 GLY 52 HA3 GLY 52 21.632 -17.828 27.776 403 HA3 GLY 52 HA2 GLY 52 21.034 -18.560 26.292 404 HA PRO 53 HA PRO 53 18.479 -14.679 27.059 405 HB2 PRO 53 HB3 PRO 53 19.663 -13.045 25.254 406 HB3 PRO 53 HB2 PRO 53 20.162 -13.096 26.949 407 HG2 PRO 53 HG3 PRO 53 21.413 -14.402 24.563 408 HG3 PRO 53 HG2 PRO 53 22.193 -13.570 25.921 409 HD2 PRO 53 HD3 PRO 53 22.017 -16.281 25.740 410 HD3 PRO 53 HD2 PRO 53 22.065 -15.414 27.288 411 H LYS 54 H LYS 54 17.598 -16.809 25.909 412 HA LYS 54 HA LYS 54 17.755 -16.859 23.049 413 HB2 LYS 54 HB3 LYS 54 16.154 -18.790 23.280 414 HB3 LYS 54 HB2 LYS 54 17.682 -18.971 24.127 415 HG2 LYS 54 HG3 LYS 54 16.672 -18.576 26.229 416 HG3 LYS 54 HG2 LYS 54 15.170 -18.025 25.481 417 HD2 LYS 54 HD3 LYS 54 14.842 -20.300 24.566 418 HD3 LYS 54 HD2 LYS 54 16.298 -20.825 25.417 419 HE2 LYS 54 HE3 LYS 54 15.302 -20.391 27.539 420 HE3 LYS 54 HE2 LYS 54 13.925 -19.585 26.792 421 HZ1 LYS 54 HZ1 LYS 54 13.218 -21.671 25.846 422 HZ2 LYS 54 HZ2 LYS 54 13.408 -21.844 27.525 423 HZ3 LYS 54 HZ3 LYS 54 14.580 -22.466 26.477 424 H VAL 55 H VAL 55 16.843 -14.872 22.421 425 HA VAL 55 HA VAL 55 14.092 -15.263 21.733 426 HB VAL 55 HB VAL 55 13.828 -14.110 23.910 427 HG11 VAL 55 HG11 VAL 55 14.489 -11.778 24.165 428 HG12 VAL 55 HG12 VAL 55 15.294 -11.829 22.597 429 HG13 VAL 55 HG13 VAL 55 15.891 -12.822 23.928 430 HG21 VAL 55 HG21 VAL 55 12.351 -12.304 23.114 431 HG22 VAL 55 HG22 VAL 55 12.127 -13.809 22.224 432 HG23 VAL 55 HG23 VAL 55 13.035 -12.484 21.496 433 H ARG 56 H ARG 56 13.700 -14.443 19.758 434 HA ARG 56 HA ARG 56 15.558 -12.416 18.715 435 HB2 ARG 56 HB3 ARG 56 14.584 -14.874 17.257 436 HB3 ARG 56 HB2 ARG 56 15.449 -13.546 16.499 437 HG2 ARG 56 HG3 ARG 56 16.504 -15.344 18.664 438 HG3 ARG 56 HG2 ARG 56 16.929 -15.402 16.951 439 HD2 ARG 56 HD3 ARG 56 17.849 -13.146 17.105 440 HD3 ARG 56 HD2 ARG 56 17.415 -13.083 18.814 441 HE ARG 56 HE ARG 56 19.246 -15.160 17.837 442 HH11 ARG 56 HH11 ARG 56 18.573 -12.419 19.908 443 HH12 ARG 56 HH12 ARG 56 20.095 -12.513 20.749 444 HH21 ARG 56 HH21 ARG 56 21.236 -15.314 18.961 445 HH22 ARG 56 HH22 ARG 56 21.609 -14.145 20.198 446 H LYS 57 H LYS 57 14.483 -10.677 18.145 447 HA LYS 57 HA LYS 57 11.704 -10.956 17.245 448 HB2 LYS 57 HB3 LYS 57 12.111 -9.371 19.095 449 HB3 LYS 57 HB2 LYS 57 13.242 -8.485 18.083 450 HG2 LYS 57 HG3 LYS 57 11.353 -8.031 16.511 451 HG3 LYS 57 HG2 LYS 57 10.269 -8.756 17.701 452 HD2 LYS 57 HD3 LYS 57 12.062 -6.373 18.182 453 HD3 LYS 57 HD2 LYS 57 10.325 -6.302 17.880 454 HE2 LYS 57 HE3 LYS 57 9.892 -7.556 19.906 455 HE3 LYS 57 HE2 LYS 57 11.623 -7.735 20.191 456 HZ1 LYS 57 HZ1 LYS 57 11.792 -5.329 20.413 457 HZ2 LYS 57 HZ2 LYS 57 10.696 -5.965 21.536 458 HZ3 LYS 57 HZ3 LYS 57 10.123 -5.169 20.154 459 H CYS 58 H CYS 58 11.220 -10.662 15.156 460 HA CYS 58 HA CYS 58 13.274 -10.345 13.231 461 HB2 CYS 58 HB3 CYS 58 11.157 -11.597 12.843 462 HB3 CYS 58 HB2 CYS 58 10.291 -10.064 12.834 463 H LEU 59 H LEU 59 13.756 -8.611 11.884 464 HA LEU 59 HA LEU 59 12.879 -6.003 12.937 465 HB2 LEU 59 HB3 LEU 59 15.462 -6.728 11.544 466 HB3 LEU 59 HB2 LEU 59 15.032 -5.132 12.134 467 HG LEU 59 HG LEU 59 15.439 -7.576 13.861 468 HD11 LEU 59 HD11 LEU 59 17.176 -5.141 13.494 469 HD12 LEU 59 HD12 LEU 59 17.523 -6.754 12.874 470 HD13 LEU 59 HD13 LEU 59 17.467 -6.470 14.614 471 HD21 LEU 59 HD21 LEU 59 13.805 -6.060 14.817 472 HD22 LEU 59 HD22 LEU 59 14.898 -4.698 14.581 473 HD23 LEU 59 HD23 LEU 59 15.315 -5.972 15.724 474 H ALA 60 H ALA 60 13.479 -4.256 11.108 475 HA ALA 60 HA ALA 60 11.706 -4.846 8.915 476 HB1 ALA 60 HB1 ALA 60 11.685 -2.652 9.995 477 HB2 ALA 60 HB2 ALA 60 12.063 -2.515 8.277 478 HB3 ALA 60 HB3 ALA 60 13.348 -2.377 9.477 479 H ASN 61 H ASN 61 14.532 -6.043 9.291 480 HA ASN 61 HA ASN 61 15.273 -5.854 6.485 481 HB2 ASN 61 HB3 ASN 61 17.608 -5.467 6.927 482 HB3 ASN 61 HB2 ASN 61 16.685 -4.205 7.733 483 HD21 ASN 61 HD21 ASN 61 18.861 -6.801 8.086 484 HD22 ASN 61 HD22 ASN 61 19.062 -6.704 9.808 485 H GLY 62 H GLY 62 17.389 -7.507 6.365 486 HA2 GLY 62 HA3 GLY 62 16.034 -9.981 6.498 487 HA3 GLY 62 HA2 GLY 62 17.706 -9.749 6.028 488 H SER 63 H SER 63 18.331 -8.537 8.724 489 HA SER 63 HA SER 63 18.808 -11.131 9.971 490 HB2 SER 63 HB3 SER 63 20.497 -9.931 11.327 491 HB3 SER 63 HB2 SER 63 20.770 -9.737 9.597 492 HG SER 63 HG SER 63 20.428 -7.849 11.444 493 H TRP 64 H TRP 64 18.759 -11.257 12.359 494 HA TRP 64 HA TRP 64 16.255 -10.114 13.311 495 HB2 TRP 64 HB3 TRP 64 17.986 -12.315 14.461 496 HB3 TRP 64 HB2 TRP 64 16.436 -11.798 15.120 497 HD1 TRP 64 HD1 TRP 64 17.840 -13.343 11.850 498 HE1 TRP 64 HE1 TRP 64 16.004 -14.812 10.801 499 HE3 TRP 64 HE3 TRP 64 14.046 -12.371 15.138 500 HZ2 TRP 64 HZ2 TRP 64 13.307 -15.473 11.309 501 HZ3 TRP 64 HZ3 TRP 64 11.873 -13.465 14.786 502 HH2 TRP 64 HH2 TRP 64 11.510 -14.985 12.911 503 H THR 65 H THR 65 16.441 -9.885 15.933 504 HA THR 65 HA THR 65 17.480 -7.386 16.312 505 HB THR 65 HB THR 65 17.439 -8.039 18.827 506 HG1 THR 65 HG1 THR 65 16.936 -10.052 19.258 507 HG21 THR 65 HG21 THR 65 14.962 -7.953 18.808 508 HG22 THR 65 HG22 THR 65 14.998 -8.175 17.060 509 HG23 THR 65 HG23 THR 65 15.702 -6.727 17.778 510 H ASP 66 H ASP 66 18.932 -10.198 17.962 511 HA ASP 66 HA ASP 66 21.579 -8.956 17.591 512 HB2 ASP 66 HB3 ASP 66 20.676 -8.473 19.896 513 HB3 ASP 66 HB2 ASP 66 20.608 -10.200 20.180 514 H MET 67 H MET 67 20.879 -10.921 15.881 515 HA MET 67 HA MET 67 21.153 -13.498 17.161 516 HB2 MET 67 HB3 MET 67 19.533 -13.289 15.368 517 HB3 MET 67 HB2 MET 67 20.801 -12.809 14.243 518 HG2 MET 67 HG3 MET 67 21.856 -14.988 14.486 519 HG3 MET 67 HG2 MET 67 20.610 -15.473 15.634 520 HE1 MET 67 HE1 MET 67 20.426 -17.648 14.065 521 HE2 MET 67 HE2 MET 67 21.550 -16.974 12.886 522 HE3 MET 67 HE3 MET 67 19.978 -17.578 12.362 523 H ASP 68 H ASP 68 23.308 -12.975 17.925 524 HA ASP 68 HA ASP 68 24.779 -15.007 16.610 525 HB2 ASP 68 HB3 ASP 68 25.705 -13.017 15.398 526 HB3 ASP 68 HB2 ASP 68 26.212 -12.356 16.950 527 H THR 69 H THR 69 24.375 -16.073 18.517 528 HA THR 69 HA THR 69 25.771 -15.210 20.900 529 HB THR 69 HB THR 69 22.793 -15.518 21.183 530 HG1 THR 69 HG1 THR 69 24.192 -13.145 20.451 531 HG21 THR 69 HG21 THR 69 24.115 -15.500 23.224 532 HG22 THR 69 HG22 THR 69 23.150 -14.023 23.112 533 HG23 THR 69 HG23 THR 69 24.875 -13.984 22.741 534 HA PRO 70 HA PRO 70 25.621 -19.714 20.862 535 HB2 PRO 70 HB3 PRO 70 27.393 -19.454 23.190 536 HB3 PRO 70 HB2 PRO 70 27.686 -20.249 21.643 537 HG2 PRO 70 HG3 PRO 70 28.906 -17.944 22.321 538 HG3 PRO 70 HG2 PRO 70 28.461 -18.326 20.647 539 HD2 PRO 70 HD3 PRO 70 27.089 -16.532 22.611 540 HD3 PRO 70 HD2 PRO 70 27.358 -16.300 20.871 541 H SER 71 H SER 71 23.489 -19.945 21.579 542 HA SER 71 HA SER 71 22.849 -19.742 24.368 543 HB2 SER 71 HB3 SER 71 20.765 -21.044 23.549 544 HB3 SER 71 HB2 SER 71 21.008 -19.409 22.933 545 HG SER 71 HG SER 71 21.602 -21.859 21.630 546 H ARG 72 H ARG 72 23.916 -21.086 25.694 547 HA ARG 72 HA ARG 72 24.941 -23.579 24.711 548 HB2 ARG 72 HB3 ARG 72 26.095 -23.737 26.839 549 HB3 ARG 72 HB2 ARG 72 26.292 -22.130 26.163 550 HG2 ARG 72 HG3 ARG 72 24.294 -21.498 27.674 551 HG3 ARG 72 HG2 ARG 72 24.679 -22.995 28.524 552 HD2 ARG 72 HD3 ARG 72 26.404 -20.564 28.148 553 HD3 ARG 72 HD2 ARG 72 25.846 -21.285 29.656 554 HE ARG 72 HE ARG 72 27.335 -23.260 28.579 555 HH11 ARG 72 HH11 ARG 72 27.956 -19.875 29.184 556 HH12 ARG 72 HH12 ARG 72 29.674 -20.070 29.308 557 HH21 ARG 72 HH21 ARG 72 29.586 -23.545 28.751 558 HH22 ARG 72 HH22 ARG 72 30.611 -22.167 29.049 559 H CYS 73 H CYS 73 24.097 -25.505 24.900 560 HA CYS 73 HA CYS 73 21.567 -25.831 26.251 561 HB2 CYS 73 HB3 CYS 73 21.978 -26.840 24.026 562 HB3 CYS 73 HB2 CYS 73 23.243 -27.841 24.725 563 H VAL 74 H VAL 74 21.816 -25.828 28.400 564 HA VAL 74 HA VAL 74 22.688 -28.123 29.737 565 HB VAL 74 HB VAL 74 24.952 -27.208 29.184 566 HG11 VAL 74 HG11 VAL 74 24.080 -24.912 30.928 567 HG12 VAL 74 HG12 VAL 74 24.507 -24.848 29.218 568 HG13 VAL 74 HG13 VAL 74 25.742 -25.217 30.422 569 HG21 VAL 74 HG21 VAL 74 24.665 -28.649 31.117 570 HG22 VAL 74 HG22 VAL 74 24.263 -27.255 32.119 571 HG23 VAL 74 HG23 VAL 74 25.882 -27.415 31.442 572 H ARG 75 H ARG 75 22.225 -27.983 31.999 573 HA ARG 75 HA ARG 75 21.263 -25.505 33.098 574 HB2 ARG 75 HB3 ARG 75 18.997 -26.568 33.654 575 HB3 ARG 75 HB2 ARG 75 19.240 -25.998 32.010 576 HG2 ARG 75 HG3 ARG 75 19.575 -28.219 31.209 577 HG3 ARG 75 HG2 ARG 75 19.608 -28.861 32.852 578 HD2 ARG 75 HD3 ARG 75 17.248 -27.581 31.480 579 HD3 ARG 75 HD2 ARG 75 17.464 -29.303 31.791 580 HE ARG 75 HE ARG 75 16.869 -27.220 33.771 581 HH11 ARG 75 HH11 ARG 75 17.457 -30.605 33.046 582 HH12 ARG 75 HH12 ARG 75 16.778 -31.167 34.545 583 HH21 ARG 75 HH21 ARG 75 15.970 -27.968 35.722 584 HH22 ARG 75 HH22 ARG 75 15.907 -29.674 36.052 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 10.945 -4.092 -6.940 2 H2 GLY 1 HT2 GLY 1 11.391 -3.705 -5.350 3 H3 GLY 1 HT3 GLY 1 10.501 -2.597 -6.275 4 HA2 GLY 1 HA2 GLY 1 8.615 -4.098 -6.320 5 HA3 GLY 1 HA3 GLY 1 9.537 -5.248 -5.356 6 HA PRO 2 HA PRO 2 7.106 -2.232 -2.599 7 HB2 PRO 2 HB3 PRO 2 5.991 -4.776 -1.588 8 HB3 PRO 2 HB2 PRO 2 5.165 -3.265 -1.977 9 HG2 PRO 2 HG3 PRO 2 4.924 -5.425 -3.540 10 HG3 PRO 2 HG2 PRO 2 4.976 -3.788 -4.218 11 HD2 PRO 2 HD3 PRO 2 7.127 -5.865 -4.107 12 HD3 PRO 2 HD2 PRO 2 6.721 -4.729 -5.412 13 H THR 3 H THR 3 7.895 -1.802 -0.568 14 HA THR 3 HA THR 3 10.112 -3.401 0.322 15 HB THR 3 HB THR 3 10.273 -1.739 2.170 16 HG1 THR 3 HG1 THR 3 7.910 -1.309 2.090 17 HG21 THR 3 HG21 THR 3 11.455 -1.340 0.083 18 HG22 THR 3 HG22 THR 3 10.853 0.184 0.738 19 HG23 THR 3 HG23 THR 3 10.020 -0.589 -0.611 20 H SER 4 H SER 4 9.484 -5.339 1.078 21 HA SER 4 HA SER 4 7.415 -5.446 3.147 22 HB2 SER 4 HB3 SER 4 8.795 -7.735 1.724 23 HB3 SER 4 HB2 SER 4 7.354 -7.831 2.735 24 HG SER 4 HG SER 4 6.199 -7.320 1.063 25 H GLU 5 H GLU 5 8.108 -5.274 5.169 26 HA GLU 5 HA GLU 5 10.797 -5.779 5.975 27 HB2 GLU 5 HB3 GLU 5 8.669 -5.912 8.035 28 HB3 GLU 5 HB2 GLU 5 10.182 -5.024 8.043 29 HG2 GLU 5 HG3 GLU 5 8.600 -3.349 8.019 30 HG3 GLU 5 HG2 GLU 5 9.032 -3.491 6.315 31 H GLY 6 H GLY 6 11.615 -7.793 5.902 32 HA2 GLY 6 HA3 GLY 6 10.241 -9.932 7.274 33 HA3 GLY 6 HA2 GLY 6 10.356 -10.138 5.535 34 H CYS 7 H CYS 7 11.673 -11.080 8.288 35 HA CYS 7 HA CYS 7 14.447 -11.135 7.409 36 HB2 CYS 7 HB3 CYS 7 13.135 -12.373 9.843 37 HB3 CYS 7 HB2 CYS 7 14.866 -12.275 9.545 38 H GLN 8 H GLN 8 15.574 -13.135 7.044 39 HA GLN 8 HA GLN 8 13.940 -15.033 5.611 40 HB2 GLN 8 HB3 GLN 8 16.130 -16.099 5.058 41 HB3 GLN 8 HB2 GLN 8 16.012 -14.412 4.580 42 HG2 GLN 8 HG3 GLN 8 17.445 -13.707 6.277 43 HG3 GLN 8 HG2 GLN 8 17.270 -15.212 7.175 44 HE21 GLN 8 HE21 GLN 8 17.629 -16.926 4.865 45 HE22 GLN 8 HE22 GLN 8 19.306 -16.852 4.451 46 H ILE 9 H ILE 9 14.933 -17.435 5.859 47 HA ILE 9 HA ILE 9 14.168 -18.232 8.546 48 HB ILE 9 HB ILE 9 14.752 -19.799 6.035 49 HG12 ILE 9 HG13 ILE 9 12.222 -19.383 7.635 50 HG13 ILE 9 HG12 ILE 9 12.588 -18.680 6.061 51 HG21 ILE 9 HG21 ILE 9 14.074 -21.817 7.251 52 HG22 ILE 9 HG22 ILE 9 14.014 -20.885 8.747 53 HG23 ILE 9 HG23 ILE 9 15.549 -21.106 7.909 54 HD11 ILE 9 HD11 ILE 9 11.066 -20.600 5.912 55 HD12 ILE 9 HD12 ILE 9 12.316 -21.627 6.614 56 HD13 ILE 9 HD13 ILE 9 12.578 -20.869 5.044 57 H ILE 10 H ILE 10 15.620 -18.526 10.096 58 HA ILE 10 HA ILE 10 18.428 -18.740 9.600 59 HB ILE 10 HB ILE 10 16.936 -19.337 12.164 60 HG12 ILE 10 HG13 ILE 10 18.212 -16.747 11.248 61 HG13 ILE 10 HG12 ILE 10 16.480 -17.052 11.345 62 HG21 ILE 10 HG21 ILE 10 19.100 -18.865 13.237 63 HG22 ILE 10 HG22 ILE 10 19.836 -18.681 11.645 64 HG23 ILE 10 HG23 ILE 10 19.186 -20.243 12.140 65 HD11 ILE 10 HD11 ILE 10 18.386 -17.075 13.673 66 HD12 ILE 10 HD12 ILE 10 16.640 -17.314 13.750 67 HD13 ILE 10 HD13 ILE 10 17.296 -15.757 13.245 68 H HIS 11 H HIS 11 19.323 -20.533 8.822 69 HA HIS 11 HA HIS 11 18.034 -23.083 9.020 70 HB2 HIS 11 HB3 HIS 11 20.646 -22.155 7.853 71 HB3 HIS 11 HB2 HIS 11 20.266 -23.870 7.978 72 HD1 HIS 11 HD1 HIS 11 18.977 -24.842 6.093 73 HD2 HIS 11 HD2 HIS 11 18.661 -20.694 6.231 74 HE1 HIS 11 HE1 HIS 11 17.671 -24.188 4.036 75 HE2 HIS 11 HE2 HIS 11 17.336 -21.698 4.245 76 HA PRO 12 HA PRO 12 19.344 -24.231 13.055 77 HB2 PRO 12 HB3 PRO 12 19.572 -26.976 12.464 78 HB3 PRO 12 HB2 PRO 12 18.143 -26.154 13.096 79 HG2 PRO 12 HG3 PRO 12 18.806 -26.924 10.300 80 HG3 PRO 12 HG2 PRO 12 17.230 -26.862 11.108 81 HD2 PRO 12 HD3 PRO 12 17.958 -24.985 9.349 82 HD3 PRO 12 HD2 PRO 12 17.027 -24.568 10.804 83 HA PRO 13 HA PRO 13 23.734 -24.357 12.203 84 HB2 PRO 13 HB3 PRO 13 24.128 -23.690 14.993 85 HB3 PRO 13 HB2 PRO 13 24.386 -22.679 13.572 86 HG2 PRO 13 HG3 PRO 13 22.409 -22.238 15.407 87 HG3 PRO 13 HG2 PRO 13 22.311 -21.729 13.710 88 HD2 PRO 13 HD3 PRO 13 21.087 -24.110 15.057 89 HD3 PRO 13 HD2 PRO 13 20.402 -23.037 13.816 90 H TRP 14 H TRP 14 23.497 -25.114 15.613 91 HA TRP 14 HA TRP 14 24.857 -27.645 15.078 92 HB2 TRP 14 HB3 TRP 14 25.776 -25.770 16.659 93 HB3 TRP 14 HB2 TRP 14 24.613 -26.417 17.812 94 HD1 TRP 14 HD1 TRP 14 25.488 -28.342 19.278 95 HE1 TRP 14 HE1 TRP 14 27.464 -29.998 19.161 96 HE3 TRP 14 HE3 TRP 14 27.345 -27.060 14.686 97 HZ2 TRP 14 HZ2 TRP 14 29.533 -30.655 17.355 98 HZ3 TRP 14 HZ3 TRP 14 29.322 -28.250 13.839 99 HH2 TRP 14 HH2 TRP 14 30.391 -30.009 15.148 100 H GLU 15 H GLU 15 24.370 -29.205 17.093 101 HA GLU 15 HA GLU 15 21.933 -30.389 16.755 102 HB2 GLU 15 HB3 GLU 15 23.880 -30.411 19.030 103 HB3 GLU 15 HB2 GLU 15 22.353 -31.271 19.175 104 HG2 GLU 15 HG3 GLU 15 24.391 -31.696 17.005 105 HG3 GLU 15 HG2 GLU 15 24.174 -32.722 18.425 106 H GLY 16 H GLY 16 20.085 -29.326 16.826 107 HA2 GLY 16 HA3 GLY 16 18.701 -28.798 19.141 108 HA3 GLY 16 HA2 GLY 16 19.462 -27.272 18.702 109 H GLY 17 H GLY 17 17.299 -26.436 18.409 110 HA2 GLY 17 HA3 GLY 17 16.532 -26.644 15.633 111 HA3 GLY 17 HA2 GLY 17 15.319 -27.261 16.748 112 H ILE 18 H ILE 18 14.141 -25.419 15.619 113 HA ILE 18 HA ILE 18 14.559 -23.002 17.229 114 HB ILE 18 HB ILE 18 14.107 -23.144 14.267 115 HG12 ILE 18 HG13 ILE 18 15.984 -21.635 16.086 116 HG13 ILE 18 HG12 ILE 18 16.392 -23.019 15.076 117 HG21 ILE 18 HG21 ILE 18 13.561 -20.752 16.029 118 HG22 ILE 18 HG22 ILE 18 12.359 -21.668 15.120 119 HG23 ILE 18 HG23 ILE 18 13.595 -20.743 14.266 120 HD11 ILE 18 HD11 ILE 18 15.977 -21.701 13.073 121 HD12 ILE 18 HD12 ILE 18 17.188 -20.934 14.099 122 HD13 ILE 18 HD13 ILE 18 15.537 -20.313 14.067 123 H ARG 19 H ARG 19 12.918 -22.260 18.227 124 HA ARG 19 HA ARG 19 10.341 -23.602 17.980 125 HB2 ARG 19 HB3 ARG 19 11.638 -23.270 20.149 126 HB3 ARG 19 HB2 ARG 19 11.251 -21.565 20.009 127 HG2 ARG 19 HG3 ARG 19 9.725 -22.643 21.529 128 HG3 ARG 19 HG2 ARG 19 8.868 -22.092 20.089 129 HD2 ARG 19 HD3 ARG 19 8.509 -24.224 19.318 130 HD3 ARG 19 HD2 ARG 19 9.911 -24.880 20.165 131 HE ARG 19 HE ARG 19 8.573 -24.550 22.252 132 HH11 ARG 19 HH11 ARG 19 6.957 -24.901 19.160 133 HH12 ARG 19 HH12 ARG 19 5.535 -25.639 19.843 134 HH21 ARG 19 HH21 ARG 19 6.721 -25.493 23.151 135 HH22 ARG 19 HH22 ARG 19 5.396 -25.973 22.138 136 H TYR 20 H TYR 20 8.541 -22.561 17.209 137 HA TYR 20 HA TYR 20 8.952 -19.781 16.350 138 HB2 TYR 20 HB3 TYR 20 7.139 -21.935 15.257 139 HB3 TYR 20 HB2 TYR 20 7.098 -20.255 14.725 140 HD1 TYR 20 HD1 TYR 20 8.896 -23.416 14.546 141 HD2 TYR 20 HD2 TYR 20 9.014 -19.294 13.511 142 HE1 TYR 20 HE1 TYR 20 10.702 -23.875 12.941 143 HE2 TYR 20 HE2 TYR 20 10.813 -19.742 11.898 144 HH TYR 20 HH TYR 20 12.600 -21.480 11.572 145 H ARG 21 H ARG 21 6.373 -18.999 15.888 146 HA ARG 21 HA ARG 21 5.354 -18.904 18.657 147 HB2 ARG 21 HB3 ARG 21 6.402 -16.819 17.372 148 HB3 ARG 21 HB2 ARG 21 4.779 -16.724 16.703 149 HG2 ARG 21 HG3 ARG 21 3.877 -16.613 19.002 150 HG3 ARG 21 HG2 ARG 21 5.532 -16.604 19.620 151 HD2 ARG 21 HD3 ARG 21 5.916 -14.583 18.136 152 HD3 ARG 21 HD2 ARG 21 4.169 -14.531 17.918 153 HE ARG 21 HE ARG 21 5.611 -14.087 20.451 154 HH11 ARG 21 HH11 ARG 21 2.655 -13.899 18.555 155 HH12 ARG 21 HH12 ARG 21 1.880 -12.816 19.673 156 HH21 ARG 21 HH21 ARG 21 4.592 -12.646 21.873 157 HH22 ARG 21 HH22 ARG 21 2.969 -12.107 21.547 158 H GLY 22 H GLY 22 4.370 -18.571 15.243 159 HA2 GLY 22 HA3 GLY 22 1.803 -19.830 15.952 160 HA3 GLY 22 HA2 GLY 22 1.816 -18.321 15.053 161 H LEU 23 H LEU 23 4.199 -20.832 14.540 162 HA LEU 23 HA LEU 23 2.976 -21.341 11.911 163 HB2 LEU 23 HB3 LEU 23 5.852 -21.535 12.800 164 HB3 LEU 23 HB2 LEU 23 5.275 -22.160 11.266 165 HG LEU 23 HG LEU 23 5.189 -19.265 12.124 166 HD11 LEU 23 HD11 LEU 23 7.451 -20.053 11.660 167 HD12 LEU 23 HD12 LEU 23 6.893 -18.935 10.417 168 HD13 LEU 23 HD13 LEU 23 6.919 -20.668 10.094 169 HD21 LEU 23 HD21 LEU 23 3.328 -19.883 10.643 170 HD22 LEU 23 HD22 LEU 23 4.484 -20.528 9.477 171 HD23 LEU 23 HD23 LEU 23 4.477 -18.805 9.851 172 H THR 24 H THR 24 2.252 -23.313 11.475 173 HA THR 24 HA THR 24 2.435 -25.372 13.476 174 HB THR 24 HB THR 24 0.352 -24.932 12.138 175 HG1 THR 24 HG1 THR 24 0.346 -26.892 13.101 176 HG21 THR 24 HG21 THR 24 0.206 -25.872 9.870 177 HG22 THR 24 HG22 THR 24 1.932 -26.230 9.912 178 HG23 THR 24 HG23 THR 24 1.378 -24.558 9.953 179 H ARG 25 H ARG 25 2.716 -27.712 12.351 180 HA ARG 25 HA ARG 25 5.498 -27.837 11.707 181 HB2 ARG 25 HB3 ARG 25 5.154 -30.259 11.655 182 HB3 ARG 25 HB2 ARG 25 4.400 -29.554 13.078 183 HG2 ARG 25 HG3 ARG 25 2.221 -29.643 11.940 184 HG3 ARG 25 HG2 ARG 25 2.998 -30.406 10.551 185 HD2 ARG 25 HD3 ARG 25 3.772 -32.215 12.102 186 HD3 ARG 25 HD2 ARG 25 2.756 -31.492 13.350 187 HE ARG 25 HE ARG 25 1.176 -31.923 11.075 188 HH11 ARG 25 HH11 ARG 25 2.873 -33.719 13.547 189 HH12 ARG 25 HH12 ARG 25 1.849 -35.116 13.420 190 HH21 ARG 25 HH21 ARG 25 -0.186 -33.773 10.896 191 HH22 ARG 25 HH22 ARG 25 0.113 -35.151 11.920 192 H ASP 26 H ASP 26 5.864 -29.737 9.890 193 HA ASP 26 HA ASP 26 6.098 -30.184 7.686 194 HB2 ASP 26 HB3 ASP 26 3.653 -30.509 7.653 195 HB3 ASP 26 HB2 ASP 26 3.440 -28.793 7.312 196 H GLN 27 H GLN 27 4.904 -26.915 8.273 197 HA GLN 27 HA GLN 27 6.100 -25.726 6.003 198 HB2 GLN 27 HB3 GLN 27 5.141 -24.565 8.618 199 HB3 GLN 27 HB2 GLN 27 5.717 -23.586 7.277 200 HG2 GLN 27 HG3 GLN 27 3.943 -24.557 5.857 201 HG3 GLN 27 HG2 GLN 27 3.334 -25.420 7.267 202 HE21 GLN 27 HE21 GLN 27 3.907 -23.240 9.094 203 HE22 GLN 27 HE22 GLN 27 2.713 -22.020 8.790 204 H VAL 28 H VAL 28 7.349 -23.510 7.050 205 HA VAL 28 HA VAL 28 9.376 -22.658 7.439 206 HB VAL 28 HB VAL 28 10.496 -23.100 9.411 207 HG11 VAL 28 HG11 VAL 28 7.676 -24.041 9.872 208 HG12 VAL 28 HG12 VAL 28 8.245 -22.372 9.854 209 HG13 VAL 28 HG13 VAL 28 8.782 -23.474 11.124 210 HG21 VAL 28 HG21 VAL 28 11.101 -25.426 9.062 211 HG22 VAL 28 HG22 VAL 28 9.447 -25.927 9.422 212 HG23 VAL 28 HG23 VAL 28 10.438 -25.190 10.681 213 H LYS 29 H LYS 29 8.958 -25.125 5.637 214 HA LYS 29 HA LYS 29 11.729 -25.981 5.369 215 HB2 LYS 29 HB3 LYS 29 10.973 -27.598 3.804 216 HB3 LYS 29 HB2 LYS 29 9.778 -27.586 5.093 217 HG2 LYS 29 HG3 LYS 29 8.250 -26.321 3.737 218 HG3 LYS 29 HG2 LYS 29 9.470 -26.123 2.478 219 HD2 LYS 29 HD3 LYS 29 8.145 -27.858 1.671 220 HD3 LYS 29 HD2 LYS 29 9.513 -28.694 2.404 221 HE2 LYS 29 HE3 LYS 29 7.590 -29.872 3.098 222 HE3 LYS 29 HE2 LYS 29 8.088 -28.906 4.488 223 HZ1 LYS 29 HZ1 LYS 29 5.678 -28.826 4.099 224 HZ2 LYS 29 HZ2 LYS 29 5.951 -28.145 2.566 225 HZ3 LYS 29 HZ3 LYS 29 6.391 -27.297 3.961 226 H ALA 30 H ALA 30 9.383 -23.857 3.946 227 HA ALA 30 HA ALA 30 11.453 -22.572 2.388 228 HB1 ALA 30 HB1 ALA 30 9.028 -23.732 1.024 229 HB2 ALA 30 HB2 ALA 30 10.683 -24.317 0.863 230 HB3 ALA 30 HB3 ALA 30 10.257 -22.713 0.268 231 H ILE 31 H ILE 31 11.033 -20.822 3.755 232 HA ILE 31 HA ILE 31 8.586 -19.337 3.064 233 HB ILE 31 HB ILE 31 10.019 -19.190 5.729 234 HG12 ILE 31 HG13 ILE 31 7.335 -20.430 5.070 235 HG13 ILE 31 HG12 ILE 31 8.799 -21.328 5.450 236 HG21 ILE 31 HG21 ILE 31 8.995 -17.086 5.085 237 HG22 ILE 31 HG22 ILE 31 8.104 -17.816 6.420 238 HG23 ILE 31 HG23 ILE 31 7.462 -17.903 4.780 239 HD11 ILE 31 HD11 ILE 31 7.329 -21.228 7.366 240 HD12 ILE 31 HD12 ILE 31 7.329 -19.466 7.298 241 HD13 ILE 31 HD13 ILE 31 8.815 -20.334 7.688 242 H ASN 32 H ASN 32 8.929 -17.288 2.365 243 HA ASN 32 HA ASN 32 11.639 -16.602 1.697 244 HB2 ASN 32 HB3 ASN 32 9.002 -15.227 1.176 245 HB3 ASN 32 HB2 ASN 32 10.545 -14.545 0.674 246 HD21 ASN 32 HD21 ASN 32 9.993 -14.656 -1.500 247 HD22 ASN 32 HD22 ASN 32 9.937 -16.159 -2.359 248 H PHE 33 H PHE 33 9.088 -14.978 3.592 249 HA PHE 33 HA PHE 33 11.207 -13.631 5.112 250 HB2 PHE 33 HB3 PHE 33 8.767 -12.239 4.009 251 HB3 PHE 33 HB2 PHE 33 10.024 -11.503 4.988 252 HD1 PHE 33 HD1 PHE 33 8.873 -12.136 1.711 253 HD2 PHE 33 HD2 PHE 33 12.419 -11.551 3.993 254 HE1 PHE 33 HE1 PHE 33 10.088 -11.527 -0.338 255 HE2 PHE 33 HE2 PHE 33 13.637 -10.937 1.947 256 HZ PHE 33 HZ PHE 33 12.470 -10.924 -0.225 257 H LEU 34 H LEU 34 10.765 -13.274 7.232 258 HA LEU 34 HA LEU 34 8.126 -14.077 8.253 259 HB2 LEU 34 HB3 LEU 34 10.818 -13.763 9.580 260 HB3 LEU 34 HB2 LEU 34 9.338 -13.867 10.510 261 HG LEU 34 HG LEU 34 10.326 -16.026 10.512 262 HD11 LEU 34 HD11 LEU 34 8.628 -17.400 9.393 263 HD12 LEU 34 HD12 LEU 34 8.059 -15.970 8.531 264 HD13 LEU 34 HD13 LEU 34 7.925 -16.053 10.289 265 HD21 LEU 34 HD21 LEU 34 10.438 -15.873 7.501 266 HD22 LEU 34 HD22 LEU 34 10.891 -17.262 8.490 267 HD23 LEU 34 HD23 LEU 34 11.817 -15.766 8.596 268 HA PRO 35 HA PRO 35 6.916 -9.855 8.637 269 HB2 PRO 35 HB3 PRO 35 5.363 -10.044 10.913 270 HB3 PRO 35 HB2 PRO 35 4.824 -10.462 9.284 271 HG2 PRO 35 HG3 PRO 35 5.827 -12.245 11.469 272 HG3 PRO 35 HG2 PRO 35 4.482 -12.499 10.341 273 HD2 PRO 35 HD3 PRO 35 6.843 -13.707 9.980 274 HD3 PRO 35 HD2 PRO 35 5.895 -13.110 8.601 275 H VAL 36 H VAL 36 7.071 -7.964 9.985 276 HA VAL 36 HA VAL 36 9.521 -7.907 11.447 277 HB VAL 36 HB VAL 36 8.632 -6.050 9.994 278 HG11 VAL 36 HG11 VAL 36 6.880 -5.508 12.379 279 HG12 VAL 36 HG12 VAL 36 6.352 -5.960 10.758 280 HG13 VAL 36 HG13 VAL 36 7.136 -4.402 11.028 281 HG21 VAL 36 HG21 VAL 36 10.536 -5.688 11.436 282 HG22 VAL 36 HG22 VAL 36 9.471 -5.331 12.797 283 HG23 VAL 36 HG23 VAL 36 9.518 -4.247 11.405 284 H ASP 37 H ASP 37 6.594 -8.973 12.425 285 HA ASP 37 HA ASP 37 7.437 -8.628 15.206 286 HB2 ASP 37 HB3 ASP 37 5.516 -7.167 14.993 287 HB3 ASP 37 HB2 ASP 37 4.580 -8.448 14.229 288 H TYR 38 H TYR 38 8.375 -10.609 15.225 289 HA TYR 38 HA TYR 38 6.577 -12.813 15.645 290 HB2 TYR 38 HB3 TYR 38 7.157 -12.744 13.122 291 HB3 TYR 38 HB2 TYR 38 8.771 -13.240 13.622 292 HD1 TYR 38 HD1 TYR 38 9.127 -15.458 14.639 293 HD2 TYR 38 HD2 TYR 38 5.313 -14.255 13.202 294 HE1 TYR 38 HE1 TYR 38 8.364 -17.792 14.725 295 HE2 TYR 38 HE2 TYR 38 4.538 -16.584 13.279 296 HH TYR 38 HH TYR 38 5.556 -18.865 13.219 297 H GLU 39 H GLU 39 7.405 -14.177 17.144 298 HA GLU 39 HA GLU 39 10.161 -13.636 18.027 299 HB2 GLU 39 HB3 GLU 39 7.886 -14.689 19.712 300 HB3 GLU 39 HB2 GLU 39 9.472 -14.177 20.274 301 HG2 GLU 39 HG3 GLU 39 8.956 -11.879 19.587 302 HG3 GLU 39 HG2 GLU 39 7.358 -12.408 19.062 303 H ILE 40 H ILE 40 11.567 -15.278 17.998 304 HA ILE 40 HA ILE 40 10.491 -18.021 17.942 305 HB ILE 40 HB ILE 40 12.480 -18.728 16.671 306 HG12 ILE 40 HG13 ILE 40 13.026 -15.773 16.339 307 HG13 ILE 40 HG12 ILE 40 13.957 -16.852 17.373 308 HG21 ILE 40 HG21 ILE 40 11.798 -17.825 14.507 309 HG22 ILE 40 HG22 ILE 40 10.874 -16.563 15.324 310 HG23 ILE 40 HG23 ILE 40 10.404 -18.255 15.498 311 HD11 ILE 40 HD11 ILE 40 14.602 -18.157 15.402 312 HD12 ILE 40 HD12 ILE 40 15.106 -16.471 15.283 313 HD13 ILE 40 HD13 ILE 40 13.699 -17.039 14.379 314 H GLU 41 H GLU 41 11.897 -19.660 18.844 315 HA GLU 41 HA GLU 41 13.657 -18.628 20.969 316 HB2 GLU 41 HB3 GLU 41 11.547 -19.198 21.996 317 HB3 GLU 41 HB2 GLU 41 11.516 -20.755 21.185 318 HG2 GLU 41 HG3 GLU 41 13.440 -21.483 22.496 319 HG3 GLU 41 HG2 GLU 41 13.494 -19.911 23.292 320 H TYR 42 H TYR 42 15.292 -20.104 21.693 321 HA TYR 42 HA TYR 42 16.136 -21.954 19.588 322 HB2 TYR 42 HB3 TYR 42 17.681 -20.603 21.804 323 HB3 TYR 42 HB2 TYR 42 18.370 -21.832 20.751 324 HD1 TYR 42 HD1 TYR 42 19.218 -21.271 18.640 325 HD2 TYR 42 HD2 TYR 42 16.833 -18.454 20.754 326 HE1 TYR 42 HE1 TYR 42 19.807 -19.546 16.987 327 HE2 TYR 42 HE2 TYR 42 17.414 -16.721 19.114 328 HH TYR 42 HH TYR 42 18.960 -17.439 16.145 329 H VAL 43 H VAL 43 15.308 -23.921 19.975 330 HA VAL 43 HA VAL 43 15.470 -24.958 22.724 331 HB VAL 43 HB VAL 43 13.751 -26.615 22.045 332 HG11 VAL 43 HG11 VAL 43 12.990 -23.720 21.684 333 HG12 VAL 43 HG12 VAL 43 13.084 -24.602 23.209 334 HG13 VAL 43 HG13 VAL 43 11.864 -25.037 22.011 335 HG21 VAL 43 HG21 VAL 43 12.477 -26.237 19.974 336 HG22 VAL 43 HG22 VAL 43 14.159 -26.654 19.646 337 HG23 VAL 43 HG23 VAL 43 13.623 -24.979 19.509 338 H CYS 44 H CYS 44 15.831 -27.325 22.893 339 HA CYS 44 HA CYS 44 17.769 -28.221 20.869 340 HB2 CYS 44 HB3 CYS 44 17.568 -28.910 23.810 341 HB3 CYS 44 HB2 CYS 44 18.693 -29.668 22.689 342 H ARG 45 H ARG 45 17.964 -30.790 21.070 343 HA ARG 45 HA ARG 45 15.406 -31.804 20.240 344 HB2 ARG 45 HB3 ARG 45 18.050 -33.220 20.639 345 HB3 ARG 45 HB2 ARG 45 16.629 -33.924 19.878 346 HG2 ARG 45 HG3 ARG 45 18.100 -31.497 18.875 347 HG3 ARG 45 HG2 ARG 45 18.291 -33.137 18.248 348 HD2 ARG 45 HD3 ARG 45 16.106 -33.179 17.396 349 HD3 ARG 45 HD2 ARG 45 15.608 -31.794 18.365 350 HE ARG 45 HE ARG 45 17.330 -30.569 16.876 351 HH11 ARG 45 HH11 ARG 45 15.294 -33.212 15.816 352 HH12 ARG 45 HH12 ARG 45 15.148 -32.619 14.191 353 HH21 ARG 45 HH21 ARG 45 17.135 -29.775 14.767 354 HH22 ARG 45 HH22 ARG 45 16.183 -30.643 13.592 355 H GLY 46 H GLY 46 13.942 -32.059 21.792 356 HA2 GLY 46 HA3 GLY 46 12.961 -33.393 23.486 357 HA3 GLY 46 HA2 GLY 46 14.575 -33.851 24.024 358 H GLU 47 H GLU 47 13.553 -33.272 26.161 359 HA GLU 47 HA GLU 47 13.227 -30.447 26.627 360 HB2 GLU 47 HB3 GLU 47 12.997 -31.225 29.054 361 HB3 GLU 47 HB2 GLU 47 11.748 -31.697 27.913 362 HG2 GLU 47 HG3 GLU 47 12.675 -33.912 27.749 363 HG3 GLU 47 HG2 GLU 47 14.043 -33.450 28.761 364 H ARG 48 H ARG 48 15.361 -29.883 25.903 365 HA ARG 48 HA ARG 48 17.262 -30.010 28.147 366 HB2 ARG 48 HB3 ARG 48 18.166 -29.795 25.277 367 HB3 ARG 48 HB2 ARG 48 19.120 -30.211 26.695 368 HG2 ARG 48 HG3 ARG 48 17.437 -32.249 26.772 369 HG3 ARG 48 HG2 ARG 48 17.318 -31.894 25.051 370 HD2 ARG 48 HD3 ARG 48 19.806 -32.556 26.613 371 HD3 ARG 48 HD2 ARG 48 19.006 -33.563 25.410 372 HE ARG 48 HE ARG 48 20.514 -31.088 24.850 373 HH11 ARG 48 HH11 ARG 48 19.003 -34.038 23.746 374 HH12 ARG 48 HH12 ARG 48 19.861 -34.080 22.240 375 HH21 ARG 48 HH21 ARG 48 21.683 -31.132 22.874 376 HH22 ARG 48 HH22 ARG 48 21.383 -32.416 21.737 377 H GLU 49 H GLU 49 17.609 -28.061 28.954 378 HA GLU 49 HA GLU 49 16.483 -25.786 27.559 379 HB2 GLU 49 HB3 GLU 49 17.602 -25.991 30.363 380 HB3 GLU 49 HB2 GLU 49 16.680 -24.642 29.710 381 HG2 GLU 49 HG3 GLU 49 14.732 -26.077 29.449 382 HG3 GLU 49 HG2 GLU 49 15.650 -27.450 30.061 383 H VAL 50 H VAL 50 17.581 -23.794 27.327 384 HA VAL 50 HA VAL 50 20.514 -24.049 27.235 385 HB VAL 50 HB VAL 50 20.512 -22.434 25.362 386 HG11 VAL 50 HG11 VAL 50 20.634 -24.773 24.827 387 HG12 VAL 50 HG12 VAL 50 19.634 -23.955 23.627 388 HG13 VAL 50 HG13 VAL 50 18.879 -24.920 24.897 389 HG21 VAL 50 HG21 VAL 50 17.512 -22.754 25.448 390 HG22 VAL 50 HG22 VAL 50 18.415 -21.966 24.154 391 HG23 VAL 50 HG23 VAL 50 18.424 -21.281 25.779 392 H VAL 51 H VAL 51 21.627 -22.553 28.408 393 HA VAL 51 HA VAL 51 20.054 -20.354 29.520 394 HB VAL 51 HB VAL 51 21.283 -21.521 31.200 395 HG11 VAL 51 HG11 VAL 51 23.762 -21.042 29.559 396 HG12 VAL 51 HG12 VAL 51 22.960 -22.592 29.821 397 HG13 VAL 51 HG13 VAL 51 23.718 -21.751 31.175 398 HG21 VAL 51 HG21 VAL 51 22.704 -19.747 32.130 399 HG22 VAL 51 HG22 VAL 51 21.180 -19.119 31.506 400 HG23 VAL 51 HG23 VAL 51 22.665 -18.913 30.577 401 H GLY 52 H GLY 52 19.840 -19.000 27.885 402 HA2 GLY 52 HA3 GLY 52 22.081 -17.262 27.338 403 HA3 GLY 52 HA2 GLY 52 21.427 -18.085 25.924 404 HA PRO 53 HA PRO 53 18.586 -14.461 26.726 405 HB2 PRO 53 HB3 PRO 53 19.512 -12.733 24.855 406 HB3 PRO 53 HB2 PRO 53 20.039 -12.684 26.539 407 HG2 PRO 53 HG3 PRO 53 21.429 -13.802 24.151 408 HG3 PRO 53 HG2 PRO 53 22.103 -12.935 25.542 409 HD2 PRO 53 HD3 PRO 53 22.189 -15.668 25.224 410 HD3 PRO 53 HD2 PRO 53 22.273 -14.840 26.790 411 H LYS 54 H LYS 54 17.458 -16.337 25.783 412 HA LYS 54 HA LYS 54 17.623 -16.641 22.900 413 HB2 LYS 54 HB3 LYS 54 16.017 -18.538 23.270 414 HB3 LYS 54 HB2 LYS 54 17.563 -18.708 24.082 415 HG2 LYS 54 HG3 LYS 54 16.624 -18.253 26.191 416 HG3 LYS 54 HG2 LYS 54 15.132 -17.635 25.480 417 HD2 LYS 54 HD3 LYS 54 14.626 -19.890 24.636 418 HD3 LYS 54 HD2 LYS 54 16.096 -20.494 25.403 419 HE2 LYS 54 HE3 LYS 54 15.257 -19.986 27.578 420 HE3 LYS 54 HE2 LYS 54 13.878 -19.119 26.903 421 HZ1 LYS 54 HZ1 LYS 54 12.974 -21.137 26.076 422 HZ2 LYS 54 HZ2 LYS 54 13.370 -21.398 27.707 423 HZ3 LYS 54 HZ3 LYS 54 14.369 -22.014 26.483 424 H VAL 55 H VAL 55 16.744 -14.713 22.207 425 HA VAL 55 HA VAL 55 13.904 -14.858 21.841 426 HB VAL 55 HB VAL 55 13.899 -13.664 23.952 427 HG11 VAL 55 HG11 VAL 55 15.002 -11.496 24.227 428 HG12 VAL 55 HG12 VAL 55 15.745 -11.674 22.637 429 HG13 VAL 55 HG13 VAL 55 16.166 -12.788 23.938 430 HG21 VAL 55 HG21 VAL 55 12.766 -11.585 23.266 431 HG22 VAL 55 HG22 VAL 55 12.232 -12.985 22.336 432 HG23 VAL 55 HG23 VAL 55 13.354 -11.829 21.621 433 H ARG 56 H ARG 56 13.455 -14.225 19.851 434 HA ARG 56 HA ARG 56 15.185 -12.246 18.551 435 HB2 ARG 56 HB3 ARG 56 14.246 -14.791 17.213 436 HB3 ARG 56 HB2 ARG 56 15.243 -13.536 16.496 437 HG2 ARG 56 HG3 ARG 56 16.056 -15.313 18.783 438 HG3 ARG 56 HG2 ARG 56 16.527 -15.525 17.096 439 HD2 ARG 56 HD3 ARG 56 17.568 -13.267 17.175 440 HD3 ARG 56 HD2 ARG 56 17.210 -13.214 18.902 441 HE ARG 56 HE ARG 56 18.870 -15.362 17.759 442 HH11 ARG 56 HH11 ARG 56 18.344 -12.819 20.124 443 HH12 ARG 56 HH12 ARG 56 19.875 -13.057 20.902 444 HH21 ARG 56 HH21 ARG 56 20.860 -15.689 18.796 445 HH22 ARG 56 HH22 ARG 56 21.328 -14.674 20.124 446 H LYS 57 H LYS 57 13.951 -10.654 17.791 447 HA LYS 57 HA LYS 57 11.418 -11.442 16.521 448 HB2 LYS 57 HB3 LYS 57 10.921 -10.096 18.525 449 HB3 LYS 57 HB2 LYS 57 11.967 -8.812 17.930 450 HG2 LYS 57 HG3 LYS 57 10.513 -8.390 16.077 451 HG3 LYS 57 HG2 LYS 57 9.532 -9.803 16.459 452 HD2 LYS 57 HD3 LYS 57 9.845 -7.393 18.248 453 HD3 LYS 57 HD2 LYS 57 8.493 -7.654 17.144 454 HE2 LYS 57 HE3 LYS 57 8.180 -9.883 18.381 455 HE3 LYS 57 HE2 LYS 57 9.234 -9.191 19.612 456 HZ1 LYS 57 HZ1 LYS 57 6.580 -8.219 18.727 457 HZ2 LYS 57 HZ2 LYS 57 7.638 -7.256 19.639 458 HZ3 LYS 57 HZ3 LYS 57 7.050 -8.711 20.286 459 H CYS 58 H CYS 58 11.123 -10.731 14.473 460 HA CYS 58 HA CYS 58 13.396 -9.901 13.005 461 HB2 CYS 58 HB3 CYS 58 11.603 -11.281 12.029 462 HB3 CYS 58 HB2 CYS 58 10.487 -9.929 12.170 463 H LEU 59 H LEU 59 13.885 -7.943 12.066 464 HA LEU 59 HA LEU 59 12.384 -5.638 13.104 465 HB2 LEU 59 HB3 LEU 59 15.356 -5.915 12.671 466 HB3 LEU 59 HB2 LEU 59 14.552 -4.418 13.098 467 HG LEU 59 HG LEU 59 14.647 -6.908 14.804 468 HD11 LEU 59 HD11 LEU 59 16.802 -5.813 14.676 469 HD12 LEU 59 HD12 LEU 59 16.080 -5.557 16.265 470 HD13 LEU 59 HD13 LEU 59 16.061 -4.262 15.066 471 HD21 LEU 59 HD21 LEU 59 12.582 -5.623 15.117 472 HD22 LEU 59 HD22 LEU 59 13.536 -4.170 15.412 473 HD23 LEU 59 HD23 LEU 59 13.629 -5.530 16.532 474 H ALA 60 H ALA 60 13.314 -3.589 11.747 475 HA ALA 60 HA ALA 60 12.303 -4.053 9.101 476 HB1 ALA 60 HB1 ALA 60 12.626 -1.651 8.784 477 HB2 ALA 60 HB2 ALA 60 13.498 -1.565 10.314 478 HB3 ALA 60 HB3 ALA 60 11.787 -1.996 10.297 479 H ASN 61 H ASN 61 15.279 -4.485 10.480 480 HA ASN 61 HA ASN 61 16.713 -4.094 7.957 481 HB2 ASN 61 HB3 ASN 61 18.752 -4.666 9.324 482 HB3 ASN 61 HB2 ASN 61 17.924 -3.200 9.833 483 HD21 ASN 61 HD21 ASN 61 18.841 -6.409 10.686 484 HD22 ASN 61 HD22 ASN 61 18.287 -6.360 12.324 485 H GLY 62 H GLY 62 18.219 -5.932 7.337 486 HA2 GLY 62 HA3 GLY 62 16.534 -8.253 7.056 487 HA3 GLY 62 HA2 GLY 62 18.103 -8.006 6.308 488 H SER 63 H SER 63 17.103 -8.122 9.714 489 HA SER 63 HA SER 63 18.180 -10.708 10.171 490 HB2 SER 63 HB3 SER 63 20.309 -9.385 10.005 491 HB3 SER 63 HB2 SER 63 19.762 -8.412 11.371 492 HG SER 63 HG SER 63 21.127 -10.100 12.070 493 H TRP 64 H TRP 64 18.263 -11.079 12.646 494 HA TRP 64 HA TRP 64 15.734 -10.066 13.646 495 HB2 TRP 64 HB3 TRP 64 17.558 -12.236 14.716 496 HB3 TRP 64 HB2 TRP 64 15.963 -11.842 15.353 497 HD1 TRP 64 HD1 TRP 64 17.572 -13.200 12.098 498 HE1 TRP 64 HE1 TRP 64 15.839 -14.685 10.903 499 HE3 TRP 64 HE3 TRP 64 13.576 -12.450 15.202 500 HZ2 TRP 64 HZ2 TRP 64 13.146 -15.439 11.234 501 HZ3 TRP 64 HZ3 TRP 64 11.459 -13.593 14.692 502 HH2 TRP 64 HH2 TRP 64 11.248 -15.056 12.750 503 H THR 65 H THR 65 15.846 -9.917 16.249 504 HA THR 65 HA THR 65 16.765 -7.392 16.735 505 HB THR 65 HB THR 65 16.650 -8.126 19.231 506 HG1 THR 65 HG1 THR 65 16.057 -10.138 19.601 507 HG21 THR 65 HG21 THR 65 14.906 -6.852 18.085 508 HG22 THR 65 HG22 THR 65 14.197 -8.070 19.145 509 HG23 THR 65 HG23 THR 65 14.253 -8.342 17.403 510 H ASP 66 H ASP 66 18.421 -10.380 17.790 511 HA ASP 66 HA ASP 66 20.957 -8.948 17.709 512 HB2 ASP 66 HB3 ASP 66 20.047 -8.703 20.055 513 HB3 ASP 66 HB2 ASP 66 20.121 -10.449 20.203 514 H MET 67 H MET 67 20.816 -10.599 15.810 515 HA MET 67 HA MET 67 21.116 -13.339 16.731 516 HB2 MET 67 HB3 MET 67 19.750 -12.870 14.742 517 HB3 MET 67 HB2 MET 67 21.165 -12.228 13.921 518 HG2 MET 67 HG3 MET 67 22.220 -14.390 13.954 519 HG3 MET 67 HG2 MET 67 20.892 -15.060 14.898 520 HE1 MET 67 HE1 MET 67 22.069 -13.677 11.458 521 HE2 MET 67 HE2 MET 67 20.747 -12.566 11.808 522 HE3 MET 67 HE3 MET 67 20.597 -13.725 10.488 523 H ASP 68 H ASP 68 23.066 -12.710 17.905 524 HA ASP 68 HA ASP 68 25.060 -14.260 16.641 525 HB2 ASP 68 HB3 ASP 68 25.802 -12.072 15.739 526 HB3 ASP 68 HB2 ASP 68 25.888 -11.437 17.379 527 H THR 69 H THR 69 24.727 -15.635 18.390 528 HA THR 69 HA THR 69 25.597 -14.675 20.990 529 HB THR 69 HB THR 69 22.860 -15.895 20.892 530 HG1 THR 69 HG1 THR 69 23.355 -13.087 20.743 531 HG21 THR 69 HG21 THR 69 24.213 -13.964 22.772 532 HG22 THR 69 HG22 THR 69 23.931 -15.683 23.061 533 HG23 THR 69 HG23 THR 69 22.567 -14.568 22.945 534 HA PRO 70 HA PRO 70 26.688 -19.026 21.039 535 HB2 PRO 70 HB3 PRO 70 28.179 -18.964 23.275 536 HB3 PRO 70 HB2 PRO 70 28.762 -18.309 21.740 537 HG2 PRO 70 HG3 PRO 70 27.651 -16.876 24.114 538 HG3 PRO 70 HG2 PRO 70 29.003 -16.425 23.060 539 HD2 PRO 70 HD3 PRO 70 26.462 -15.380 22.865 540 HD3 PRO 70 HD2 PRO 70 27.630 -15.433 21.530 541 H SER 71 H SER 71 24.608 -19.846 21.445 542 HA SER 71 HA SER 71 23.632 -19.844 24.187 543 HB2 SER 71 HB3 SER 71 21.668 -21.071 23.083 544 HB3 SER 71 HB2 SER 71 21.918 -19.387 22.622 545 HG SER 71 HG SER 71 22.652 -21.713 21.173 546 H ARG 72 H ARG 72 24.300 -21.371 25.517 547 HA ARG 72 HA ARG 72 25.293 -23.900 24.454 548 HB2 ARG 72 HB3 ARG 72 26.155 -24.254 26.764 549 HB3 ARG 72 HB2 ARG 72 26.774 -22.799 26.000 550 HG2 ARG 72 HG3 ARG 72 25.186 -21.448 27.264 551 HG3 ARG 72 HG2 ARG 72 24.541 -22.907 28.016 552 HD2 ARG 72 HD3 ARG 72 26.088 -21.803 29.518 553 HD3 ARG 72 HD2 ARG 72 26.745 -23.357 29.002 554 HE ARG 72 HE ARG 72 28.177 -22.093 27.444 555 HH11 ARG 72 HH11 ARG 72 26.787 -20.428 30.206 556 HH12 ARG 72 HH12 ARG 72 27.976 -19.158 30.196 557 HH21 ARG 72 HH21 ARG 72 29.756 -20.422 27.456 558 HH22 ARG 72 HH22 ARG 72 29.650 -19.160 28.646 559 H CYS 73 H CYS 73 24.223 -25.744 24.591 560 HA CYS 73 HA CYS 73 21.624 -25.783 25.918 561 HB2 CYS 73 HB3 CYS 73 22.014 -26.646 23.566 562 HB3 CYS 73 HB2 CYS 73 22.927 -27.968 24.282 563 H VAL 74 H VAL 74 21.504 -26.393 27.982 564 HA VAL 74 HA VAL 74 23.327 -28.479 28.950 565 HB VAL 74 HB VAL 74 22.884 -25.854 30.386 566 HG11 VAL 74 HG11 VAL 74 23.101 -27.719 31.926 567 HG12 VAL 74 HG12 VAL 74 24.541 -26.701 31.984 568 HG13 VAL 74 HG13 VAL 74 24.580 -28.236 31.118 569 HG21 VAL 74 HG21 VAL 74 25.285 -25.474 30.018 570 HG22 VAL 74 HG22 VAL 74 24.384 -25.553 28.505 571 HG23 VAL 74 HG23 VAL 74 25.350 -26.932 29.027 572 H ARG 75 H ARG 75 22.040 -30.034 29.687 573 HA ARG 75 HA ARG 75 19.620 -29.274 31.170 574 HB2 ARG 75 HB3 ARG 75 19.248 -30.898 29.365 575 HB3 ARG 75 HB2 ARG 75 20.439 -31.977 30.079 576 HG2 ARG 75 HG3 ARG 75 18.227 -32.750 30.621 577 HG3 ARG 75 HG2 ARG 75 19.018 -32.168 32.090 578 HD2 ARG 75 HD3 ARG 75 17.836 -29.937 31.586 579 HD3 ARG 75 HD2 ARG 75 16.832 -30.882 30.486 580 HE ARG 75 HE ARG 75 16.926 -31.119 33.409 581 HH11 ARG 75 HH11 ARG 75 15.485 -32.059 30.354 582 HH12 ARG 75 HH12 ARG 75 14.103 -32.812 31.100 583 HH21 ARG 75 HH21 ARG 75 15.113 -32.055 34.375 584 HH22 ARG 75 HH22 ARG 75 13.890 -32.794 33.386 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 4.463 2.627 -0.460 2 H2 GLY 1 HT2 GLY 1 3.024 2.495 -1.345 3 H3 GLY 1 HT3 GLY 1 4.159 3.687 -1.752 4 HA2 GLY 1 HA2 GLY 1 4.227 1.824 -3.309 5 HA3 GLY 1 HA3 GLY 1 5.741 2.020 -2.434 6 HA PRO 2 HA PRO 2 4.007 -2.315 -1.771 7 HB2 PRO 2 HB3 PRO 2 5.859 -3.410 -3.694 8 HB3 PRO 2 HB2 PRO 2 4.096 -3.468 -3.713 9 HG2 PRO 2 HG3 PRO 2 5.607 -2.046 -5.505 10 HG3 PRO 2 HG2 PRO 2 3.930 -1.654 -5.086 11 HD2 PRO 2 HD3 PRO 2 6.472 -0.404 -4.117 12 HD3 PRO 2 HD2 PRO 2 4.919 0.361 -4.521 13 H THR 3 H THR 3 4.936 -2.792 0.135 14 HA THR 3 HA THR 3 7.729 -3.640 0.140 15 HB THR 3 HB THR 3 7.940 -2.466 2.453 16 HG1 THR 3 HG1 THR 3 6.262 -1.279 2.936 17 HG21 THR 3 HG21 THR 3 8.867 -0.455 1.400 18 HG22 THR 3 HG22 THR 3 8.051 -0.872 -0.107 19 HG23 THR 3 HG23 THR 3 9.325 -1.916 0.524 20 H SER 4 H SER 4 8.253 -5.064 1.863 21 HA SER 4 HA SER 4 6.151 -5.868 3.690 22 HB2 SER 4 HB3 SER 4 7.445 -7.862 1.805 23 HB3 SER 4 HB2 SER 4 6.277 -8.235 3.073 24 HG SER 4 HG SER 4 5.095 -6.418 1.677 25 H GLU 5 H GLU 5 7.257 -5.518 5.508 26 HA GLU 5 HA GLU 5 10.085 -5.971 5.709 27 HB2 GLU 5 HB3 GLU 5 8.075 -5.360 7.891 28 HB3 GLU 5 HB2 GLU 5 9.821 -5.320 8.068 29 HG2 GLU 5 HG3 GLU 5 9.159 -3.087 7.856 30 HG3 GLU 5 HG2 GLU 5 9.835 -3.524 6.290 31 H GLY 6 H GLY 6 10.772 -8.017 5.680 32 HA2 GLY 6 HA3 GLY 6 9.738 -9.834 7.710 33 HA3 GLY 6 HA2 GLY 6 9.586 -10.351 6.038 34 H CYS 7 H CYS 7 11.161 -11.321 8.396 35 HA CYS 7 HA CYS 7 13.900 -11.064 7.429 36 HB2 CYS 7 HB3 CYS 7 12.782 -12.550 9.820 37 HB3 CYS 7 HB2 CYS 7 14.490 -12.319 9.461 38 H GLN 8 H GLN 8 15.177 -12.921 6.882 39 HA GLN 8 HA GLN 8 13.606 -14.885 5.447 40 HB2 GLN 8 HB3 GLN 8 15.950 -15.585 4.619 41 HB3 GLN 8 HB2 GLN 8 15.299 -14.042 4.095 42 HG2 GLN 8 HG3 GLN 8 17.500 -13.555 4.617 43 HG3 GLN 8 HG2 GLN 8 16.616 -13.033 6.044 44 HE21 GLN 8 HE21 GLN 8 17.397 -16.374 5.228 45 HE22 GLN 8 HE22 GLN 8 18.480 -16.622 6.555 46 H ILE 9 H ILE 9 15.023 -17.138 5.367 47 HA ILE 9 HA ILE 9 14.342 -18.212 7.985 48 HB ILE 9 HB ILE 9 15.110 -19.733 5.487 49 HG12 ILE 9 HG13 ILE 9 12.344 -19.009 6.481 50 HG13 ILE 9 HG12 ILE 9 13.142 -18.277 5.093 51 HG21 ILE 9 HG21 ILE 9 13.911 -21.589 6.550 52 HG22 ILE 9 HG22 ILE 9 13.623 -20.585 7.971 53 HG23 ILE 9 HG23 ILE 9 15.270 -21.041 7.534 54 HD11 ILE 9 HD11 ILE 9 12.396 -21.181 5.354 55 HD12 ILE 9 HD12 ILE 9 13.144 -20.420 3.948 56 HD13 ILE 9 HD13 ILE 9 11.511 -19.965 4.436 57 H ILE 10 H ILE 10 15.885 -18.335 9.456 58 HA ILE 10 HA ILE 10 18.677 -18.347 8.884 59 HB ILE 10 HB ILE 10 17.358 -19.108 11.499 60 HG12 ILE 10 HG13 ILE 10 18.183 -16.356 10.536 61 HG13 ILE 10 HG12 ILE 10 16.522 -16.918 10.711 62 HG21 ILE 10 HG21 ILE 10 19.740 -19.633 11.365 63 HG22 ILE 10 HG22 ILE 10 19.453 -18.315 12.501 64 HG23 ILE 10 HG23 ILE 10 20.091 -17.970 10.893 65 HD11 ILE 10 HD11 ILE 10 16.869 -17.179 13.118 66 HD12 ILE 10 HD12 ILE 10 17.173 -15.523 12.588 67 HD13 ILE 10 HD13 ILE 10 18.525 -16.601 12.935 68 H HIS 11 H HIS 11 20.166 -20.028 9.062 69 HA HIS 11 HA HIS 11 19.070 -22.704 8.721 70 HB2 HIS 11 HB3 HIS 11 21.896 -21.639 8.539 71 HB3 HIS 11 HB2 HIS 11 21.469 -23.329 8.301 72 HD1 HIS 11 HD1 HIS 11 20.626 -24.008 6.024 73 HD2 HIS 11 HD2 HIS 11 20.891 -19.881 6.497 74 HE1 HIS 11 HE1 HIS 11 20.233 -23.028 3.736 75 HE2 HIS 11 HE2 HIS 11 20.585 -20.548 4.015 76 HA PRO 12 HA PRO 12 19.881 -23.914 12.939 77 HB2 PRO 12 HB3 PRO 12 19.999 -26.671 11.957 78 HB3 PRO 12 HB2 PRO 12 18.813 -25.920 13.025 79 HG2 PRO 12 HG3 PRO 12 18.210 -26.652 10.504 80 HG3 PRO 12 HG2 PRO 12 17.475 -25.234 11.278 81 HD2 PRO 12 HD3 PRO 12 19.741 -25.361 9.313 82 HD3 PRO 12 HD2 PRO 12 18.364 -24.237 9.370 83 HA PRO 13 HA PRO 13 24.287 -24.598 12.486 84 HB2 PRO 13 HB3 PRO 13 24.993 -23.412 14.810 85 HB3 PRO 13 HB2 PRO 13 24.507 -22.496 13.381 86 HG2 PRO 13 HG3 PRO 13 23.061 -22.927 15.904 87 HG3 PRO 13 HG2 PRO 13 22.834 -21.666 14.682 88 HD2 PRO 13 HD3 PRO 13 21.321 -24.094 15.069 89 HD3 PRO 13 HD2 PRO 13 21.039 -22.797 13.892 90 H TRP 14 H TRP 14 24.210 -24.584 15.921 91 HA TRP 14 HA TRP 14 25.059 -27.363 16.009 92 HB2 TRP 14 HB3 TRP 14 26.009 -25.200 17.317 93 HB3 TRP 14 HB2 TRP 14 24.841 -25.764 18.506 94 HD1 TRP 14 HD1 TRP 14 25.303 -28.210 19.604 95 HE1 TRP 14 HE1 TRP 14 27.485 -29.556 19.886 96 HE3 TRP 14 HE3 TRP 14 28.229 -25.708 16.238 97 HZ2 TRP 14 HZ2 TRP 14 30.095 -29.547 18.813 98 HZ3 TRP 14 HZ3 TRP 14 30.556 -26.445 15.926 99 HH2 TRP 14 HH2 TRP 14 31.468 -28.325 17.189 100 H GLU 15 H GLU 15 24.183 -28.335 18.332 101 HA GLU 15 HA GLU 15 21.556 -29.107 17.854 102 HB2 GLU 15 HB3 GLU 15 23.140 -29.216 20.420 103 HB3 GLU 15 HB2 GLU 15 21.609 -30.043 20.161 104 HG2 GLU 15 HG3 GLU 15 24.149 -30.502 18.614 105 HG3 GLU 15 HG2 GLU 15 23.491 -31.552 19.868 106 H GLY 16 H GLY 16 22.708 -26.248 19.427 107 HA2 GLY 16 HA3 GLY 16 20.253 -25.517 20.669 108 HA3 GLY 16 HA2 GLY 16 21.517 -24.407 20.143 109 H GLY 17 H GLY 17 18.536 -25.950 19.322 110 HA2 GLY 17 HA3 GLY 17 18.622 -25.014 16.563 111 HA3 GLY 17 HA2 GLY 17 17.415 -26.079 17.263 112 H ILE 18 H ILE 18 16.014 -24.595 15.990 113 HA ILE 18 HA ILE 18 15.541 -22.092 17.445 114 HB ILE 18 HB ILE 18 15.429 -22.662 14.508 115 HG12 ILE 18 HG13 ILE 18 16.636 -20.523 16.256 116 HG13 ILE 18 HG12 ILE 18 17.499 -21.839 15.468 117 HG21 ILE 18 HG21 ILE 18 14.305 -20.513 14.152 118 HG22 ILE 18 HG22 ILE 18 14.098 -20.326 15.894 119 HG23 ILE 18 HG23 ILE 18 13.271 -21.632 15.044 120 HD11 ILE 18 HD11 ILE 18 16.927 -20.902 13.278 121 HD12 ILE 18 HD12 ILE 18 17.854 -19.773 14.267 122 HD13 ILE 18 HD13 ILE 18 16.113 -19.558 14.080 123 H ARG 19 H ARG 19 13.622 -21.559 18.081 124 HA ARG 19 HA ARG 19 11.420 -23.483 17.707 125 HB2 ARG 19 HB3 ARG 19 12.509 -23.322 19.977 126 HB3 ARG 19 HB2 ARG 19 11.961 -21.659 20.054 127 HG2 ARG 19 HG3 ARG 19 10.432 -22.980 21.302 128 HG3 ARG 19 HG2 ARG 19 9.620 -22.464 19.825 129 HD2 ARG 19 HD3 ARG 19 10.139 -24.667 18.823 130 HD3 ARG 19 HD2 ARG 19 10.838 -25.170 20.362 131 HE ARG 19 HE ARG 19 8.106 -24.206 20.497 132 HH11 ARG 19 HH11 ARG 19 10.212 -27.003 20.202 133 HH12 ARG 19 HH12 ARG 19 8.979 -28.133 20.673 134 HH21 ARG 19 HH21 ARG 19 6.508 -25.688 21.149 135 HH22 ARG 19 HH22 ARG 19 6.873 -27.384 21.226 136 H TYR 20 H TYR 20 9.345 -22.570 17.324 137 HA TYR 20 HA TYR 20 9.403 -19.691 16.699 138 HB2 TYR 20 HB3 TYR 20 7.500 -21.799 15.640 139 HB3 TYR 20 HB2 TYR 20 7.591 -20.118 15.123 140 HD1 TYR 20 HD1 TYR 20 8.936 -23.440 14.722 141 HD2 TYR 20 HD2 TYR 20 9.646 -19.326 13.902 142 HE1 TYR 20 HE1 TYR 20 10.589 -24.071 13.014 143 HE2 TYR 20 HE2 TYR 20 11.301 -19.946 12.190 144 HH TYR 20 HH TYR 20 12.767 -21.872 11.648 145 H ARG 21 H ARG 21 6.749 -19.048 16.678 146 HA ARG 21 HA ARG 21 6.104 -19.392 19.517 147 HB2 ARG 21 HB3 ARG 21 5.061 -17.366 17.529 148 HB3 ARG 21 HB2 ARG 21 4.605 -17.442 19.226 149 HG2 ARG 21 HG3 ARG 21 7.141 -17.225 19.673 150 HG3 ARG 21 HG2 ARG 21 7.215 -16.651 18.008 151 HD2 ARG 21 HD3 ARG 21 5.507 -15.477 20.200 152 HD3 ARG 21 HD2 ARG 21 7.035 -14.816 19.630 153 HE ARG 21 HE ARG 21 4.884 -15.114 17.672 154 HH11 ARG 21 HH11 ARG 21 6.760 -13.040 19.781 155 HH12 ARG 21 HH12 ARG 21 6.252 -11.564 19.010 156 HH21 ARG 21 HH21 ARG 21 4.202 -13.157 16.643 157 HH22 ARG 21 HH22 ARG 21 4.787 -11.638 17.248 158 H GLY 22 H GLY 22 4.693 -19.762 16.312 159 HA2 GLY 22 HA3 GLY 22 2.916 -21.792 17.345 160 HA3 GLY 22 HA2 GLY 22 2.097 -20.340 16.791 161 H LEU 23 H LEU 23 4.834 -22.258 15.564 162 HA LEU 23 HA LEU 23 3.399 -22.411 13.001 163 HB2 LEU 23 HB3 LEU 23 6.375 -22.262 13.494 164 HB3 LEU 23 HB2 LEU 23 5.645 -22.573 11.928 165 HG LEU 23 HG LEU 23 5.300 -20.050 13.554 166 HD11 LEU 23 HD11 LEU 23 6.622 -18.994 11.799 167 HD12 LEU 23 HD12 LEU 23 6.852 -20.560 11.022 168 HD13 LEU 23 HD13 LEU 23 7.537 -20.258 12.619 169 HD21 LEU 23 HD21 LEU 23 3.314 -20.564 12.239 170 HD22 LEU 23 HD22 LEU 23 4.306 -20.749 10.793 171 HD23 LEU 23 HD23 LEU 23 4.169 -19.172 11.571 172 H THR 24 H THR 24 2.672 -24.345 12.610 173 HA THR 24 HA THR 24 3.722 -26.670 13.956 174 HB THR 24 HB THR 24 1.277 -26.321 13.548 175 HG1 THR 24 HG1 THR 24 1.349 -28.407 13.855 176 HG21 THR 24 HG21 THR 24 1.998 -26.940 10.681 177 HG22 THR 24 HG22 THR 24 1.405 -25.395 11.294 178 HG23 THR 24 HG23 THR 24 0.361 -26.816 11.330 179 H ARG 25 H ARG 25 3.717 -28.726 12.278 180 HA ARG 25 HA ARG 25 6.208 -28.418 10.944 181 HB2 ARG 25 HB3 ARG 25 4.196 -30.672 10.942 182 HB3 ARG 25 HB2 ARG 25 5.765 -30.772 10.158 183 HG2 ARG 25 HG3 ARG 25 5.312 -30.297 13.096 184 HG3 ARG 25 HG2 ARG 25 5.742 -31.844 12.361 185 HD2 ARG 25 HD3 ARG 25 7.797 -30.739 11.457 186 HD3 ARG 25 HD2 ARG 25 7.379 -29.316 12.410 187 HE ARG 25 HE ARG 25 7.479 -31.697 13.996 188 HH11 ARG 25 HH11 ARG 25 9.403 -29.146 12.565 189 HH12 ARG 25 HH12 ARG 25 10.741 -29.354 13.657 190 HH21 ARG 25 HH21 ARG 25 9.245 -31.983 15.438 191 HH22 ARG 25 HH22 ARG 25 10.643 -30.958 15.287 192 H ASP 26 H ASP 26 6.174 -29.744 8.647 193 HA ASP 26 HA ASP 26 5.952 -29.513 6.411 194 HB2 ASP 26 HB3 ASP 26 3.651 -30.156 6.603 195 HB3 ASP 26 HB2 ASP 26 3.186 -28.540 7.131 196 H GLN 27 H GLN 27 5.073 -26.708 8.297 197 HA GLN 27 HA GLN 27 5.575 -24.835 6.169 198 HB2 GLN 27 HB3 GLN 27 5.169 -24.441 9.139 199 HB3 GLN 27 HB2 GLN 27 5.231 -23.145 7.951 200 HG2 GLN 27 HG3 GLN 27 3.229 -23.924 6.898 201 HG3 GLN 27 HG2 GLN 27 3.210 -25.375 7.897 202 HE21 GLN 27 HE21 GLN 27 3.961 -23.977 10.322 203 HE22 GLN 27 HE22 GLN 27 2.565 -23.082 10.823 204 H VAL 28 H VAL 28 6.948 -22.849 7.395 205 HA VAL 28 HA VAL 28 9.002 -21.985 7.659 206 HB VAL 28 HB VAL 28 10.303 -22.692 9.504 207 HG11 VAL 28 HG11 VAL 28 7.382 -23.209 10.010 208 HG12 VAL 28 HG12 VAL 28 8.221 -21.660 10.085 209 HG13 VAL 28 HG13 VAL 28 8.587 -22.919 11.264 210 HG21 VAL 28 HG21 VAL 28 10.520 -25.073 9.042 211 HG22 VAL 28 HG22 VAL 28 8.826 -25.325 9.458 212 HG23 VAL 28 HG23 VAL 28 9.971 -24.807 10.697 213 H LYS 29 H LYS 29 8.666 -24.206 5.594 214 HA LYS 29 HA LYS 29 11.533 -24.753 5.229 215 HB2 LYS 29 HB3 LYS 29 10.941 -26.628 3.852 216 HB3 LYS 29 HB2 LYS 29 10.032 -26.749 5.351 217 HG2 LYS 29 HG3 LYS 29 8.076 -25.755 4.153 218 HG3 LYS 29 HG2 LYS 29 9.007 -25.864 2.659 219 HD2 LYS 29 HD3 LYS 29 9.230 -28.310 3.043 220 HD3 LYS 29 HD2 LYS 29 8.174 -28.148 4.447 221 HE2 LYS 29 HE3 LYS 29 6.486 -27.104 2.836 222 HE3 LYS 29 HE2 LYS 29 7.510 -27.730 1.545 223 HZ1 LYS 29 HZ1 LYS 29 7.249 -29.927 2.946 224 HZ2 LYS 29 HZ2 LYS 29 6.092 -29.469 1.798 225 HZ3 LYS 29 HZ3 LYS 29 5.808 -29.175 3.443 226 H ALA 30 H ALA 30 8.784 -23.107 3.982 227 HA ALA 30 HA ALA 30 10.431 -22.086 1.789 228 HB1 ALA 30 HB1 ALA 30 7.616 -23.077 1.408 229 HB2 ALA 30 HB2 ALA 30 9.075 -23.917 0.887 230 HB3 ALA 30 HB3 ALA 30 8.658 -22.360 0.177 231 H ILE 31 H ILE 31 9.071 -21.197 4.448 232 HA ILE 31 HA ILE 31 7.324 -19.071 3.645 233 HB ILE 31 HB ILE 31 8.825 -19.417 6.251 234 HG12 ILE 31 HG13 ILE 31 5.982 -20.132 5.491 235 HG13 ILE 31 HG12 ILE 31 7.285 -21.275 5.789 236 HG21 ILE 31 HG21 ILE 31 6.490 -17.628 5.569 237 HG22 ILE 31 HG22 ILE 31 8.147 -17.104 5.859 238 HG23 ILE 31 HG23 ILE 31 7.211 -17.824 7.167 239 HD11 ILE 31 HD11 ILE 31 5.778 -21.118 7.686 240 HD12 ILE 31 HD12 ILE 31 6.103 -19.389 7.813 241 HD13 ILE 31 HD13 ILE 31 7.394 -20.554 8.109 242 H ASN 32 H ASN 32 8.130 -17.545 2.344 243 HA ASN 32 HA ASN 32 10.840 -17.018 1.995 244 HB2 ASN 32 HB3 ASN 32 8.413 -15.392 1.248 245 HB3 ASN 32 HB2 ASN 32 10.050 -14.949 0.771 246 HD21 ASN 32 HD21 ASN 32 11.156 -16.223 -0.697 247 HD22 ASN 32 HD22 ASN 32 10.347 -17.379 -1.704 248 H PHE 33 H PHE 33 8.437 -15.098 3.789 249 HA PHE 33 HA PHE 33 10.681 -13.815 5.180 250 HB2 PHE 33 HB3 PHE 33 8.244 -12.380 4.112 251 HB3 PHE 33 HB2 PHE 33 9.498 -11.651 5.104 252 HD1 PHE 33 HD1 PHE 33 8.452 -12.522 1.794 253 HD2 PHE 33 HD2 PHE 33 11.836 -11.502 4.167 254 HE1 PHE 33 HE1 PHE 33 9.698 -11.941 -0.246 255 HE2 PHE 33 HE2 PHE 33 13.090 -10.920 2.130 256 HZ PHE 33 HZ PHE 33 12.023 -11.137 -0.076 257 H LEU 34 H LEU 34 10.495 -13.948 7.293 258 HA LEU 34 HA LEU 34 7.971 -14.617 8.542 259 HB2 LEU 34 HB3 LEU 34 10.743 -14.094 9.620 260 HB3 LEU 34 HB2 LEU 34 9.362 -14.303 10.676 261 HG LEU 34 HG LEU 34 10.550 -16.371 10.584 262 HD11 LEU 34 HD11 LEU 34 8.139 -16.555 10.651 263 HD12 LEU 34 HD12 LEU 34 8.835 -17.889 9.731 264 HD13 LEU 34 HD13 LEU 34 8.068 -16.542 8.889 265 HD21 LEU 34 HD21 LEU 34 10.285 -16.246 7.582 266 HD22 LEU 34 HD22 LEU 34 10.949 -17.594 8.505 267 HD23 LEU 34 HD23 LEU 34 11.773 -16.035 8.506 268 HA PRO 35 HA PRO 35 6.525 -10.450 8.684 269 HB2 PRO 35 HB3 PRO 35 5.046 -10.756 11.043 270 HB3 PRO 35 HB2 PRO 35 4.463 -11.048 9.402 271 HG2 PRO 35 HG3 PRO 35 5.484 -12.986 11.428 272 HG3 PRO 35 HG2 PRO 35 4.180 -13.181 10.241 273 HD2 PRO 35 HD3 PRO 35 6.564 -14.315 9.860 274 HD3 PRO 35 HD2 PRO 35 5.660 -13.611 8.502 275 H VAL 36 H VAL 36 7.003 -8.551 9.660 276 HA VAL 36 HA VAL 36 9.280 -8.420 11.282 277 HB VAL 36 HB VAL 36 8.600 -6.582 9.804 278 HG11 VAL 36 HG11 VAL 36 6.413 -6.079 11.812 279 HG12 VAL 36 HG12 VAL 36 6.198 -6.644 10.156 280 HG13 VAL 36 HG13 VAL 36 6.834 -5.026 10.458 281 HG21 VAL 36 HG21 VAL 36 10.155 -6.102 11.595 282 HG22 VAL 36 HG22 VAL 36 8.818 -5.779 12.698 283 HG23 VAL 36 HG23 VAL 36 9.098 -4.717 11.318 284 H ASP 37 H ASP 37 9.630 -8.028 13.401 285 HA ASP 37 HA ASP 37 9.313 -7.863 15.633 286 HB2 ASP 37 HB3 ASP 37 7.447 -6.299 15.188 287 HB3 ASP 37 HB2 ASP 37 6.345 -7.671 15.096 288 H TYR 38 H TYR 38 7.967 -10.297 13.692 289 HA TYR 38 HA TYR 38 7.052 -12.034 15.749 290 HB2 TYR 38 HB3 TYR 38 6.578 -12.320 13.273 291 HB3 TYR 38 HB2 TYR 38 8.233 -12.888 13.094 292 HD1 TYR 38 HD1 TYR 38 8.862 -15.114 13.806 293 HD2 TYR 38 HD2 TYR 38 4.935 -13.644 14.521 294 HE1 TYR 38 HE1 TYR 38 8.119 -17.390 14.381 295 HE2 TYR 38 HE2 TYR 38 4.184 -15.909 15.102 296 HH TYR 38 HH TYR 38 4.809 -18.210 14.706 297 H GLU 39 H GLU 39 8.210 -13.010 17.254 298 HA GLU 39 HA GLU 39 11.123 -13.046 16.930 299 HB2 GLU 39 HB3 GLU 39 9.478 -13.222 19.460 300 HB3 GLU 39 HB2 GLU 39 11.232 -13.137 19.370 301 HG2 GLU 39 HG3 GLU 39 11.096 -10.918 18.403 302 HG3 GLU 39 HG2 GLU 39 9.336 -11.006 18.431 303 H ILE 40 H ILE 40 12.308 -14.868 17.387 304 HA ILE 40 HA ILE 40 10.766 -17.353 17.722 305 HB ILE 40 HB ILE 40 12.582 -18.509 16.466 306 HG12 ILE 40 HG13 ILE 40 13.443 -15.679 15.835 307 HG13 ILE 40 HG12 ILE 40 14.351 -16.849 16.785 308 HG21 ILE 40 HG21 ILE 40 10.496 -17.955 15.374 309 HG22 ILE 40 HG22 ILE 40 11.837 -17.763 14.246 310 HG23 ILE 40 HG23 ILE 40 11.097 -16.343 14.986 311 HD11 ILE 40 HD11 ILE 40 13.681 -17.074 13.865 312 HD12 ILE 40 HD12 ILE 40 14.575 -18.264 14.809 313 HD13 ILE 40 HD13 ILE 40 15.248 -16.654 14.553 314 H GLU 41 H GLU 41 11.900 -19.079 18.787 315 HA GLU 41 HA GLU 41 13.556 -18.018 20.971 316 HB2 GLU 41 HB3 GLU 41 11.313 -18.843 21.576 317 HB3 GLU 41 HB2 GLU 41 11.699 -20.405 20.875 318 HG2 GLU 41 HG3 GLU 41 13.459 -20.704 22.556 319 HG3 GLU 41 HG2 GLU 41 13.014 -19.157 23.275 320 H TYR 42 H TYR 42 15.061 -19.672 21.947 321 HA TYR 42 HA TYR 42 16.159 -21.462 19.887 322 HB2 TYR 42 HB3 TYR 42 17.501 -19.494 21.652 323 HB3 TYR 42 HB2 TYR 42 18.326 -21.031 21.417 324 HD1 TYR 42 HD1 TYR 42 19.899 -21.062 19.752 325 HD2 TYR 42 HD2 TYR 42 16.505 -18.539 19.295 326 HE1 TYR 42 HE1 TYR 42 20.785 -20.270 17.601 327 HE2 TYR 42 HE2 TYR 42 17.379 -17.745 17.142 328 HH TYR 42 HH TYR 42 19.905 -19.240 15.491 329 H VAL 43 H VAL 43 15.411 -23.400 20.500 330 HA VAL 43 HA VAL 43 15.692 -24.190 23.315 331 HB VAL 43 HB VAL 43 14.244 -26.128 22.718 332 HG11 VAL 43 HG11 VAL 43 13.079 -23.406 22.148 333 HG12 VAL 43 HG12 VAL 43 13.291 -24.139 23.737 334 HG13 VAL 43 HG13 VAL 43 12.159 -24.846 22.584 335 HG21 VAL 43 HG21 VAL 43 12.986 -26.060 20.606 336 HG22 VAL 43 HG22 VAL 43 14.718 -26.249 20.335 337 HG23 VAL 43 HG23 VAL 43 13.951 -24.680 20.084 338 H CYS 44 H CYS 44 16.290 -26.546 23.609 339 HA CYS 44 HA CYS 44 18.666 -27.076 22.011 340 HB2 CYS 44 HB3 CYS 44 18.685 -27.139 24.533 341 HB3 CYS 44 HB2 CYS 44 17.644 -28.552 24.445 342 H ARG 45 H ARG 45 18.957 -28.865 20.779 343 HA ARG 45 HA ARG 45 16.736 -29.877 19.435 344 HB2 ARG 45 HB3 ARG 45 19.222 -29.718 18.732 345 HB3 ARG 45 HB2 ARG 45 19.399 -31.275 19.526 346 HG2 ARG 45 HG3 ARG 45 17.282 -30.896 17.471 347 HG3 ARG 45 HG2 ARG 45 18.955 -31.151 16.974 348 HD2 ARG 45 HD3 ARG 45 17.313 -32.976 18.728 349 HD3 ARG 45 HD2 ARG 45 17.747 -33.264 17.042 350 HE ARG 45 HE ARG 45 20.155 -32.930 18.246 351 HH11 ARG 45 HH11 ARG 45 17.413 -35.028 18.894 352 HH12 ARG 45 HH12 ARG 45 18.389 -36.254 19.661 353 HH21 ARG 45 HH21 ARG 45 21.414 -34.523 19.227 354 HH22 ARG 45 HH22 ARG 45 20.662 -35.964 19.850 355 H GLY 46 H GLY 46 15.282 -31.279 20.083 356 HA2 GLY 46 HA3 GLY 46 14.802 -33.566 20.809 357 HA3 GLY 46 HA2 GLY 46 16.065 -33.363 22.020 358 H GLU 47 H GLU 47 15.408 -32.873 23.995 359 HA GLU 47 HA GLU 47 13.175 -31.053 24.367 360 HB2 GLU 47 HB3 GLU 47 12.135 -32.616 26.068 361 HB3 GLU 47 HB2 GLU 47 11.928 -33.064 24.380 362 HG2 GLU 47 HG3 GLU 47 13.654 -34.733 24.566 363 HG3 GLU 47 HG2 GLU 47 14.017 -34.221 26.213 364 H ARG 48 H ARG 48 15.345 -30.001 24.927 365 HA ARG 48 HA ARG 48 15.816 -30.391 27.810 366 HB2 ARG 48 HB3 ARG 48 17.928 -29.484 25.849 367 HB3 ARG 48 HB2 ARG 48 18.148 -29.889 27.541 368 HG2 ARG 48 HG3 ARG 48 17.378 -31.849 25.393 369 HG3 ARG 48 HG2 ARG 48 19.012 -31.598 26.004 370 HD2 ARG 48 HD3 ARG 48 18.322 -32.306 28.220 371 HD3 ARG 48 HD2 ARG 48 16.656 -32.482 27.668 372 HE ARG 48 HE ARG 48 18.407 -34.041 26.083 373 HH11 ARG 48 HH11 ARG 48 16.904 -34.007 29.254 374 HH12 ARG 48 HH12 ARG 48 16.891 -35.733 29.395 375 HH21 ARG 48 HH21 ARG 48 18.379 -36.301 26.269 376 HH22 ARG 48 HH22 ARG 48 17.704 -37.037 27.695 377 H GLU 49 H GLU 49 15.725 -28.566 29.032 378 HA GLU 49 HA GLU 49 14.940 -26.104 27.765 379 HB2 GLU 49 HB3 GLU 49 15.438 -26.807 30.663 380 HB3 GLU 49 HB2 GLU 49 14.908 -25.220 30.118 381 HG2 GLU 49 HG3 GLU 49 12.905 -26.293 29.125 382 HG3 GLU 49 HG2 GLU 49 13.421 -27.820 29.839 383 H VAL 50 H VAL 50 16.052 -24.070 28.152 384 HA VAL 50 HA VAL 50 18.960 -24.377 28.466 385 HB VAL 50 HB VAL 50 19.345 -22.783 26.652 386 HG11 VAL 50 HG11 VAL 50 18.676 -24.186 24.739 387 HG12 VAL 50 HG12 VAL 50 17.649 -25.128 25.819 388 HG13 VAL 50 HG13 VAL 50 19.397 -25.111 26.055 389 HG21 VAL 50 HG21 VAL 50 17.547 -22.087 25.154 390 HG22 VAL 50 HG22 VAL 50 17.258 -21.523 26.800 391 HG23 VAL 50 HG23 VAL 50 16.368 -22.911 26.174 392 H VAL 51 H VAL 51 20.032 -22.615 29.402 393 HA VAL 51 HA VAL 51 18.314 -20.341 30.120 394 HB VAL 51 HB VAL 51 19.002 -21.429 32.153 395 HG11 VAL 51 HG11 VAL 51 21.851 -21.143 31.209 396 HG12 VAL 51 HG12 VAL 51 20.940 -22.650 31.318 397 HG13 VAL 51 HG13 VAL 51 21.336 -21.750 32.784 398 HG21 VAL 51 HG21 VAL 51 20.612 -18.923 31.702 399 HG22 VAL 51 HG22 VAL 51 20.211 -19.615 33.274 400 HG23 VAL 51 HG23 VAL 51 18.929 -19.013 32.223 401 H GLY 52 H GLY 52 18.633 -19.093 28.429 402 HA2 GLY 52 HA3 GLY 52 21.216 -17.829 28.101 403 HA3 GLY 52 HA2 GLY 52 20.652 -18.746 26.707 404 HA PRO 53 HA PRO 53 18.580 -14.534 26.595 405 HB2 PRO 53 HB3 PRO 53 20.058 -13.345 24.680 406 HB3 PRO 53 HB2 PRO 53 20.476 -13.224 26.393 407 HG2 PRO 53 HG3 PRO 53 21.645 -14.977 24.273 408 HG3 PRO 53 HG2 PRO 53 22.460 -14.101 25.582 409 HD2 PRO 53 HD3 PRO 53 21.864 -16.782 25.653 410 HD3 PRO 53 HD2 PRO 53 22.066 -15.768 27.099 411 H LYS 54 H LYS 54 17.521 -16.720 25.709 412 HA LYS 54 HA LYS 54 17.718 -17.215 22.909 413 HB2 LYS 54 HB3 LYS 54 15.714 -18.698 23.316 414 HB3 LYS 54 HB2 LYS 54 17.134 -19.068 24.284 415 HG2 LYS 54 HG3 LYS 54 16.169 -18.185 26.235 416 HG3 LYS 54 HG2 LYS 54 14.901 -17.356 25.331 417 HD2 LYS 54 HD3 LYS 54 14.006 -19.575 24.661 418 HD3 LYS 54 HD2 LYS 54 15.211 -20.335 25.701 419 HE2 LYS 54 HE3 LYS 54 14.248 -19.372 27.657 420 HE3 LYS 54 HE2 LYS 54 13.212 -18.316 26.699 421 HZ1 LYS 54 HZ1 LYS 54 13.017 -21.285 26.805 422 HZ2 LYS 54 HZ2 LYS 54 12.022 -20.255 25.895 423 HZ3 LYS 54 HZ3 LYS 54 11.975 -20.195 27.586 424 H VAL 55 H VAL 55 17.277 -15.232 21.912 425 HA VAL 55 HA VAL 55 14.504 -14.940 21.254 426 HB VAL 55 HB VAL 55 14.555 -13.563 23.271 427 HG11 VAL 55 HG11 VAL 55 15.889 -11.515 23.390 428 HG12 VAL 55 HG12 VAL 55 16.688 -11.950 21.878 429 HG13 VAL 55 HG13 VAL 55 16.903 -12.955 23.311 430 HG21 VAL 55 HG21 VAL 55 13.686 -11.474 22.314 431 HG22 VAL 55 HG22 VAL 55 13.065 -12.901 21.486 432 HG23 VAL 55 HG23 VAL 55 14.341 -11.938 20.741 433 H ARG 56 H ARG 56 14.353 -14.466 19.184 434 HA ARG 56 HA ARG 56 16.379 -12.698 17.979 435 HB2 ARG 56 HB3 ARG 56 14.911 -14.918 16.541 436 HB3 ARG 56 HB2 ARG 56 16.107 -13.840 15.847 437 HG2 ARG 56 HG3 ARG 56 16.658 -15.849 18.013 438 HG3 ARG 56 HG2 ARG 56 16.952 -16.104 16.294 439 HD2 ARG 56 HD3 ARG 56 18.428 -14.056 16.374 440 HD3 ARG 56 HD2 ARG 56 18.281 -14.127 18.131 441 HE ARG 56 HE ARG 56 19.309 -16.431 16.608 442 HH11 ARG 56 HH11 ARG 56 19.702 -14.028 19.127 443 HH12 ARG 56 HH12 ARG 56 21.190 -14.709 19.714 444 HH21 ARG 56 HH21 ARG 56 21.226 -17.345 17.405 445 HH22 ARG 56 HH22 ARG 56 22.037 -16.608 18.751 446 H LYS 57 H LYS 57 15.368 -10.800 17.671 447 HA LYS 57 HA LYS 57 12.489 -10.837 17.142 448 HB2 LYS 57 HB3 LYS 57 13.444 -9.400 18.982 449 HB3 LYS 57 HB2 LYS 57 14.254 -8.453 17.742 450 HG2 LYS 57 HG3 LYS 57 11.965 -8.041 16.751 451 HG3 LYS 57 HG2 LYS 57 11.307 -8.731 18.233 452 HD2 LYS 57 HD3 LYS 57 13.091 -6.306 18.021 453 HD3 LYS 57 HD2 LYS 57 11.368 -6.307 18.389 454 HE2 LYS 57 HE3 LYS 57 13.514 -7.585 20.084 455 HE3 LYS 57 HE2 LYS 57 12.778 -6.015 20.391 456 HZ1 LYS 57 HZ1 LYS 57 11.676 -7.549 21.761 457 HZ2 LYS 57 HZ2 LYS 57 11.499 -8.687 20.517 458 HZ3 LYS 57 HZ3 LYS 57 10.599 -7.247 20.484 459 H CYS 58 H CYS 58 11.791 -10.621 15.099 460 HA CYS 58 HA CYS 58 13.551 -9.991 12.956 461 HB2 CYS 58 HB3 CYS 58 11.535 -11.441 12.723 462 HB3 CYS 58 HB2 CYS 58 10.523 -10.019 12.945 463 H LEU 59 H LEU 59 14.062 -8.087 12.097 464 HA LEU 59 HA LEU 59 12.941 -5.711 13.374 465 HB2 LEU 59 HB3 LEU 59 15.438 -6.078 11.719 466 HB3 LEU 59 HB2 LEU 59 14.937 -4.571 12.466 467 HG LEU 59 HG LEU 59 15.652 -7.099 13.951 468 HD11 LEU 59 HD11 LEU 59 17.170 -4.513 13.633 469 HD12 LEU 59 HD12 LEU 59 17.598 -6.066 12.912 470 HD13 LEU 59 HD13 LEU 59 17.636 -5.867 14.664 471 HD21 LEU 59 HD21 LEU 59 15.008 -4.335 14.965 472 HD22 LEU 59 HD22 LEU 59 15.527 -5.705 15.945 473 HD23 LEU 59 HD23 LEU 59 13.976 -5.757 15.109 474 H ALA 60 H ALA 60 13.225 -3.714 11.745 475 HA ALA 60 HA ALA 60 11.246 -4.131 9.716 476 HB1 ALA 60 HB1 ALA 60 11.544 -1.753 9.224 477 HB2 ALA 60 HB2 ALA 60 12.959 -1.710 10.276 478 HB3 ALA 60 HB3 ALA 60 11.365 -2.035 10.954 479 H ASN 61 H ASN 61 14.650 -4.350 9.820 480 HA ASN 61 HA ASN 61 14.825 -4.326 6.891 481 HB2 ASN 61 HB3 ASN 61 17.249 -4.318 7.174 482 HB3 ASN 61 HB2 ASN 61 16.534 -3.007 8.100 483 HD21 ASN 61 HD21 ASN 61 18.390 -5.888 8.202 484 HD22 ASN 61 HD22 ASN 61 18.709 -5.872 9.910 485 H GLY 62 H GLY 62 16.268 -6.145 5.988 486 HA2 GLY 62 HA3 GLY 62 14.896 -8.570 6.695 487 HA3 GLY 62 HA2 GLY 62 16.056 -8.367 5.393 488 H SER 63 H SER 63 16.271 -8.028 8.929 489 HA SER 63 HA SER 63 17.903 -10.390 9.165 490 HB2 SER 63 HB3 SER 63 19.132 -7.670 9.713 491 HB3 SER 63 HB2 SER 63 19.837 -9.210 10.204 492 HG SER 63 HG SER 63 19.156 -9.066 7.538 493 H TRP 64 H TRP 64 18.338 -10.898 11.420 494 HA TRP 64 HA TRP 64 16.181 -9.933 13.104 495 HB2 TRP 64 HB3 TRP 64 18.216 -12.121 13.612 496 HB3 TRP 64 HB2 TRP 64 16.770 -11.802 14.567 497 HD1 TRP 64 HD1 TRP 64 17.785 -13.055 11.055 498 HE1 TRP 64 HE1 TRP 64 15.879 -14.516 10.127 499 HE3 TRP 64 HE3 TRP 64 14.342 -12.363 14.773 500 HZ2 TRP 64 HZ2 TRP 64 13.268 -15.275 10.873 501 HZ3 TRP 64 HZ3 TRP 64 12.171 -13.497 14.588 502 HH2 TRP 64 HH2 TRP 64 11.645 -14.924 12.675 503 H THR 65 H THR 65 16.862 -9.753 15.544 504 HA THR 65 HA THR 65 18.332 -7.408 15.793 505 HB THR 65 HB THR 65 18.383 -8.106 18.302 506 HG1 THR 65 HG1 THR 65 17.174 -9.850 18.837 507 HG21 THR 65 HG21 THR 65 16.008 -7.497 18.524 508 HG22 THR 65 HG22 THR 65 15.791 -7.750 16.790 509 HG23 THR 65 HG23 THR 65 16.847 -6.462 17.370 510 H ASP 66 H ASP 66 19.314 -10.417 17.403 511 HA ASP 66 HA ASP 66 22.114 -9.833 16.666 512 HB2 ASP 66 HB3 ASP 66 21.741 -9.377 19.077 513 HB3 ASP 66 HB2 ASP 66 21.100 -10.999 19.277 514 H MET 67 H MET 67 22.862 -11.459 15.353 515 HA MET 67 HA MET 67 21.901 -14.155 16.057 516 HB2 MET 67 HB3 MET 67 22.788 -13.197 13.334 517 HB3 MET 67 HB2 MET 67 22.250 -14.824 13.726 518 HG2 MET 67 HG3 MET 67 20.037 -13.919 14.319 519 HG3 MET 67 HG2 MET 67 20.589 -12.315 13.844 520 HE1 MET 67 HE1 MET 67 21.269 -11.664 11.357 521 HE2 MET 67 HE2 MET 67 21.227 -12.797 10.005 522 HE3 MET 67 HE3 MET 67 22.402 -13.015 11.303 523 H ASP 68 H ASP 68 23.702 -13.976 17.605 524 HA ASP 68 HA ASP 68 25.466 -15.973 16.674 525 HB2 ASP 68 HB3 ASP 68 26.821 -13.986 15.991 526 HB3 ASP 68 HB2 ASP 68 26.813 -13.448 17.669 527 H THR 69 H THR 69 24.531 -17.211 18.257 528 HA THR 69 HA THR 69 25.237 -16.636 20.990 529 HB THR 69 HB THR 69 22.300 -16.899 20.633 530 HG1 THR 69 HG1 THR 69 23.712 -14.461 20.177 531 HG21 THR 69 HG21 THR 69 23.265 -16.830 22.865 532 HG22 THR 69 HG22 THR 69 22.285 -15.388 22.581 533 HG23 THR 69 HG23 THR 69 24.043 -15.291 22.497 534 HA PRO 70 HA PRO 70 24.703 -21.125 20.414 535 HB2 PRO 70 HB3 PRO 70 26.595 -21.848 22.199 536 HB3 PRO 70 HB2 PRO 70 26.993 -21.354 20.549 537 HG2 PRO 70 HG3 PRO 70 27.150 -19.781 23.086 538 HG3 PRO 70 HG2 PRO 70 28.288 -19.834 21.728 539 HD2 PRO 70 HD3 PRO 70 26.455 -17.834 22.097 540 HD3 PRO 70 HD2 PRO 70 27.092 -18.305 20.510 541 H SER 71 H SER 71 22.745 -21.501 21.349 542 HA SER 71 HA SER 71 22.198 -20.812 24.065 543 HB2 SER 71 HB3 SER 71 20.052 -22.148 23.577 544 HB3 SER 71 HB2 SER 71 20.334 -20.688 22.630 545 HG SER 71 HG SER 71 19.965 -23.150 21.741 546 H ARG 72 H ARG 72 23.316 -21.877 25.563 547 HA ARG 72 HA ARG 72 23.934 -24.673 25.331 548 HB2 ARG 72 HB3 ARG 72 24.828 -24.294 27.713 549 HB3 ARG 72 HB2 ARG 72 25.628 -23.458 26.391 550 HG2 ARG 72 HG3 ARG 72 24.631 -21.396 26.966 551 HG3 ARG 72 HG2 ARG 72 23.493 -22.172 28.069 552 HD2 ARG 72 HD3 ARG 72 25.398 -21.000 29.186 553 HD3 ARG 72 HD2 ARG 72 25.232 -22.702 29.609 554 HE ARG 72 HE ARG 72 27.015 -22.648 27.518 555 HH11 ARG 72 HH11 ARG 72 26.850 -21.185 30.689 556 HH12 ARG 72 HH12 ARG 72 28.561 -21.224 30.946 557 HH21 ARG 72 HH21 ARG 72 29.268 -22.703 27.834 558 HH22 ARG 72 HH22 ARG 72 29.952 -22.089 29.313 559 H CYS 73 H CYS 73 22.485 -26.185 25.722 560 HA CYS 73 HA CYS 73 20.355 -25.732 27.626 561 HB2 CYS 73 HB3 CYS 73 19.978 -28.287 26.941 562 HB3 CYS 73 HB2 CYS 73 19.429 -26.949 25.941 563 H VAL 74 H VAL 74 21.158 -25.690 29.630 564 HA VAL 74 HA VAL 74 22.521 -28.123 30.552 565 HB VAL 74 HB VAL 74 23.955 -26.158 30.797 566 HG11 VAL 74 HG11 VAL 74 21.773 -25.013 32.531 567 HG12 VAL 74 HG12 VAL 74 22.245 -24.430 30.936 568 HG13 VAL 74 HG13 VAL 74 23.373 -24.314 32.287 569 HG21 VAL 74 HG21 VAL 74 24.441 -26.328 33.198 570 HG22 VAL 74 HG22 VAL 74 24.160 -27.908 32.465 571 HG23 VAL 74 HG23 VAL 74 22.900 -27.152 33.440 572 H ARG 75 H ARG 75 21.526 -29.309 32.056 573 HA ARG 75 HA ARG 75 18.943 -28.297 33.039 574 HB2 ARG 75 HB3 ARG 75 19.551 -30.608 31.622 575 HB3 ARG 75 HB2 ARG 75 19.396 -31.174 33.275 576 HG2 ARG 75 HG3 ARG 75 17.318 -29.686 31.686 577 HG3 ARG 75 HG2 ARG 75 17.296 -31.394 32.121 578 HD2 ARG 75 HD3 ARG 75 17.338 -30.618 34.542 579 HD3 ARG 75 HD2 ARG 75 16.985 -29.004 33.920 580 HE ARG 75 HE ARG 75 15.215 -31.341 33.859 581 HH11 ARG 75 HH11 ARG 75 15.711 -27.921 33.211 582 HH12 ARG 75 HH12 ARG 75 14.034 -27.632 32.832 583 HH21 ARG 75 HH21 ARG 75 13.021 -30.939 33.371 584 HH22 ARG 75 HH22 ARG 75 12.524 -29.329 32.934 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 5.770 3.000 -2.489 2 H2 GLY 1 HT2 GLY 1 6.524 2.053 -1.304 3 H3 GLY 1 HT3 GLY 1 4.836 2.086 -1.410 4 HA2 GLY 1 HA2 GLY 1 4.911 1.017 -3.567 5 HA3 GLY 1 HA3 GLY 1 6.668 1.002 -3.475 6 HA PRO 2 HA PRO 2 4.605 -2.808 -1.442 7 HB2 PRO 2 HB3 PRO 2 5.660 -4.306 -3.742 8 HB3 PRO 2 HB2 PRO 2 4.045 -4.341 -3.028 9 HG2 PRO 2 HG3 PRO 2 4.515 -3.214 -5.425 10 HG3 PRO 2 HG2 PRO 2 3.299 -2.571 -4.305 11 HD2 PRO 2 HD3 PRO 2 6.073 -1.592 -4.861 12 HD3 PRO 2 HD2 PRO 2 4.579 -0.661 -4.623 13 H THR 3 H THR 3 6.235 -2.608 0.100 14 HA THR 3 HA THR 3 8.921 -3.476 -0.625 15 HB THR 3 HB THR 3 9.378 -2.776 1.816 16 HG1 THR 3 HG1 THR 3 7.750 -1.985 2.909 17 HG21 THR 3 HG21 THR 3 9.535 -0.401 1.181 18 HG22 THR 3 HG22 THR 3 8.522 -0.722 -0.228 19 HG23 THR 3 HG23 THR 3 10.117 -1.465 -0.099 20 H SER 4 H SER 4 9.686 -5.419 -0.148 21 HA SER 4 HA SER 4 8.152 -7.173 1.618 22 HB2 SER 4 HB3 SER 4 10.587 -7.753 -0.097 23 HB3 SER 4 HB2 SER 4 9.647 -8.950 0.797 24 HG SER 4 HG SER 4 7.848 -8.419 -0.503 25 H GLU 5 H GLU 5 8.564 -6.603 3.668 26 HA GLU 5 HA GLU 5 11.379 -6.272 4.463 27 HB2 GLU 5 HB3 GLU 5 8.933 -4.904 5.607 28 HB3 GLU 5 HB2 GLU 5 10.585 -4.686 6.171 29 HG2 GLU 5 HG3 GLU 5 11.228 -3.649 4.124 30 HG3 GLU 5 HG2 GLU 5 9.689 -4.054 3.368 31 H GLY 6 H GLY 6 11.813 -8.251 5.242 32 HA2 GLY 6 HA3 GLY 6 10.687 -8.900 7.801 33 HA3 GLY 6 HA2 GLY 6 10.277 -10.060 6.542 34 H CYS 7 H CYS 7 11.740 -10.821 8.736 35 HA CYS 7 HA CYS 7 14.542 -10.872 8.017 36 HB2 CYS 7 HB3 CYS 7 13.178 -12.501 10.159 37 HB3 CYS 7 HB2 CYS 7 14.875 -12.042 10.069 38 H GLN 8 H GLN 8 15.652 -12.603 7.179 39 HA GLN 8 HA GLN 8 14.022 -14.527 5.766 40 HB2 GLN 8 HB3 GLN 8 16.114 -15.237 4.713 41 HB3 GLN 8 HB2 GLN 8 15.894 -13.500 4.593 42 HG2 GLN 8 HG3 GLN 8 17.572 -13.049 6.127 43 HG3 GLN 8 HG2 GLN 8 17.526 -14.676 6.804 44 HE21 GLN 8 HE21 GLN 8 17.546 -16.038 4.265 45 HE22 GLN 8 HE22 GLN 8 19.135 -15.864 3.611 46 H ILE 9 H ILE 9 15.232 -16.816 5.619 47 HA ILE 9 HA ILE 9 15.078 -17.896 8.314 48 HB ILE 9 HB ILE 9 15.406 -19.295 5.650 49 HG12 ILE 9 HG13 ILE 9 13.021 -19.010 7.491 50 HG13 ILE 9 HG12 ILE 9 13.216 -18.250 5.913 51 HG21 ILE 9 HG21 ILE 9 14.901 -21.360 6.893 52 HG22 ILE 9 HG22 ILE 9 14.972 -20.448 8.400 53 HG23 ILE 9 HG23 ILE 9 16.418 -20.615 7.404 54 HD11 ILE 9 HD11 ILE 9 11.743 -20.157 5.763 55 HD12 ILE 9 HD12 ILE 9 12.985 -21.201 6.455 56 HD13 ILE 9 HD13 ILE 9 13.232 -20.467 4.870 57 H ILE 10 H ILE 10 16.823 -17.649 9.447 58 HA ILE 10 HA ILE 10 19.460 -17.420 8.407 59 HB ILE 10 HB ILE 10 20.112 -17.476 10.824 60 HG12 ILE 10 HG13 ILE 10 17.123 -17.762 11.204 61 HG13 ILE 10 HG12 ILE 10 18.330 -18.982 11.592 62 HG21 ILE 10 HG21 ILE 10 19.615 -15.365 9.745 63 HG22 ILE 10 HG22 ILE 10 18.998 -15.349 11.397 64 HG23 ILE 10 HG23 ILE 10 17.890 -15.586 10.047 65 HD11 ILE 10 HD11 ILE 10 17.523 -17.816 13.568 66 HD12 ILE 10 HD12 ILE 10 18.084 -16.284 12.896 67 HD13 ILE 10 HD13 ILE 10 19.246 -17.545 13.313 68 H HIS 11 H HIS 11 21.274 -18.772 9.282 69 HA HIS 11 HA HIS 11 20.857 -21.548 8.844 70 HB2 HIS 11 HB3 HIS 11 23.176 -21.830 9.307 71 HB3 HIS 11 HB2 HIS 11 23.042 -20.267 8.515 72 HD1 HIS 11 HD1 HIS 11 24.589 -21.858 11.337 73 HD2 HIS 11 HD2 HIS 11 23.031 -18.068 10.586 74 HE1 HIS 11 HE1 HIS 11 25.585 -20.358 13.087 75 HE2 HIS 11 HE2 HIS 11 24.788 -18.042 12.493 76 HA PRO 12 HA PRO 12 19.486 -22.775 12.939 77 HB2 PRO 12 HB3 PRO 12 20.759 -25.345 12.170 78 HB3 PRO 12 HB2 PRO 12 19.108 -25.027 12.714 79 HG2 PRO 12 HG3 PRO 12 19.632 -25.598 10.157 80 HG3 PRO 12 HG2 PRO 12 18.387 -24.417 10.603 81 HD2 PRO 12 HD3 PRO 12 21.154 -23.957 9.571 82 HD3 PRO 12 HD2 PRO 12 19.653 -23.074 9.215 83 HA PRO 13 HA PRO 13 23.341 -22.335 15.123 84 HB2 PRO 13 HB3 PRO 13 22.484 -22.922 17.620 85 HB3 PRO 13 HB2 PRO 13 22.078 -21.405 16.811 86 HG2 PRO 13 HG3 PRO 13 20.435 -23.883 17.126 87 HG3 PRO 13 HG2 PRO 13 19.945 -22.186 17.293 88 HD2 PRO 13 HD3 PRO 13 19.462 -23.662 15.060 89 HD3 PRO 13 HD2 PRO 13 19.709 -21.904 15.027 90 H TRP 14 H TRP 14 24.086 -23.754 17.364 91 HA TRP 14 HA TRP 14 25.027 -26.196 16.268 92 HB2 TRP 14 HB3 TRP 14 26.145 -24.703 18.055 93 HB3 TRP 14 HB2 TRP 14 25.092 -25.522 19.206 94 HD1 TRP 14 HD1 TRP 14 26.417 -27.348 20.408 95 HE1 TRP 14 HE1 TRP 14 28.164 -29.120 19.739 96 HE3 TRP 14 HE3 TRP 14 26.966 -26.133 15.463 97 HZ2 TRP 14 HZ2 TRP 14 29.581 -29.892 17.432 98 HZ3 TRP 14 HZ3 TRP 14 28.540 -27.447 14.101 99 HH2 TRP 14 HH2 TRP 14 29.819 -29.284 15.066 100 H GLU 15 H GLU 15 24.814 -28.128 18.157 101 HA GLU 15 HA GLU 15 22.712 -29.597 17.391 102 HB2 GLU 15 HB3 GLU 15 23.807 -29.612 20.205 103 HB3 GLU 15 HB2 GLU 15 22.937 -30.926 19.427 104 HG2 GLU 15 HG3 GLU 15 25.632 -29.846 18.648 105 HG3 GLU 15 HG2 GLU 15 25.301 -31.380 19.450 106 H GLY 16 H GLY 16 20.720 -28.783 17.196 107 HA2 GLY 16 HA3 GLY 16 18.846 -28.905 19.170 108 HA3 GLY 16 HA2 GLY 16 19.442 -27.252 19.251 109 H GLY 17 H GLY 17 17.894 -26.032 18.392 110 HA2 GLY 17 HA3 GLY 17 17.490 -25.990 15.609 111 HA3 GLY 17 HA2 GLY 17 16.120 -26.799 16.360 112 H ILE 18 H ILE 18 14.977 -24.913 15.395 113 HA ILE 18 HA ILE 18 15.019 -22.701 17.312 114 HB ILE 18 HB ILE 18 14.999 -22.520 14.328 115 HG12 ILE 18 HG13 ILE 18 16.353 -21.015 16.565 116 HG13 ILE 18 HG12 ILE 18 17.093 -22.245 15.542 117 HG21 ILE 18 HG21 ILE 18 13.872 -20.430 16.196 118 HG22 ILE 18 HG22 ILE 18 12.971 -21.340 14.985 119 HG23 ILE 18 HG23 ILE 18 14.210 -20.192 14.482 120 HD11 ILE 18 HD11 ILE 18 16.087 -19.564 14.613 121 HD12 ILE 18 HD12 ILE 18 16.847 -20.796 13.604 122 HD13 ILE 18 HD13 ILE 18 17.773 -20.008 14.881 123 H ARG 19 H ARG 19 13.192 -22.189 18.174 124 HA ARG 19 HA ARG 19 10.779 -23.593 17.304 125 HB2 ARG 19 HB3 ARG 19 11.692 -23.602 19.709 126 HB3 ARG 19 HB2 ARG 19 11.125 -21.942 19.801 127 HG2 ARG 19 HG3 ARG 19 9.485 -23.450 20.759 128 HG3 ARG 19 HG2 ARG 19 8.846 -22.672 19.310 129 HD2 ARG 19 HD3 ARG 19 9.491 -24.708 18.021 130 HD3 ARG 19 HD2 ARG 19 9.922 -25.476 19.548 131 HE ARG 19 HE ARG 19 7.320 -24.560 19.822 132 HH11 ARG 19 HH11 ARG 19 9.085 -26.934 17.949 133 HH12 ARG 19 HH12 ARG 19 7.682 -27.915 17.633 134 HH21 ARG 19 HH21 ARG 19 5.465 -25.870 19.416 135 HH22 ARG 19 HH22 ARG 19 5.652 -27.322 18.472 136 H TYR 20 H TYR 20 9.030 -22.502 16.523 137 HA TYR 20 HA TYR 20 9.446 -19.673 15.975 138 HB2 TYR 20 HB3 TYR 20 7.459 -21.664 14.876 139 HB3 TYR 20 HB2 TYR 20 7.510 -19.962 14.421 140 HD1 TYR 20 HD1 TYR 20 8.984 -23.227 13.927 141 HD2 TYR 20 HD2 TYR 20 9.531 -19.064 13.249 142 HE1 TYR 20 HE1 TYR 20 10.689 -23.731 12.231 143 HE2 TYR 20 HE2 TYR 20 11.239 -19.558 11.545 144 HH TYR 20 HH TYR 20 12.785 -21.391 10.959 145 H ARG 21 H ARG 21 6.821 -18.799 15.710 146 HA ARG 21 HA ARG 21 6.250 -18.536 18.585 147 HB2 ARG 21 HB3 ARG 21 7.090 -16.543 17.286 148 HB3 ARG 21 HB2 ARG 21 5.588 -16.585 16.380 149 HG2 ARG 21 HG3 ARG 21 4.349 -16.214 18.478 150 HG3 ARG 21 HG2 ARG 21 5.889 -16.097 19.338 151 HD2 ARG 21 HD3 ARG 21 6.525 -14.264 17.753 152 HD3 ARG 21 HD2 ARG 21 4.876 -14.308 17.138 153 HE ARG 21 HE ARG 21 5.270 -13.848 19.998 154 HH11 ARG 21 HH11 ARG 21 4.345 -12.649 16.847 155 HH12 ARG 21 HH12 ARG 21 3.770 -11.126 17.442 156 HH21 ARG 21 HH21 ARG 21 4.493 -11.840 20.806 157 HH22 ARG 21 HH22 ARG 21 3.849 -10.667 19.685 158 H GLY 22 H GLY 22 4.369 -17.755 15.682 159 HA2 GLY 22 HA3 GLY 22 2.099 -19.211 16.885 160 HA3 GLY 22 HA2 GLY 22 1.935 -17.756 15.910 161 H LEU 23 H LEU 23 3.912 -20.630 15.340 162 HA LEU 23 HA LEU 23 2.200 -21.313 13.059 163 HB2 LEU 23 HB3 LEU 23 5.201 -21.007 13.025 164 HB3 LEU 23 HB2 LEU 23 4.338 -21.942 11.819 165 HG LEU 23 HG LEU 23 3.917 -18.994 12.336 166 HD11 LEU 23 HD11 LEU 23 6.130 -19.427 11.417 167 HD12 LEU 23 HD12 LEU 23 5.088 -18.669 10.215 168 HD13 LEU 23 HD13 LEU 23 5.416 -20.399 10.130 169 HD21 LEU 23 HD21 LEU 23 1.931 -20.095 11.455 170 HD22 LEU 23 HD22 LEU 23 2.888 -20.822 10.162 171 HD23 LEU 23 HD23 LEU 23 2.668 -19.072 10.222 172 H THR 24 H THR 24 2.004 -23.474 12.644 173 HA THR 24 HA THR 24 3.113 -25.284 14.661 174 HB THR 24 HB THR 24 0.680 -25.374 14.267 175 HG1 THR 24 HG1 THR 24 1.001 -27.384 14.819 176 HG21 THR 24 HG21 THR 24 1.415 -26.262 11.475 177 HG22 THR 24 HG22 THR 24 0.638 -24.739 11.910 178 HG23 THR 24 HG23 THR 24 -0.209 -26.265 12.162 179 H ARG 25 H ARG 25 3.575 -27.592 13.645 180 HA ARG 25 HA ARG 25 5.762 -27.205 11.838 181 HB2 ARG 25 HB3 ARG 25 6.120 -29.615 12.057 182 HB3 ARG 25 HB2 ARG 25 5.885 -28.867 13.629 183 HG2 ARG 25 HG3 ARG 25 3.580 -29.661 13.670 184 HG3 ARG 25 HG2 ARG 25 3.808 -30.410 12.089 185 HD2 ARG 25 HD3 ARG 25 5.619 -31.793 13.058 186 HD3 ARG 25 HD2 ARG 25 5.263 -31.095 14.637 187 HE ARG 25 HE ARG 25 2.867 -32.099 13.801 188 HH11 ARG 25 HH11 ARG 25 6.064 -33.398 14.357 189 HH12 ARG 25 HH12 ARG 25 5.509 -35.029 14.595 190 HH21 ARG 25 HH21 ARG 25 2.114 -34.224 14.160 191 HH22 ARG 25 HH22 ARG 25 3.248 -35.501 14.493 192 H ASP 26 H ASP 26 5.795 -29.348 10.162 193 HA ASP 26 HA ASP 26 5.150 -30.046 8.093 194 HB2 ASP 26 HB3 ASP 26 3.023 -30.714 9.180 195 HB3 ASP 26 HB2 ASP 26 2.380 -29.103 8.886 196 H GLN 27 H GLN 27 5.181 -27.010 9.171 197 HA GLN 27 HA GLN 27 4.937 -25.801 6.497 198 HB2 GLN 27 HB3 GLN 27 4.434 -24.586 9.222 199 HB3 GLN 27 HB2 GLN 27 4.457 -23.673 7.721 200 HG2 GLN 27 HG3 GLN 27 2.538 -24.834 6.901 201 HG3 GLN 27 HG2 GLN 27 2.570 -25.953 8.261 202 HE21 GLN 27 HE21 GLN 27 3.159 -23.900 10.220 203 HE22 GLN 27 HE22 GLN 27 1.694 -22.998 10.436 204 H VAL 28 H VAL 28 6.159 -23.354 7.363 205 HA VAL 28 HA VAL 28 8.202 -22.369 7.391 206 HB VAL 28 HB VAL 28 9.535 -22.684 9.358 207 HG11 VAL 28 HG11 VAL 28 6.603 -23.018 9.966 208 HG12 VAL 28 HG12 VAL 28 7.447 -21.504 9.642 209 HG13 VAL 28 HG13 VAL 28 7.820 -22.429 11.097 210 HG21 VAL 28 HG21 VAL 28 9.118 -24.486 10.985 211 HG22 VAL 28 HG22 VAL 28 9.697 -25.110 9.442 212 HG23 VAL 28 HG23 VAL 28 7.989 -25.233 9.858 213 H LYS 29 H LYS 29 7.979 -24.636 5.640 214 HA LYS 29 HA LYS 29 10.572 -25.962 5.782 215 HB2 LYS 29 HB3 LYS 29 9.602 -27.279 3.827 216 HB3 LYS 29 HB2 LYS 29 8.804 -27.473 5.382 217 HG2 LYS 29 HG3 LYS 29 7.237 -25.589 4.514 218 HG3 LYS 29 HG2 LYS 29 7.852 -26.066 2.930 219 HD2 LYS 29 HD3 LYS 29 7.102 -28.344 3.297 220 HD3 LYS 29 HD2 LYS 29 6.576 -27.933 4.931 221 HE2 LYS 29 HE3 LYS 29 5.020 -26.251 3.899 222 HE3 LYS 29 HE2 LYS 29 5.442 -26.928 2.326 223 HZ1 LYS 29 HZ1 LYS 29 4.611 -29.087 3.090 224 HZ2 LYS 29 HZ2 LYS 29 3.404 -27.894 3.159 225 HZ3 LYS 29 HZ3 LYS 29 4.176 -28.398 4.578 226 H ALA 30 H ALA 30 8.915 -23.478 4.071 227 HA ALA 30 HA ALA 30 11.384 -22.636 2.872 228 HB1 ALA 30 HB1 ALA 30 10.611 -24.275 1.209 229 HB2 ALA 30 HB2 ALA 30 10.645 -22.632 0.567 230 HB3 ALA 30 HB3 ALA 30 9.110 -23.367 1.030 231 H ILE 31 H ILE 31 10.866 -20.918 4.321 232 HA ILE 31 HA ILE 31 8.678 -19.152 3.461 233 HB ILE 31 HB ILE 31 10.385 -18.982 5.961 234 HG12 ILE 31 HG13 ILE 31 7.568 -20.030 5.608 235 HG13 ILE 31 HG12 ILE 31 8.988 -20.997 5.988 236 HG21 ILE 31 HG21 ILE 31 9.468 -16.830 5.262 237 HG22 ILE 31 HG22 ILE 31 8.714 -17.391 6.753 238 HG23 ILE 31 HG23 ILE 31 7.849 -17.528 5.222 239 HD11 ILE 31 HD11 ILE 31 7.598 -20.577 7.952 240 HD12 ILE 31 HD12 ILE 31 7.830 -18.842 7.739 241 HD13 ILE 31 HD13 ILE 31 9.207 -19.875 8.125 242 H ASN 32 H ASN 32 9.125 -16.999 2.872 243 HA ASN 32 HA ASN 32 11.841 -16.532 1.958 244 HB2 ASN 32 HB3 ASN 32 9.298 -14.925 1.647 245 HB3 ASN 32 HB2 ASN 32 10.862 -14.392 1.039 246 HD21 ASN 32 HD21 ASN 32 8.416 -14.984 -0.416 247 HD22 ASN 32 HD22 ASN 32 8.828 -16.224 -1.552 248 H PHE 33 H PHE 33 9.516 -14.480 3.712 249 HA PHE 33 HA PHE 33 11.664 -13.737 5.567 250 HB2 PHE 33 HB3 PHE 33 9.817 -11.775 4.187 251 HB3 PHE 33 HB2 PHE 33 11.002 -11.373 5.426 252 HD1 PHE 33 HD1 PHE 33 10.392 -11.648 1.961 253 HD2 PHE 33 HD2 PHE 33 13.471 -11.968 4.879 254 HE1 PHE 33 HE1 PHE 33 12.083 -11.310 0.208 255 HE2 PHE 33 HE2 PHE 33 15.170 -11.627 3.133 256 HZ PHE 33 HZ PHE 33 14.477 -11.297 0.794 257 H LEU 34 H LEU 34 10.995 -13.265 7.636 258 HA LEU 34 HA LEU 34 8.238 -13.963 8.294 259 HB2 LEU 34 HB3 LEU 34 10.718 -13.547 9.953 260 HB3 LEU 34 HB2 LEU 34 9.135 -13.679 10.688 261 HG LEU 34 HG LEU 34 10.194 -15.802 10.862 262 HD11 LEU 34 HD11 LEU 34 7.817 -15.859 10.329 263 HD12 LEU 34 HD12 LEU 34 8.662 -17.252 9.650 264 HD13 LEU 34 HD13 LEU 34 8.200 -15.905 8.607 265 HD21 LEU 34 HD21 LEU 34 10.637 -15.706 7.882 266 HD22 LEU 34 HD22 LEU 34 11.019 -17.060 8.945 267 HD23 LEU 34 HD23 LEU 34 11.881 -15.532 9.121 268 HA PRO 35 HA PRO 35 6.890 -9.773 8.593 269 HB2 PRO 35 HB3 PRO 35 5.033 -10.028 10.596 270 HB3 PRO 35 HB2 PRO 35 4.747 -10.487 8.914 271 HG2 PRO 35 HG3 PRO 35 5.511 -12.202 11.246 272 HG3 PRO 35 HG2 PRO 35 4.330 -12.519 9.961 273 HD2 PRO 35 HD3 PRO 35 6.769 -13.633 9.928 274 HD3 PRO 35 HD2 PRO 35 5.969 -13.113 8.429 275 H VAL 36 H VAL 36 7.270 -7.925 9.742 276 HA VAL 36 HA VAL 36 9.089 -8.042 11.932 277 HB VAL 36 HB VAL 36 9.269 -6.216 10.371 278 HG11 VAL 36 HG11 VAL 36 6.530 -5.336 11.273 279 HG12 VAL 36 HG12 VAL 36 6.941 -6.013 9.697 280 HG13 VAL 36 HG13 VAL 36 7.596 -4.449 10.183 281 HG21 VAL 36 HG21 VAL 36 10.000 -5.773 12.644 282 HG22 VAL 36 HG22 VAL 36 8.384 -5.213 13.076 283 HG23 VAL 36 HG23 VAL 36 9.348 -4.308 11.907 284 H ASP 37 H ASP 37 7.988 -9.279 13.411 285 HA ASP 37 HA ASP 37 6.667 -8.111 15.533 286 HB2 ASP 37 HB3 ASP 37 4.789 -7.751 13.933 287 HB3 ASP 37 HB2 ASP 37 4.727 -9.486 13.640 288 H TYR 38 H TYR 38 7.308 -10.797 13.494 289 HA TYR 38 HA TYR 38 6.501 -12.869 15.264 290 HB2 TYR 38 HB3 TYR 38 6.897 -12.859 12.671 291 HB3 TYR 38 HB2 TYR 38 8.552 -13.259 13.117 292 HD1 TYR 38 HD1 TYR 38 9.114 -15.442 13.948 293 HD2 TYR 38 HD2 TYR 38 5.059 -14.386 13.219 294 HE1 TYR 38 HE1 TYR 38 8.461 -17.802 14.182 295 HE2 TYR 38 HE2 TYR 38 4.396 -16.738 13.454 296 HH TYR 38 HH TYR 38 5.488 -18.990 13.211 297 H GLU 39 H GLU 39 7.708 -14.134 16.632 298 HA GLU 39 HA GLU 39 10.483 -13.305 17.149 299 HB2 GLU 39 HB3 GLU 39 8.461 -14.196 19.217 300 HB3 GLU 39 HB2 GLU 39 10.114 -13.692 19.529 301 HG2 GLU 39 HG3 GLU 39 9.576 -11.435 18.760 302 HG3 GLU 39 HG2 GLU 39 7.915 -11.938 18.451 303 H ILE 40 H ILE 40 11.888 -14.997 17.926 304 HA ILE 40 HA ILE 40 10.844 -17.727 17.515 305 HB ILE 40 HB ILE 40 13.060 -18.395 16.628 306 HG12 ILE 40 HG13 ILE 40 13.586 -15.418 16.497 307 HG13 ILE 40 HG12 ILE 40 14.366 -16.535 17.613 308 HG21 ILE 40 HG21 ILE 40 11.243 -17.955 15.099 309 HG22 ILE 40 HG22 ILE 40 12.770 -17.418 14.396 310 HG23 ILE 40 HG23 ILE 40 11.646 -16.239 15.076 311 HD11 ILE 40 HD11 ILE 40 15.395 -17.699 15.753 312 HD12 ILE 40 HD12 ILE 40 15.786 -15.979 15.711 313 HD13 ILE 40 HD13 ILE 40 14.570 -16.636 14.614 314 H GLU 41 H GLU 41 12.226 -19.419 18.516 315 HA GLU 41 HA GLU 41 13.617 -18.481 20.935 316 HB2 GLU 41 HB3 GLU 41 11.364 -19.220 21.564 317 HB3 GLU 41 HB2 GLU 41 11.627 -20.760 20.757 318 HG2 GLU 41 HG3 GLU 41 13.334 -21.352 22.355 319 HG3 GLU 41 HG2 GLU 41 13.208 -19.767 23.119 320 H TYR 42 H TYR 42 15.325 -19.795 21.638 321 HA TYR 42 HA TYR 42 16.446 -21.526 19.568 322 HB2 TYR 42 HB3 TYR 42 17.704 -20.386 22.073 323 HB3 TYR 42 HB2 TYR 42 18.544 -21.363 20.875 324 HD1 TYR 42 HD1 TYR 42 18.971 -20.431 18.608 325 HD2 TYR 42 HD2 TYR 42 17.310 -18.064 21.726 326 HE1 TYR 42 HE1 TYR 42 19.568 -18.391 17.370 327 HE2 TYR 42 HE2 TYR 42 17.901 -16.019 20.496 328 HH TYR 42 HH TYR 42 19.118 -16.114 17.227 329 H VAL 43 H VAL 43 15.652 -23.561 19.772 330 HA VAL 43 HA VAL 43 15.584 -24.754 22.456 331 HB VAL 43 HB VAL 43 14.198 -26.550 21.442 332 HG11 VAL 43 HG11 VAL 43 13.146 -24.681 22.590 333 HG12 VAL 43 HG12 VAL 43 12.160 -25.206 21.225 334 HG13 VAL 43 HG13 VAL 43 13.143 -23.747 21.095 335 HG21 VAL 43 HG21 VAL 43 13.184 -26.155 19.238 336 HG22 VAL 43 HG22 VAL 43 14.928 -26.389 19.136 337 HG23 VAL 43 HG23 VAL 43 14.245 -24.767 19.011 338 H CYS 44 H CYS 44 16.035 -27.206 22.398 339 HA CYS 44 HA CYS 44 18.507 -27.619 20.858 340 HB2 CYS 44 HB3 CYS 44 18.846 -27.313 23.303 341 HB3 CYS 44 HB2 CYS 44 17.823 -28.711 23.596 342 H ARG 45 H ARG 45 19.033 -30.113 20.884 343 HA ARG 45 HA ARG 45 16.891 -31.323 19.397 344 HB2 ARG 45 HB3 ARG 45 19.493 -31.458 19.037 345 HB3 ARG 45 HB2 ARG 45 19.397 -32.770 20.201 346 HG2 ARG 45 HG3 ARG 45 17.767 -32.681 17.679 347 HG3 ARG 45 HG2 ARG 45 19.357 -33.435 17.779 348 HD2 ARG 45 HD3 ARG 45 18.524 -34.955 19.508 349 HD3 ARG 45 HD2 ARG 45 16.935 -34.193 19.413 350 HE ARG 45 HE ARG 45 17.431 -34.986 16.860 351 HH11 ARG 45 HH11 ARG 45 17.493 -36.621 19.950 352 HH12 ARG 45 HH12 ARG 45 16.984 -38.152 19.299 353 HH21 ARG 45 HH21 ARG 45 16.745 -37.005 15.986 354 HH22 ARG 45 HH22 ARG 45 16.557 -38.371 17.052 355 H GLY 46 H GLY 46 15.220 -31.905 20.666 356 HA2 GLY 46 HA3 GLY 46 14.119 -33.555 21.921 357 HA3 GLY 46 HA2 GLY 46 15.673 -34.081 22.555 358 H GLU 47 H GLU 47 14.595 -34.081 24.650 359 HA GLU 47 HA GLU 47 13.826 -31.494 25.702 360 HB2 GLU 47 HB3 GLU 47 13.487 -32.893 27.848 361 HB3 GLU 47 HB2 GLU 47 12.392 -33.130 26.492 362 HG2 GLU 47 HG3 GLU 47 13.727 -35.092 25.809 363 HG3 GLU 47 HG2 GLU 47 14.718 -34.881 27.253 364 H ARG 48 H ARG 48 16.056 -30.773 25.201 365 HA ARG 48 HA ARG 48 17.687 -31.002 27.646 366 HB2 ARG 48 HB3 ARG 48 18.654 -30.538 24.808 367 HB3 ARG 48 HB2 ARG 48 19.672 -30.480 26.241 368 HG2 ARG 48 HG3 ARG 48 18.115 -32.924 25.447 369 HG3 ARG 48 HG2 ARG 48 19.761 -32.607 24.896 370 HD2 ARG 48 HD3 ARG 48 18.984 -32.661 27.806 371 HD3 ARG 48 HD2 ARG 48 19.526 -34.092 26.930 372 HE ARG 48 HE ARG 48 21.444 -32.169 26.484 373 HH11 ARG 48 HH11 ARG 48 20.091 -33.777 29.292 374 HH12 ARG 48 HH12 ARG 48 21.575 -33.701 30.190 375 HH21 ARG 48 HH21 ARG 48 23.384 -32.078 27.669 376 HH22 ARG 48 HH22 ARG 48 23.431 -32.735 29.286 377 H GLU 49 H GLU 49 17.359 -29.168 28.754 378 HA GLU 49 HA GLU 49 16.174 -26.924 27.399 379 HB2 GLU 49 HB3 GLU 49 16.861 -27.272 30.319 380 HB3 GLU 49 HB2 GLU 49 15.849 -26.001 29.639 381 HG2 GLU 49 HG3 GLU 49 14.311 -27.777 28.804 382 HG3 GLU 49 HG2 GLU 49 15.276 -28.953 29.691 383 H VAL 50 H VAL 50 16.970 -24.906 27.127 384 HA VAL 50 HA VAL 50 19.890 -24.737 27.185 385 HB VAL 50 HB VAL 50 19.662 -22.817 25.687 386 HG11 VAL 50 HG11 VAL 50 18.062 -25.217 24.822 387 HG12 VAL 50 HG12 VAL 50 19.800 -24.974 24.645 388 HG13 VAL 50 HG13 VAL 50 18.672 -23.971 23.735 389 HG21 VAL 50 HG21 VAL 50 17.471 -22.157 24.798 390 HG22 VAL 50 HG22 VAL 50 17.583 -21.889 26.539 391 HG23 VAL 50 HG23 VAL 50 16.689 -23.275 25.915 392 H VAL 51 H VAL 51 21.012 -23.045 28.126 393 HA VAL 51 HA VAL 51 19.396 -21.173 29.722 394 HB VAL 51 HB VAL 51 20.756 -22.408 31.246 395 HG11 VAL 51 HG11 VAL 51 23.132 -21.771 29.502 396 HG12 VAL 51 HG12 VAL 51 22.348 -23.343 29.654 397 HG13 VAL 51 HG13 VAL 51 23.176 -22.633 31.040 398 HG21 VAL 51 HG21 VAL 51 22.231 -20.681 32.190 399 HG22 VAL 51 HG22 VAL 51 20.659 -20.033 31.719 400 HG23 VAL 51 HG23 VAL 51 22.072 -19.748 30.702 401 H GLY 52 H GLY 52 19.070 -19.624 28.248 402 HA2 GLY 52 HA3 GLY 52 21.327 -17.953 27.538 403 HA3 GLY 52 HA2 GLY 52 20.488 -18.688 26.178 404 HA PRO 53 HA PRO 53 17.939 -14.986 27.314 405 HB2 PRO 53 HB3 PRO 53 18.927 -13.085 25.687 406 HB3 PRO 53 HB2 PRO 53 19.559 -13.331 27.317 407 HG2 PRO 53 HG3 PRO 53 20.719 -14.115 24.696 408 HG3 PRO 53 HG2 PRO 53 21.538 -13.609 26.182 409 HD2 PRO 53 HD3 PRO 53 21.219 -16.245 25.287 410 HD3 PRO 53 HD2 PRO 53 21.692 -15.748 26.923 411 H LYS 54 H LYS 54 16.794 -16.788 26.123 412 HA LYS 54 HA LYS 54 17.000 -16.756 23.244 413 HB2 LYS 54 HB3 LYS 54 15.356 -18.638 23.354 414 HB3 LYS 54 HB2 LYS 54 16.849 -18.921 24.232 415 HG2 LYS 54 HG3 LYS 54 15.736 -18.462 26.333 416 HG3 LYS 54 HG2 LYS 54 14.245 -18.064 25.482 417 HD2 LYS 54 HD3 LYS 54 14.198 -20.381 24.588 418 HD3 LYS 54 HD2 LYS 54 15.617 -20.749 25.572 419 HE2 LYS 54 HE3 LYS 54 13.614 -21.498 26.705 420 HE3 LYS 54 HE2 LYS 54 14.343 -20.164 27.594 421 HZ1 LYS 54 HZ1 LYS 54 11.993 -19.980 25.773 422 HZ2 LYS 54 HZ2 LYS 54 12.705 -18.669 26.581 423 HZ3 LYS 54 HZ3 LYS 54 11.958 -19.902 27.469 424 H VAL 55 H VAL 55 16.210 -14.689 22.807 425 HA VAL 55 HA VAL 55 13.451 -14.826 22.067 426 HB VAL 55 HB VAL 55 13.093 -13.918 24.278 427 HG11 VAL 55 HG11 VAL 55 14.079 -11.828 25.036 428 HG12 VAL 55 HG12 VAL 55 15.033 -11.731 23.556 429 HG13 VAL 55 HG13 VAL 55 15.323 -13.035 24.707 430 HG21 VAL 55 HG21 VAL 55 11.995 -11.794 23.726 431 HG22 VAL 55 HG22 VAL 55 11.677 -13.038 22.517 432 HG23 VAL 55 HG23 VAL 55 12.850 -11.764 22.184 433 H ARG 56 H ARG 56 13.266 -13.946 20.128 434 HA ARG 56 HA ARG 56 14.993 -11.729 19.316 435 HB2 ARG 56 HB3 ARG 56 14.749 -14.288 17.712 436 HB3 ARG 56 HB2 ARG 56 15.588 -12.835 17.201 437 HG2 ARG 56 HG3 ARG 56 16.373 -14.503 19.577 438 HG3 ARG 56 HG2 ARG 56 17.074 -14.654 17.965 439 HD2 ARG 56 HD3 ARG 56 17.675 -12.207 18.142 440 HD3 ARG 56 HD2 ARG 56 17.225 -12.312 19.846 441 HE ARG 56 HE ARG 56 19.114 -14.307 18.955 442 HH11 ARG 56 HH11 ARG 56 18.715 -11.117 20.381 443 HH12 ARG 56 HH12 ARG 56 20.328 -11.088 21.038 444 HH21 ARG 56 HH21 ARG 56 21.203 -14.247 19.816 445 HH22 ARG 56 HH22 ARG 56 21.739 -12.857 20.699 446 H LYS 57 H LYS 57 13.624 -10.248 18.529 447 HA LYS 57 HA LYS 57 11.219 -11.229 17.157 448 HB2 LYS 57 HB3 LYS 57 10.799 -9.761 19.097 449 HB3 LYS 57 HB2 LYS 57 11.738 -8.489 18.326 450 HG2 LYS 57 HG3 LYS 57 10.140 -8.160 16.651 451 HG3 LYS 57 HG2 LYS 57 9.343 -9.696 16.991 452 HD2 LYS 57 HD3 LYS 57 8.023 -7.825 17.814 453 HD3 LYS 57 HD2 LYS 57 8.590 -8.831 19.148 454 HE2 LYS 57 HE3 LYS 57 10.390 -7.231 19.584 455 HE3 LYS 57 HE2 LYS 57 9.824 -6.230 18.245 456 HZ1 LYS 57 HZ1 LYS 57 7.754 -5.876 19.393 457 HZ2 LYS 57 HZ2 LYS 57 9.041 -5.440 20.406 458 HZ3 LYS 57 HZ3 LYS 57 8.229 -6.905 20.656 459 H CYS 58 H CYS 58 10.738 -10.583 15.130 460 HA CYS 58 HA CYS 58 12.968 -10.032 13.468 461 HB2 CYS 58 HB3 CYS 58 11.102 -11.502 12.813 462 HB3 CYS 58 HB2 CYS 58 10.028 -10.107 12.773 463 H LEU 59 H LEU 59 13.322 -8.332 12.070 464 HA LEU 59 HA LEU 59 12.097 -5.776 12.850 465 HB2 LEU 59 HB3 LEU 59 14.857 -6.324 11.746 466 HB3 LEU 59 HB2 LEU 59 14.204 -4.731 12.076 467 HG LEU 59 HG LEU 59 14.726 -6.863 14.154 468 HD11 LEU 59 HD11 LEU 59 16.210 -4.311 13.528 469 HD12 LEU 59 HD12 LEU 59 16.787 -5.949 13.221 470 HD13 LEU 59 HD13 LEU 59 16.543 -5.397 14.879 471 HD21 LEU 59 HD21 LEU 59 12.854 -5.406 14.745 472 HD22 LEU 59 HD22 LEU 59 13.862 -3.988 14.452 473 HD23 LEU 59 HD23 LEU 59 14.257 -5.092 15.767 474 H ALA 60 H ALA 60 12.700 -4.137 10.845 475 HA ALA 60 HA ALA 60 11.081 -5.186 8.681 476 HB1 ALA 60 HB1 ALA 60 11.083 -2.891 7.851 477 HB2 ALA 60 HB2 ALA 60 12.287 -2.446 9.062 478 HB3 ALA 60 HB3 ALA 60 10.672 -2.940 9.567 479 H ASN 61 H ASN 61 13.784 -6.250 9.053 480 HA ASN 61 HA ASN 61 14.733 -5.879 6.339 481 HB2 ASN 61 HB3 ASN 61 17.093 -5.570 7.089 482 HB3 ASN 61 HB2 ASN 61 16.052 -4.210 7.490 483 HD21 ASN 61 HD21 ASN 61 18.023 -6.738 8.700 484 HD22 ASN 61 HD22 ASN 61 17.899 -6.344 10.373 485 H GLY 62 H GLY 62 16.706 -7.478 6.015 486 HA2 GLY 62 HA3 GLY 62 15.423 -9.995 6.328 487 HA3 GLY 62 HA2 GLY 62 16.976 -9.715 5.563 488 H SER 63 H SER 63 18.194 -8.544 7.932 489 HA SER 63 HA SER 63 18.773 -11.041 9.287 490 HB2 SER 63 HB3 SER 63 20.098 -8.329 9.421 491 HB3 SER 63 HB2 SER 63 20.641 -9.747 10.318 492 HG SER 63 HG SER 63 20.878 -9.147 7.617 493 H TRP 64 H TRP 64 18.491 -11.424 11.444 494 HA TRP 64 HA TRP 64 16.382 -9.996 12.733 495 HB2 TRP 64 HB3 TRP 64 18.170 -12.226 13.717 496 HB3 TRP 64 HB2 TRP 64 16.783 -11.601 14.600 497 HD1 TRP 64 HD1 TRP 64 17.537 -13.354 11.219 498 HE1 TRP 64 HE1 TRP 64 15.496 -14.795 10.596 499 HE3 TRP 64 HE3 TRP 64 14.427 -12.053 15.060 500 HZ2 TRP 64 HZ2 TRP 64 12.912 -15.302 11.596 501 HZ3 TRP 64 HZ3 TRP 64 12.183 -13.056 15.151 502 HH2 TRP 64 HH2 TRP 64 11.443 -14.648 13.454 503 H THR 65 H THR 65 16.844 -9.689 15.288 504 HA THR 65 HA THR 65 18.262 -7.313 15.509 505 HB THR 65 HB THR 65 18.158 -7.888 18.048 506 HG1 THR 65 HG1 THR 65 16.307 -9.508 18.230 507 HG21 THR 65 HG21 THR 65 16.649 -6.330 16.900 508 HG22 THR 65 HG22 THR 65 15.783 -7.294 18.097 509 HG23 THR 65 HG23 THR 65 15.646 -7.684 16.383 510 H ASP 66 H ASP 66 19.202 -10.474 16.880 511 HA ASP 66 HA ASP 66 21.987 -9.862 16.202 512 HB2 ASP 66 HB3 ASP 66 21.789 -9.278 18.597 513 HB3 ASP 66 HB2 ASP 66 21.093 -10.857 18.925 514 H MET 67 H MET 67 22.750 -11.579 15.038 515 HA MET 67 HA MET 67 22.034 -14.190 16.191 516 HB2 MET 67 HB3 MET 67 22.372 -13.516 13.269 517 HB3 MET 67 HB2 MET 67 22.371 -15.165 13.884 518 HG2 MET 67 HG3 MET 67 20.123 -13.182 14.143 519 HG3 MET 67 HG2 MET 67 20.188 -14.539 13.017 520 HE1 MET 67 HE1 MET 67 17.671 -14.993 14.166 521 HE2 MET 67 HE2 MET 67 17.952 -13.732 15.366 522 HE3 MET 67 HE3 MET 67 17.479 -15.352 15.882 523 H ASP 68 H ASP 68 23.923 -13.503 17.460 524 HA ASP 68 HA ASP 68 25.725 -15.589 16.754 525 HB2 ASP 68 HB3 ASP 68 26.825 -13.565 15.666 526 HB3 ASP 68 HB2 ASP 68 27.007 -12.896 17.286 527 H THR 69 H THR 69 24.856 -16.503 18.611 528 HA THR 69 HA THR 69 25.782 -15.540 21.151 529 HB THR 69 HB THR 69 22.798 -15.448 20.576 530 HG1 THR 69 HG1 THR 69 23.705 -13.530 19.855 531 HG21 THR 69 HG21 THR 69 23.228 -16.249 22.835 532 HG22 THR 69 HG22 THR 69 22.588 -14.602 22.868 533 HG23 THR 69 HG23 THR 69 24.310 -14.886 23.123 534 HA PRO 70 HA PRO 70 25.517 -20.004 21.071 535 HB2 PRO 70 HB3 PRO 70 27.086 -20.448 23.228 536 HB3 PRO 70 HB2 PRO 70 27.734 -20.001 21.646 537 HG2 PRO 70 HG3 PRO 70 27.253 -18.287 24.054 538 HG3 PRO 70 HG2 PRO 70 28.638 -18.300 22.945 539 HD2 PRO 70 HD3 PRO 70 26.636 -16.468 22.796 540 HD3 PRO 70 HD2 PRO 70 27.557 -17.011 21.380 541 H SER 71 H SER 71 23.358 -20.326 21.611 542 HA SER 71 HA SER 71 22.633 -20.338 24.428 543 HB2 SER 71 HB3 SER 71 20.407 -21.159 23.466 544 HB3 SER 71 HB2 SER 71 20.898 -19.527 23.014 545 HG SER 71 HG SER 71 21.131 -21.893 21.460 546 H ARG 72 H ARG 72 23.651 -21.981 25.431 547 HA ARG 72 HA ARG 72 23.904 -24.556 24.101 548 HB2 ARG 72 HB3 ARG 72 25.386 -25.138 25.971 549 HB3 ARG 72 HB2 ARG 72 25.880 -23.639 25.195 550 HG2 ARG 72 HG3 ARG 72 24.669 -22.412 27.013 551 HG3 ARG 72 HG2 ARG 72 24.459 -23.964 27.824 552 HD2 ARG 72 HD3 ARG 72 26.384 -22.830 28.733 553 HD3 ARG 72 HD2 ARG 72 26.907 -24.253 27.832 554 HE ARG 72 HE ARG 72 27.483 -22.701 25.986 555 HH11 ARG 72 HH11 ARG 72 27.167 -21.455 29.247 556 HH12 ARG 72 HH12 ARG 72 28.249 -20.119 28.978 557 HH21 ARG 72 HH21 ARG 72 28.888 -20.938 25.624 558 HH22 ARG 72 HH22 ARG 72 29.219 -19.820 26.918 559 H CYS 73 H CYS 73 22.981 -26.429 24.772 560 HA CYS 73 HA CYS 73 20.853 -26.158 26.774 561 HB2 CYS 73 HB3 CYS 73 19.989 -28.290 25.643 562 HB3 CYS 73 HB2 CYS 73 19.855 -26.784 24.747 563 H VAL 74 H VAL 74 21.133 -27.086 28.649 564 HA VAL 74 HA VAL 74 22.686 -29.582 28.766 565 HB VAL 74 HB VAL 74 22.662 -27.529 30.988 566 HG11 VAL 74 HG11 VAL 74 24.535 -28.857 31.859 567 HG12 VAL 74 HG12 VAL 74 24.342 -29.990 30.524 568 HG13 VAL 74 HG13 VAL 74 23.057 -29.807 31.718 569 HG21 VAL 74 HG21 VAL 74 23.816 -26.572 29.064 570 HG22 VAL 74 HG22 VAL 74 24.822 -28.014 28.935 571 HG23 VAL 74 HG23 VAL 74 24.959 -26.965 30.347 572 H ARG 75 H ARG 75 21.259 -28.077 31.553 573 HA ARG 75 HA ARG 75 18.645 -28.942 31.477 574 HB2 ARG 75 HB3 ARG 75 20.378 -31.153 31.705 575 HB3 ARG 75 HB2 ARG 75 19.711 -30.900 33.311 576 HG2 ARG 75 HG3 ARG 75 18.127 -31.268 30.776 577 HG3 ARG 75 HG2 ARG 75 18.368 -32.477 32.040 578 HD2 ARG 75 HD3 ARG 75 16.872 -29.868 32.250 579 HD3 ARG 75 HD2 ARG 75 16.210 -31.501 32.357 580 HE ARG 75 HE ARG 75 18.031 -30.323 34.359 581 HH11 ARG 75 HH11 ARG 75 15.336 -32.396 33.494 582 HH12 ARG 75 HH12 ARG 75 14.999 -32.848 35.141 583 HH21 ARG 75 HH21 ARG 75 17.599 -30.917 36.508 584 HH22 ARG 75 HH22 ARG 75 16.283 -32.006 36.855 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 3.230 -2.299 -4.854 2 H2 GLY 1 HT2 GLY 1 4.017 -2.644 -6.312 3 H3 GLY 1 HT3 GLY 1 3.628 -1.040 -5.921 4 HA2 GLY 1 HA2 GLY 1 5.973 -1.428 -5.579 5 HA3 GLY 1 HA3 GLY 1 5.160 -1.092 -4.056 6 HA PRO 2 HA PRO 2 6.564 -5.716 -4.290 7 HB2 PRO 2 HB3 PRO 2 9.226 -5.443 -5.418 8 HB3 PRO 2 HB2 PRO 2 7.900 -6.479 -5.947 9 HG2 PRO 2 HG3 PRO 2 8.781 -4.347 -7.387 10 HG3 PRO 2 HG2 PRO 2 7.107 -4.928 -7.436 11 HD2 PRO 2 HD3 PRO 2 8.269 -2.613 -5.931 12 HD3 PRO 2 HD2 PRO 2 6.727 -2.729 -6.810 13 H THR 3 H THR 3 6.617 -5.017 -2.087 14 HA THR 3 HA THR 3 9.360 -4.685 -1.071 15 HB THR 3 HB THR 3 6.830 -3.594 0.184 16 HG1 THR 3 HG1 THR 3 7.651 -1.579 -0.468 17 HG21 THR 3 HG21 THR 3 8.514 -4.198 1.849 18 HG22 THR 3 HG22 THR 3 8.370 -2.445 1.722 19 HG23 THR 3 HG23 THR 3 9.732 -3.275 0.969 20 H SER 4 H SER 4 10.022 -6.452 -0.111 21 HA SER 4 HA SER 4 8.058 -8.183 1.220 22 HB2 SER 4 HB3 SER 4 10.889 -8.845 0.363 23 HB3 SER 4 HB2 SER 4 9.678 -9.978 0.963 24 HG SER 4 HG SER 4 8.522 -8.782 -1.022 25 H GLU 5 H GLU 5 7.896 -7.431 3.272 26 HA GLU 5 HA GLU 5 10.345 -6.786 4.737 27 HB2 GLU 5 HB3 GLU 5 7.442 -6.475 5.523 28 HB3 GLU 5 HB2 GLU 5 8.820 -5.908 6.456 29 HG2 GLU 5 HG3 GLU 5 9.337 -4.241 4.900 30 HG3 GLU 5 HG2 GLU 5 8.334 -4.977 3.651 31 H GLY 6 H GLY 6 11.257 -8.715 5.245 32 HA2 GLY 6 HA3 GLY 6 10.015 -10.233 7.335 33 HA3 GLY 6 HA2 GLY 6 10.089 -11.112 5.814 34 H CYS 7 H CYS 7 11.517 -11.144 8.597 35 HA CYS 7 HA CYS 7 14.282 -11.164 7.771 36 HB2 CYS 7 HB3 CYS 7 13.002 -12.343 10.253 37 HB3 CYS 7 HB2 CYS 7 14.724 -12.083 9.994 38 H GLN 8 H GLN 8 15.428 -12.902 7.039 39 HA GLN 8 HA GLN 8 13.889 -15.026 5.935 40 HB2 GLN 8 HB3 GLN 8 15.996 -15.835 5.024 41 HB3 GLN 8 HB2 GLN 8 15.815 -14.110 4.754 42 HG2 GLN 8 HG3 GLN 8 17.418 -13.569 6.362 43 HG3 GLN 8 HG2 GLN 8 17.366 -15.177 7.082 44 HE21 GLN 8 HE21 GLN 8 17.457 -16.610 4.589 45 HE22 GLN 8 HE22 GLN 8 19.059 -16.419 3.960 46 H ILE 9 H ILE 9 14.990 -17.296 6.021 47 HA ILE 9 HA ILE 9 14.760 -18.178 8.780 48 HB ILE 9 HB ILE 9 14.603 -19.523 6.113 49 HG12 ILE 9 HG13 ILE 9 12.878 -19.480 8.589 50 HG13 ILE 9 HG12 ILE 9 12.562 -18.656 7.067 51 HG21 ILE 9 HG21 ILE 9 14.955 -21.031 8.699 52 HG22 ILE 9 HG22 ILE 9 16.138 -20.937 7.394 53 HG23 ILE 9 HG23 ILE 9 14.583 -21.727 7.117 54 HD11 ILE 9 HD11 ILE 9 12.299 -20.801 5.954 55 HD12 ILE 9 HD12 ILE 9 11.184 -20.640 7.313 56 HD13 ILE 9 HD13 ILE 9 12.633 -21.633 7.472 57 H ILE 10 H ILE 10 16.402 -18.772 9.990 58 HA ILE 10 HA ILE 10 19.077 -18.377 9.051 59 HB ILE 10 HB ILE 10 18.141 -19.412 11.736 60 HG12 ILE 10 HG13 ILE 10 18.833 -16.587 10.893 61 HG13 ILE 10 HG12 ILE 10 17.200 -17.186 11.166 62 HG21 ILE 10 HG21 ILE 10 20.771 -18.197 10.897 63 HG22 ILE 10 HG22 ILE 10 20.487 -19.890 11.302 64 HG23 ILE 10 HG23 ILE 10 20.325 -18.648 12.543 65 HD11 ILE 10 HD11 ILE 10 17.994 -15.906 13.063 66 HD12 ILE 10 HD12 ILE 10 19.381 -16.983 13.230 67 HD13 ILE 10 HD13 ILE 10 17.750 -17.595 13.511 68 H HIS 11 H HIS 11 20.660 -19.847 8.740 69 HA HIS 11 HA HIS 11 19.967 -22.415 7.831 70 HB2 HIS 11 HB3 HIS 11 22.043 -20.854 7.350 71 HB3 HIS 11 HB2 HIS 11 22.766 -21.754 8.679 72 HD1 HIS 11 HD1 HIS 11 24.198 -23.561 7.791 73 HD2 HIS 11 HD2 HIS 11 20.807 -22.949 5.456 74 HE1 HIS 11 HE1 HIS 11 24.321 -25.276 5.953 75 HE2 HIS 11 HE2 HIS 11 22.229 -24.936 4.584 76 HA PRO 12 HA PRO 12 19.497 -24.984 11.417 77 HB2 PRO 12 HB3 PRO 12 21.364 -26.726 9.852 78 HB3 PRO 12 HB2 PRO 12 19.882 -27.162 10.710 79 HG2 PRO 12 HG3 PRO 12 19.879 -26.844 8.065 80 HG3 PRO 12 HG2 PRO 12 18.509 -26.301 9.053 81 HD2 PRO 12 HD3 PRO 12 20.590 -24.710 7.667 82 HD3 PRO 12 HD2 PRO 12 18.934 -24.258 8.116 83 HA PRO 13 HA PRO 13 23.378 -24.035 13.479 84 HB2 PRO 13 HB3 PRO 13 22.033 -23.887 15.955 85 HB3 PRO 13 HB2 PRO 13 22.401 -22.541 14.876 86 HG2 PRO 13 HG3 PRO 13 19.845 -23.520 15.504 87 HG3 PRO 13 HG2 PRO 13 20.249 -22.384 14.207 88 HD2 PRO 13 HD3 PRO 13 19.759 -25.319 14.075 89 HD3 PRO 13 HD2 PRO 13 19.412 -24.055 12.876 90 H TRP 14 H TRP 14 23.267 -24.807 16.318 91 HA TRP 14 HA TRP 14 24.418 -27.390 16.119 92 HB2 TRP 14 HB3 TRP 14 25.087 -25.651 17.778 93 HB3 TRP 14 HB2 TRP 14 23.547 -25.875 18.596 94 HD1 TRP 14 HD1 TRP 14 23.640 -27.456 20.597 95 HE1 TRP 14 HE1 TRP 14 25.160 -29.385 21.373 96 HE3 TRP 14 HE3 TRP 14 26.804 -27.650 16.585 97 HZ2 TRP 14 HZ2 TRP 14 27.413 -30.790 20.413 98 HZ3 TRP 14 HZ3 TRP 14 28.616 -29.316 16.592 99 HH2 TRP 14 HH2 TRP 14 28.912 -30.854 18.468 100 H GLU 15 H GLU 15 23.656 -29.018 17.975 101 HA GLU 15 HA GLU 15 21.465 -30.423 17.157 102 HB2 GLU 15 HB3 GLU 15 22.688 -30.251 19.911 103 HB3 GLU 15 HB2 GLU 15 21.528 -31.482 19.425 104 HG2 GLU 15 HG3 GLU 15 24.131 -31.052 17.992 105 HG3 GLU 15 HG2 GLU 15 23.965 -32.130 19.377 106 H GLY 16 H GLY 16 19.535 -29.445 16.864 107 HA2 GLY 16 HA3 GLY 16 17.601 -29.342 18.697 108 HA3 GLY 16 HA2 GLY 16 18.392 -27.792 18.952 109 H GLY 17 H GLY 17 16.808 -26.470 18.252 110 HA2 GLY 17 HA3 GLY 17 16.531 -26.137 15.432 111 HA3 GLY 17 HA2 GLY 17 15.073 -26.817 16.146 112 H ILE 18 H ILE 18 14.265 -24.677 15.235 113 HA ILE 18 HA ILE 18 14.701 -22.580 17.238 114 HB ILE 18 HB ILE 18 14.198 -22.369 14.296 115 HG12 ILE 18 HG13 ILE 18 16.088 -21.089 16.269 116 HG13 ILE 18 HG12 ILE 18 16.484 -22.359 15.113 117 HG21 ILE 18 HG21 ILE 18 13.714 -19.976 14.565 118 HG22 ILE 18 HG22 ILE 18 13.677 -20.185 16.316 119 HG23 ILE 18 HG23 ILE 18 12.467 -20.977 15.308 120 HD11 ILE 18 HD11 ILE 18 15.681 -19.537 14.426 121 HD12 ILE 18 HD12 ILE 18 16.057 -20.813 13.266 122 HD13 ILE 18 HD13 ILE 18 17.311 -20.210 14.350 123 H ARG 19 H ARG 19 13.134 -21.953 18.416 124 HA ARG 19 HA ARG 19 10.514 -23.148 18.129 125 HB2 ARG 19 HB3 ARG 19 11.754 -23.004 20.294 126 HB3 ARG 19 HB2 ARG 19 11.591 -21.259 20.226 127 HG2 ARG 19 HG3 ARG 19 9.896 -22.075 21.680 128 HG3 ARG 19 HG2 ARG 19 9.120 -21.537 20.190 129 HD2 ARG 19 HD3 ARG 19 8.075 -23.563 20.630 130 HD3 ARG 19 HD2 ARG 19 9.315 -23.993 19.453 131 HE ARG 19 HE ARG 19 10.394 -24.324 22.010 132 HH11 ARG 19 HH11 ARG 19 7.973 -25.734 19.928 133 HH12 ARG 19 HH12 ARG 19 7.995 -27.282 20.720 134 HH21 ARG 19 HH21 ARG 19 10.447 -26.365 23.074 135 HH22 ARG 19 HH22 ARG 19 9.398 -27.631 22.510 136 H TYR 20 H TYR 20 9.086 -22.163 16.853 137 HA TYR 20 HA TYR 20 9.338 -19.331 16.309 138 HB2 TYR 20 HB3 TYR 20 7.465 -21.440 15.224 139 HB3 TYR 20 HB2 TYR 20 7.443 -19.752 14.720 140 HD1 TYR 20 HD1 TYR 20 8.896 -22.968 14.176 141 HD2 TYR 20 HD2 TYR 20 9.602 -18.794 13.715 142 HE1 TYR 20 HE1 TYR 20 10.625 -23.451 12.494 143 HE2 TYR 20 HE2 TYR 20 11.334 -19.266 12.035 144 HH TYR 20 HH TYR 20 12.818 -21.107 11.380 145 H ARG 21 H ARG 21 6.796 -18.490 15.932 146 HA ARG 21 HA ARG 21 5.768 -18.453 18.693 147 HB2 ARG 21 HB3 ARG 21 6.649 -16.313 17.787 148 HB3 ARG 21 HB2 ARG 21 5.451 -16.383 16.508 149 HG2 ARG 21 HG3 ARG 21 3.662 -16.161 18.119 150 HG3 ARG 21 HG2 ARG 21 4.824 -16.207 19.448 151 HD2 ARG 21 HD3 ARG 21 5.841 -14.149 18.678 152 HD3 ARG 21 HD2 ARG 21 4.789 -14.123 17.264 153 HE ARG 21 HE ARG 21 3.249 -14.170 19.642 154 HH11 ARG 21 HH11 ARG 21 5.293 -12.031 17.763 155 HH12 ARG 21 HH12 ARG 21 4.445 -10.592 18.231 156 HH21 ARG 21 HH21 ARG 21 2.154 -12.295 20.290 157 HH22 ARG 21 HH22 ARG 21 2.651 -10.739 19.678 158 H GLY 22 H GLY 22 4.938 -18.856 15.318 159 HA2 GLY 22 HA3 GLY 22 2.525 -20.260 16.080 160 HA3 GLY 22 HA2 GLY 22 2.246 -18.767 15.194 161 H LEU 23 H LEU 23 4.562 -21.471 14.909 162 HA LEU 23 HA LEU 23 3.606 -21.929 12.178 163 HB2 LEU 23 HB3 LEU 23 6.478 -21.454 12.969 164 HB3 LEU 23 HB2 LEU 23 6.010 -22.193 11.450 165 HG LEU 23 HG LEU 23 5.248 -19.403 12.321 166 HD11 LEU 23 HD11 LEU 23 6.837 -18.657 10.626 167 HD12 LEU 23 HD12 LEU 23 7.301 -20.330 10.320 168 HD13 LEU 23 HD13 LEU 23 7.640 -19.594 11.886 169 HD21 LEU 23 HD21 LEU 23 3.599 -20.379 10.830 170 HD22 LEU 23 HD22 LEU 23 4.870 -20.851 9.703 171 HD23 LEU 23 HD23 LEU 23 4.531 -19.143 9.986 172 H THR 24 H THR 24 2.901 -23.957 12.271 173 HA THR 24 HA THR 24 4.257 -25.988 13.828 174 HB THR 24 HB THR 24 1.760 -25.898 13.591 175 HG1 THR 24 HG1 THR 24 2.480 -27.859 14.229 176 HG21 THR 24 HG21 THR 24 2.336 -26.801 10.768 177 HG22 THR 24 HG22 THR 24 1.592 -25.275 11.245 178 HG23 THR 24 HG23 THR 24 0.747 -26.796 11.535 179 H ARG 25 H ARG 25 4.432 -28.221 12.466 180 HA ARG 25 HA ARG 25 6.485 -27.775 10.528 181 HB2 ARG 25 HB3 ARG 25 6.652 -30.174 10.380 182 HB3 ARG 25 HB2 ARG 25 6.423 -29.744 12.070 183 HG2 ARG 25 HG3 ARG 25 4.116 -30.398 11.985 184 HG3 ARG 25 HG2 ARG 25 4.216 -30.674 10.246 185 HD2 ARG 25 HD3 ARG 25 4.326 -32.791 11.347 186 HD3 ARG 25 HD2 ARG 25 5.921 -32.432 10.691 187 HE ARG 25 HE ARG 25 6.604 -31.831 12.963 188 HH11 ARG 25 HH11 ARG 25 3.733 -33.791 12.524 189 HH12 ARG 25 HH12 ARG 25 3.754 -34.424 14.149 190 HH21 ARG 25 HH21 ARG 25 6.651 -32.680 15.093 191 HH22 ARG 25 HH22 ARG 25 5.410 -33.785 15.614 192 H ASP 26 H ASP 26 6.099 -29.600 8.542 193 HA ASP 26 HA ASP 26 5.139 -29.950 6.510 194 HB2 ASP 26 HB3 ASP 26 3.019 -30.478 7.463 195 HB3 ASP 26 HB2 ASP 26 2.695 -28.793 7.855 196 H GLN 27 H GLN 27 4.445 -26.818 7.950 197 HA GLN 27 HA GLN 27 4.961 -25.401 5.478 198 HB2 GLN 27 HB3 GLN 27 4.556 -24.433 8.317 199 HB3 GLN 27 HB2 GLN 27 4.724 -23.381 6.919 200 HG2 GLN 27 HG3 GLN 27 2.685 -24.289 5.961 201 HG3 GLN 27 HG2 GLN 27 2.531 -25.405 7.316 202 HE21 GLN 27 HE21 GLN 27 3.413 -23.455 9.274 203 HE22 GLN 27 HE22 GLN 27 2.103 -22.343 9.491 204 H VAL 28 H VAL 28 6.465 -23.271 6.424 205 HA VAL 28 HA VAL 28 8.605 -22.555 6.503 206 HB VAL 28 HB VAL 28 9.893 -23.056 8.438 207 HG11 VAL 28 HG11 VAL 28 6.961 -23.187 9.107 208 HG12 VAL 28 HG12 VAL 28 7.910 -21.729 8.821 209 HG13 VAL 28 HG13 VAL 28 8.248 -22.740 10.226 210 HG21 VAL 28 HG21 VAL 28 9.877 -25.480 8.429 211 HG22 VAL 28 HG22 VAL 28 8.167 -25.494 8.859 212 HG23 VAL 28 HG23 VAL 28 9.357 -24.878 10.004 213 H LYS 29 H LYS 29 8.019 -24.984 4.845 214 HA LYS 29 HA LYS 29 10.480 -26.460 4.776 215 HB2 LYS 29 HB3 LYS 29 9.485 -27.567 2.820 216 HB3 LYS 29 HB2 LYS 29 8.365 -27.524 4.176 217 HG2 LYS 29 HG3 LYS 29 7.395 -25.432 3.074 218 HG3 LYS 29 HG2 LYS 29 8.300 -25.925 1.642 219 HD2 LYS 29 HD3 LYS 29 6.191 -27.532 3.081 220 HD3 LYS 29 HD2 LYS 29 6.023 -26.745 1.511 221 HE2 LYS 29 HE3 LYS 29 7.751 -28.205 0.593 222 HE3 LYS 29 HE2 LYS 29 7.941 -28.978 2.167 223 HZ1 LYS 29 HZ1 LYS 29 6.542 -30.329 0.792 224 HZ2 LYS 29 HZ2 LYS 29 5.516 -29.024 0.449 225 HZ3 LYS 29 HZ3 LYS 29 5.586 -29.656 2.019 226 H ALA 30 H ALA 30 9.295 -23.568 3.439 227 HA ALA 30 HA ALA 30 11.810 -22.928 2.267 228 HB1 ALA 30 HB1 ALA 30 10.908 -24.317 0.477 229 HB2 ALA 30 HB2 ALA 30 11.058 -22.633 -0.026 230 HB3 ALA 30 HB3 ALA 30 9.476 -23.291 0.396 231 H ILE 31 H ILE 31 10.045 -21.850 4.257 232 HA ILE 31 HA ILE 31 8.859 -19.466 3.179 233 HB ILE 31 HB ILE 31 9.491 -20.291 6.020 234 HG12 ILE 31 HG13 ILE 31 6.913 -20.061 4.452 235 HG13 ILE 31 HG12 ILE 31 7.686 -21.552 4.980 236 HG21 ILE 31 HG21 ILE 31 8.035 -17.818 5.087 237 HG22 ILE 31 HG22 ILE 31 9.624 -17.859 5.852 238 HG23 ILE 31 HG23 ILE 31 8.196 -18.354 6.761 239 HD11 ILE 31 HD11 ILE 31 5.786 -21.023 6.374 240 HD12 ILE 31 HD12 ILE 31 6.473 -19.445 6.754 241 HD13 ILE 31 HD13 ILE 31 7.276 -20.913 7.310 242 H ASN 32 H ASN 32 9.758 -17.420 3.094 243 HA ASN 32 HA ASN 32 12.676 -17.400 3.493 244 HB2 ASN 32 HB3 ASN 32 10.987 -16.191 1.310 245 HB3 ASN 32 HB2 ASN 32 12.660 -15.710 1.586 246 HD21 ASN 32 HD21 ASN 32 11.222 -17.160 -0.627 247 HD22 ASN 32 HD22 ASN 32 12.173 -18.577 -0.892 248 H PHE 33 H PHE 33 9.701 -15.734 4.121 249 HA PHE 33 HA PHE 33 11.252 -13.570 5.378 250 HB2 PHE 33 HB3 PHE 33 8.680 -13.130 3.851 251 HB3 PHE 33 HB2 PHE 33 9.724 -11.900 4.559 252 HD1 PHE 33 HD1 PHE 33 8.864 -13.556 1.605 253 HD2 PHE 33 HD2 PHE 33 12.210 -11.943 3.679 254 HE1 PHE 33 HE1 PHE 33 10.097 -13.401 -0.515 255 HE2 PHE 33 HE2 PHE 33 13.451 -11.784 1.562 256 HZ PHE 33 HZ PHE 33 12.393 -12.513 -0.540 257 H LEU 34 H LEU 34 10.927 -13.895 7.488 258 HA LEU 34 HA LEU 34 8.280 -14.534 8.507 259 HB2 LEU 34 HB3 LEU 34 10.961 -14.105 9.815 260 HB3 LEU 34 HB2 LEU 34 9.490 -14.216 10.759 261 HG LEU 34 HG LEU 34 10.539 -16.353 10.809 262 HD11 LEU 34 HD11 LEU 34 8.128 -16.406 10.612 263 HD12 LEU 34 HD12 LEU 34 8.850 -17.789 9.788 264 HD13 LEU 34 HD13 LEU 34 8.255 -16.417 8.852 265 HD21 LEU 34 HD21 LEU 34 10.619 -16.237 7.799 266 HD22 LEU 34 HD22 LEU 34 11.049 -17.638 8.780 267 HD23 LEU 34 HD23 LEU 34 12.003 -16.158 8.890 268 HA PRO 35 HA PRO 35 7.046 -10.312 8.592 269 HB2 PRO 35 HB3 PRO 35 5.048 -10.526 10.461 270 HB3 PRO 35 HB2 PRO 35 4.879 -10.986 8.764 271 HG2 PRO 35 HG3 PRO 35 5.435 -12.707 11.148 272 HG3 PRO 35 HG2 PRO 35 4.353 -13.009 9.776 273 HD2 PRO 35 HD3 PRO 35 6.774 -14.156 9.942 274 HD3 PRO 35 HD2 PRO 35 6.092 -13.643 8.384 275 H VAL 36 H VAL 36 6.893 -8.468 9.939 276 HA VAL 36 HA VAL 36 8.907 -8.239 11.891 277 HB VAL 36 HB VAL 36 8.052 -6.373 10.479 278 HG11 VAL 36 HG11 VAL 36 5.678 -6.821 10.621 279 HG12 VAL 36 HG12 VAL 36 6.025 -5.177 11.161 280 HG13 VAL 36 HG13 VAL 36 5.687 -6.442 12.344 281 HG21 VAL 36 HG21 VAL 36 9.404 -5.874 12.430 282 HG22 VAL 36 HG22 VAL 36 7.961 -5.851 13.445 283 HG23 VAL 36 HG23 VAL 36 8.179 -4.628 12.192 284 H ASP 37 H ASP 37 8.672 -7.663 14.157 285 HA ASP 37 HA ASP 37 7.827 -7.747 16.273 286 HB2 ASP 37 HB3 ASP 37 5.723 -6.819 15.488 287 HB3 ASP 37 HB2 ASP 37 5.201 -8.395 14.911 288 H TYR 38 H TYR 38 8.149 -10.234 14.176 289 HA TYR 38 HA TYR 38 7.216 -12.394 15.845 290 HB2 TYR 38 HB3 TYR 38 7.539 -12.243 13.216 291 HB3 TYR 38 HB2 TYR 38 9.161 -12.800 13.607 292 HD1 TYR 38 HD1 TYR 38 9.467 -15.031 14.686 293 HD2 TYR 38 HD2 TYR 38 5.673 -13.694 13.303 294 HE1 TYR 38 HE1 TYR 38 8.634 -17.344 14.750 295 HE2 TYR 38 HE2 TYR 38 4.826 -16.002 13.364 296 HH TYR 38 HH TYR 38 5.821 -18.324 13.236 297 H GLU 39 H GLU 39 8.315 -13.192 17.527 298 HA GLU 39 HA GLU 39 11.249 -12.935 17.548 299 HB2 GLU 39 HB3 GLU 39 9.341 -13.100 19.887 300 HB3 GLU 39 HB2 GLU 39 11.093 -13.079 20.019 301 HG2 GLU 39 HG3 GLU 39 11.185 -10.855 19.117 302 HG3 GLU 39 HG2 GLU 39 9.452 -10.867 18.803 303 H ILE 40 H ILE 40 12.462 -14.744 18.020 304 HA ILE 40 HA ILE 40 10.963 -17.279 18.163 305 HB ILE 40 HB ILE 40 12.827 -18.327 16.896 306 HG12 ILE 40 HG13 ILE 40 13.680 -15.465 16.408 307 HG13 ILE 40 HG12 ILE 40 14.534 -16.613 17.432 308 HG21 ILE 40 HG21 ILE 40 11.441 -16.075 15.449 309 HG22 ILE 40 HG22 ILE 40 10.748 -17.660 15.792 310 HG23 ILE 40 HG23 ILE 40 12.135 -17.520 14.712 311 HD11 ILE 40 HD11 ILE 40 15.605 -16.401 15.276 312 HD12 ILE 40 HD12 ILE 40 14.108 -16.862 14.464 313 HD13 ILE 40 HD13 ILE 40 14.954 -18.026 15.486 314 H GLU 41 H GLU 41 12.143 -19.081 19.083 315 HA GLU 41 HA GLU 41 14.086 -18.249 21.141 316 HB2 GLU 41 HB3 GLU 41 11.910 -18.782 22.122 317 HB3 GLU 41 HB2 GLU 41 11.905 -20.341 21.312 318 HG2 GLU 41 HG3 GLU 41 13.835 -21.037 22.641 319 HG3 GLU 41 HG2 GLU 41 13.841 -19.470 23.449 320 H TYR 42 H TYR 42 15.719 -19.804 21.677 321 HA TYR 42 HA TYR 42 16.268 -21.679 19.495 322 HB2 TYR 42 HB3 TYR 42 18.023 -20.182 21.397 323 HB3 TYR 42 HB2 TYR 42 18.605 -21.684 20.684 324 HD1 TYR 42 HD1 TYR 42 19.314 -21.779 18.436 325 HD2 TYR 42 HD2 TYR 42 17.416 -18.267 19.900 326 HE1 TYR 42 HE1 TYR 42 19.952 -20.589 16.386 327 HE2 TYR 42 HE2 TYR 42 18.050 -17.065 17.849 328 HH TYR 42 HH TYR 42 19.269 -18.676 15.091 329 H VAL 43 H VAL 43 15.406 -23.595 19.941 330 HA VAL 43 HA VAL 43 15.647 -24.647 22.668 331 HB VAL 43 HB VAL 43 13.952 -26.326 21.988 332 HG11 VAL 43 HG11 VAL 43 13.133 -23.454 21.587 333 HG12 VAL 43 HG12 VAL 43 13.290 -24.284 23.134 334 HG13 VAL 43 HG13 VAL 43 12.052 -24.790 21.984 335 HG21 VAL 43 HG21 VAL 43 14.353 -26.384 19.593 336 HG22 VAL 43 HG22 VAL 43 13.820 -24.710 19.442 337 HG23 VAL 43 HG23 VAL 43 12.671 -25.961 19.917 338 H CYS 44 H CYS 44 16.296 -26.814 23.000 339 HA CYS 44 HA CYS 44 18.312 -27.690 21.055 340 HB2 CYS 44 HB3 CYS 44 18.928 -27.155 23.456 341 HB3 CYS 44 HB2 CYS 44 17.966 -28.541 23.941 342 H ARG 45 H ARG 45 18.608 -30.287 21.399 343 HA ARG 45 HA ARG 45 16.321 -31.426 20.194 344 HB2 ARG 45 HB3 ARG 45 18.830 -32.636 21.339 345 HB3 ARG 45 HB2 ARG 45 17.566 -33.617 20.609 346 HG2 ARG 45 HG3 ARG 45 19.086 -31.413 19.231 347 HG3 ARG 45 HG2 ARG 45 19.377 -33.144 19.038 348 HD2 ARG 45 HD3 ARG 45 17.077 -33.411 18.205 349 HD3 ARG 45 HD2 ARG 45 16.833 -31.674 18.358 350 HE ARG 45 HE ARG 45 19.091 -32.206 16.736 351 HH11 ARG 45 HH11 ARG 45 15.587 -32.234 16.706 352 HH12 ARG 45 HH12 ARG 45 15.482 -32.099 14.975 353 HH21 ARG 45 HH21 ARG 45 18.953 -32.013 14.478 354 HH22 ARG 45 HH22 ARG 45 17.393 -31.994 13.701 355 H GLY 46 H GLY 46 14.464 -31.730 21.228 356 HA2 GLY 46 HA3 GLY 46 13.023 -32.888 22.650 357 HA3 GLY 46 HA2 GLY 46 14.418 -33.445 23.565 358 H GLU 47 H GLU 47 13.499 -32.925 25.560 359 HA GLU 47 HA GLU 47 12.791 -30.145 26.047 360 HB2 GLU 47 HB3 GLU 47 12.155 -30.980 28.320 361 HB3 GLU 47 HB2 GLU 47 11.269 -31.720 26.996 362 HG2 GLU 47 HG3 GLU 47 12.644 -33.712 27.154 363 HG3 GLU 47 HG2 GLU 47 13.609 -32.964 28.429 364 H ARG 48 H ARG 48 15.485 -30.673 25.412 365 HA ARG 48 HA ARG 48 16.938 -30.429 27.922 366 HB2 ARG 48 HB3 ARG 48 17.971 -30.261 25.081 367 HB3 ARG 48 HB2 ARG 48 18.948 -30.385 26.537 368 HG2 ARG 48 HG3 ARG 48 17.048 -32.482 25.511 369 HG3 ARG 48 HG2 ARG 48 18.805 -32.518 25.369 370 HD2 ARG 48 HD3 ARG 48 17.345 -32.395 27.999 371 HD3 ARG 48 HD2 ARG 48 17.845 -33.902 27.234 372 HE ARG 48 HE ARG 48 20.118 -32.353 27.347 373 HH11 ARG 48 HH11 ARG 48 17.809 -33.589 29.685 374 HH12 ARG 48 HH12 ARG 48 18.998 -33.787 30.939 375 HH21 ARG 48 HH21 ARG 48 21.674 -32.586 29.009 376 HH22 ARG 48 HH22 ARG 48 21.181 -33.203 30.564 377 H GLU 49 H GLU 49 16.887 -28.534 28.879 378 HA GLU 49 HA GLU 49 16.004 -26.207 27.464 379 HB2 GLU 49 HB3 GLU 49 16.906 -26.454 30.336 380 HB3 GLU 49 HB2 GLU 49 15.985 -25.129 29.638 381 HG2 GLU 49 HG3 GLU 49 14.121 -26.647 29.210 382 HG3 GLU 49 HG2 GLU 49 15.048 -27.977 29.907 383 H VAL 50 H VAL 50 17.086 -24.307 27.135 384 HA VAL 50 HA VAL 50 20.007 -24.520 27.189 385 HB VAL 50 HB VAL 50 20.019 -22.658 25.588 386 HG11 VAL 50 HG11 VAL 50 18.185 -24.915 24.785 387 HG12 VAL 50 HG12 VAL 50 19.947 -24.917 24.707 388 HG13 VAL 50 HG13 VAL 50 19.022 -23.830 23.672 389 HG21 VAL 50 HG21 VAL 50 17.941 -21.825 24.610 390 HG22 VAL 50 HG22 VAL 50 17.992 -21.519 26.346 391 HG23 VAL 50 HG23 VAL 50 17.009 -22.839 25.713 392 H VAL 51 H VAL 51 21.278 -22.909 28.125 393 HA VAL 51 HA VAL 51 19.788 -20.763 29.480 394 HB VAL 51 HB VAL 51 20.835 -22.106 31.174 395 HG11 VAL 51 HG11 VAL 51 23.250 -22.498 31.266 396 HG12 VAL 51 HG12 VAL 51 23.429 -21.730 29.688 397 HG13 VAL 51 HG13 VAL 51 22.516 -23.232 29.840 398 HG21 VAL 51 HG21 VAL 51 22.301 -20.466 32.257 399 HG22 VAL 51 HG22 VAL 51 20.868 -19.710 31.560 400 HG23 VAL 51 HG23 VAL 51 22.422 -19.580 30.736 401 H GLY 52 H GLY 52 19.794 -19.305 27.911 402 HA2 GLY 52 HA3 GLY 52 22.299 -17.936 27.373 403 HA3 GLY 52 HA2 GLY 52 21.505 -18.627 25.963 404 HA PRO 53 HA PRO 53 19.384 -14.563 26.795 405 HB2 PRO 53 HB3 PRO 53 20.612 -13.010 24.936 406 HB3 PRO 53 HB2 PRO 53 21.131 -13.077 26.622 407 HG2 PRO 53 HG3 PRO 53 22.343 -14.326 24.219 408 HG3 PRO 53 HG2 PRO 53 23.122 -13.726 25.690 409 HD2 PRO 53 HD3 PRO 53 22.595 -16.396 25.099 410 HD3 PRO 53 HD2 PRO 53 22.967 -15.745 26.708 411 H LYS 54 H LYS 54 18.028 -16.316 25.808 412 HA LYS 54 HA LYS 54 18.107 -16.641 22.950 413 HB2 LYS 54 HB3 LYS 54 16.069 -18.107 23.395 414 HB3 LYS 54 HB2 LYS 54 17.583 -18.615 24.127 415 HG2 LYS 54 HG3 LYS 54 16.904 -17.862 26.265 416 HG3 LYS 54 HG2 LYS 54 15.506 -17.019 25.599 417 HD2 LYS 54 HD3 LYS 54 14.566 -19.195 24.907 418 HD3 LYS 54 HD2 LYS 54 15.941 -20.005 25.661 419 HE2 LYS 54 HE3 LYS 54 15.313 -19.126 27.826 420 HE3 LYS 54 HE2 LYS 54 13.997 -18.202 27.101 421 HZ1 LYS 54 HZ1 LYS 54 13.010 -20.333 26.392 422 HZ2 LYS 54 HZ2 LYS 54 13.116 -20.174 28.080 423 HZ3 LYS 54 HZ3 LYS 54 14.226 -21.158 27.255 424 H VAL 55 H VAL 55 17.639 -14.572 22.166 425 HA VAL 55 HA VAL 55 14.810 -14.240 21.772 426 HB VAL 55 HB VAL 55 15.074 -12.911 23.789 427 HG11 VAL 55 HG11 VAL 55 16.504 -10.924 23.846 428 HG12 VAL 55 HG12 VAL 55 17.158 -11.356 22.266 429 HG13 VAL 55 HG13 VAL 55 17.441 -12.405 23.656 430 HG21 VAL 55 HG21 VAL 55 14.228 -10.768 22.960 431 HG22 VAL 55 HG22 VAL 55 13.488 -12.138 22.131 432 HG23 VAL 55 HG23 VAL 55 14.752 -11.198 21.333 433 H ARG 56 H ARG 56 14.448 -13.731 19.768 434 HA ARG 56 HA ARG 56 16.356 -12.072 18.288 435 HB2 ARG 56 HB3 ARG 56 15.174 -14.685 17.324 436 HB3 ARG 56 HB2 ARG 56 16.030 -13.546 16.295 437 HG2 ARG 56 HG3 ARG 56 17.256 -14.861 18.707 438 HG3 ARG 56 HG2 ARG 56 17.368 -15.510 17.070 439 HD2 ARG 56 HD3 ARG 56 18.491 -13.497 16.322 440 HD3 ARG 56 HD2 ARG 56 18.311 -12.777 17.921 441 HE ARG 56 HE ARG 56 20.023 -14.115 18.711 442 HH11 ARG 56 HH11 ARG 56 19.211 -15.024 15.426 443 HH12 ARG 56 HH12 ARG 56 20.646 -15.978 15.202 444 HH21 ARG 56 HH21 ARG 56 21.911 -15.327 18.409 445 HH22 ARG 56 HH22 ARG 56 22.186 -16.146 16.894 446 H LYS 57 H LYS 57 15.101 -10.318 18.025 447 HA LYS 57 HA LYS 57 12.294 -10.689 17.298 448 HB2 LYS 57 HB3 LYS 57 12.831 -9.132 19.142 449 HB3 LYS 57 HB2 LYS 57 13.794 -8.168 18.034 450 HG2 LYS 57 HG3 LYS 57 11.802 -7.654 16.729 451 HG3 LYS 57 HG2 LYS 57 10.826 -8.640 17.818 452 HD2 LYS 57 HD3 LYS 57 12.401 -6.189 18.610 453 HD3 LYS 57 HD2 LYS 57 10.660 -6.240 18.335 454 HE2 LYS 57 HE3 LYS 57 10.380 -7.795 20.168 455 HE3 LYS 57 HE2 LYS 57 12.125 -7.871 20.407 456 HZ1 LYS 57 HZ1 LYS 57 12.071 -5.475 20.926 457 HZ2 LYS 57 HZ2 LYS 57 11.167 -6.408 22.016 458 HZ3 LYS 57 HZ3 LYS 57 10.376 -5.503 20.820 459 H CYS 58 H CYS 58 11.476 -10.106 15.360 460 HA CYS 58 HA CYS 58 13.381 -9.293 13.296 461 HB2 CYS 58 HB3 CYS 58 11.973 -11.274 12.858 462 HB3 CYS 58 HB2 CYS 58 10.530 -10.280 13.035 463 H LEU 59 H LEU 59 13.394 -7.326 12.469 464 HA LEU 59 HA LEU 59 11.215 -5.475 13.159 465 HB2 LEU 59 HB3 LEU 59 14.105 -4.929 12.492 466 HB3 LEU 59 HB2 LEU 59 12.891 -3.676 12.645 467 HG LEU 59 HG LEU 59 13.969 -5.470 14.811 468 HD11 LEU 59 HD11 LEU 59 13.906 -2.475 14.480 469 HD12 LEU 59 HD12 LEU 59 15.310 -3.514 14.236 470 HD13 LEU 59 HD13 LEU 59 14.598 -3.357 15.842 471 HD21 LEU 59 HD21 LEU 59 11.543 -5.286 15.079 472 HD22 LEU 59 HD22 LEU 59 11.667 -3.530 14.991 473 HD23 LEU 59 HD23 LEU 59 12.404 -4.398 16.335 474 H ALA 60 H ALA 60 11.373 -3.517 11.425 475 HA ALA 60 HA ALA 60 10.267 -4.420 9.042 476 HB1 ALA 60 HB1 ALA 60 11.750 -1.829 9.490 477 HB2 ALA 60 HB2 ALA 60 10.052 -2.119 9.867 478 HB3 ALA 60 HB3 ALA 60 10.602 -2.162 8.193 479 H ASN 61 H ASN 61 13.630 -3.776 9.857 480 HA ASN 61 HA ASN 61 14.537 -4.449 7.193 481 HB2 ASN 61 HB3 ASN 61 16.791 -4.136 8.055 482 HB3 ASN 61 HB2 ASN 61 15.779 -2.790 8.562 483 HD21 ASN 61 HD21 ASN 61 17.658 -5.491 9.572 484 HD22 ASN 61 HD22 ASN 61 17.533 -5.212 11.273 485 H GLY 62 H GLY 62 15.558 -6.364 6.598 486 HA2 GLY 62 HA3 GLY 62 14.428 -8.630 7.972 487 HA3 GLY 62 HA2 GLY 62 15.307 -8.660 6.455 488 H SER 63 H SER 63 15.924 -8.029 9.905 489 HA SER 63 HA SER 63 17.848 -10.185 9.954 490 HB2 SER 63 HB3 SER 63 18.752 -7.380 10.677 491 HB3 SER 63 HB2 SER 63 19.706 -8.859 10.829 492 HG SER 63 HG SER 63 18.701 -8.518 8.314 493 H TRP 64 H TRP 64 17.981 -11.087 11.953 494 HA TRP 64 HA TRP 64 16.106 -10.248 13.934 495 HB2 TRP 64 HB3 TRP 64 18.321 -12.304 14.173 496 HB3 TRP 64 HB2 TRP 64 16.913 -12.151 15.221 497 HD1 TRP 64 HD1 TRP 64 18.011 -13.588 11.890 498 HE1 TRP 64 HE1 TRP 64 16.075 -14.949 10.862 499 HE3 TRP 64 HE3 TRP 64 14.268 -12.238 15.105 500 HZ2 TRP 64 HZ2 TRP 64 13.327 -15.388 11.357 501 HZ3 TRP 64 HZ3 TRP 64 12.020 -13.171 14.753 502 HH2 TRP 64 HH2 TRP 64 11.560 -14.711 12.923 503 H THR 65 H THR 65 16.448 -9.037 15.739 504 HA THR 65 HA THR 65 18.556 -7.167 15.468 505 HB THR 65 HB THR 65 17.520 -6.249 17.647 506 HG1 THR 65 HG1 THR 65 16.437 -8.202 18.241 507 HG21 THR 65 HG21 THR 65 15.640 -5.320 16.386 508 HG22 THR 65 HG22 THR 65 15.866 -6.547 15.140 509 HG23 THR 65 HG23 THR 65 17.114 -5.331 15.416 510 H ASP 66 H ASP 66 19.163 -10.051 16.639 511 HA ASP 66 HA ASP 66 21.329 -9.065 18.258 512 HB2 ASP 66 HB3 ASP 66 19.133 -9.520 19.754 513 HB3 ASP 66 HB2 ASP 66 19.752 -11.161 19.673 514 H MET 67 H MET 67 21.407 -10.342 15.822 515 HA MET 67 HA MET 67 21.419 -13.203 16.291 516 HB2 MET 67 HB3 MET 67 20.445 -12.363 14.235 517 HB3 MET 67 HB2 MET 67 21.949 -11.566 13.809 518 HG2 MET 67 HG3 MET 67 23.025 -13.608 13.371 519 HG3 MET 67 HG2 MET 67 21.734 -14.542 14.128 520 HE1 MET 67 HE1 MET 67 21.656 -16.146 12.006 521 HE2 MET 67 HE2 MET 67 22.953 -15.215 11.259 522 HE3 MET 67 HE3 MET 67 21.485 -15.566 10.348 523 H ASP 68 H ASP 68 23.159 -12.827 17.907 524 HA ASP 68 HA ASP 68 25.143 -14.514 16.837 525 HB2 ASP 68 HB3 ASP 68 26.226 -12.286 16.343 526 HB3 ASP 68 HB2 ASP 68 26.225 -11.966 18.075 527 H THR 69 H THR 69 24.335 -15.978 18.380 528 HA THR 69 HA THR 69 24.402 -15.001 21.159 529 HB THR 69 HB THR 69 22.194 -16.754 20.085 530 HG1 THR 69 HG1 THR 69 22.181 -13.924 20.515 531 HG21 THR 69 HG21 THR 69 22.561 -16.793 22.523 532 HG22 THR 69 HG22 THR 69 21.020 -16.045 22.097 533 HG23 THR 69 HG23 THR 69 22.391 -15.038 22.557 534 HA PRO 70 HA PRO 70 26.518 -18.959 21.712 535 HB2 PRO 70 HB3 PRO 70 27.210 -17.854 24.318 536 HB3 PRO 70 HB2 PRO 70 28.278 -18.298 22.986 537 HG2 PRO 70 HG3 PRO 70 27.862 -15.726 23.756 538 HG3 PRO 70 HG2 PRO 70 28.256 -16.186 22.091 539 HD2 PRO 70 HD3 PRO 70 25.599 -15.504 23.294 540 HD3 PRO 70 HD2 PRO 70 26.270 -15.051 21.711 541 H SER 71 H SER 71 25.154 -20.557 22.244 542 HA SER 71 HA SER 71 23.648 -20.341 24.749 543 HB2 SER 71 HB3 SER 71 21.702 -21.434 23.435 544 HB3 SER 71 HB2 SER 71 21.985 -19.706 23.222 545 HG SER 71 HG SER 71 23.043 -20.156 21.286 546 H ARG 72 H ARG 72 23.210 -22.290 25.773 547 HA ARG 72 HA ARG 72 24.231 -24.741 24.545 548 HB2 ARG 72 HB3 ARG 72 25.512 -25.310 26.564 549 HB3 ARG 72 HB2 ARG 72 26.116 -23.832 25.829 550 HG2 ARG 72 HG3 ARG 72 24.828 -22.530 27.497 551 HG3 ARG 72 HG2 ARG 72 24.360 -24.044 28.268 552 HD2 ARG 72 HD3 ARG 72 26.217 -23.136 29.472 553 HD3 ARG 72 HD2 ARG 72 26.777 -24.552 28.584 554 HE ARG 72 HE ARG 72 27.317 -22.491 26.899 555 HH11 ARG 72 HH11 ARG 72 28.055 -23.053 30.282 556 HH12 ARG 72 HH12 ARG 72 29.583 -22.219 30.214 557 HH21 ARG 72 HH21 ARG 72 29.290 -21.382 26.815 558 HH22 ARG 72 HH22 ARG 72 30.297 -21.275 28.232 559 H CYS 73 H CYS 73 23.019 -26.511 25.053 560 HA CYS 73 HA CYS 73 20.845 -26.083 26.949 561 HB2 CYS 73 HB3 CYS 73 20.130 -28.409 25.941 562 HB3 CYS 73 HB2 CYS 73 19.817 -26.907 25.085 563 H VAL 74 H VAL 74 21.555 -26.411 28.905 564 HA VAL 74 HA VAL 74 22.519 -29.097 29.574 565 HB VAL 74 HB VAL 74 24.468 -27.626 29.675 566 HG11 VAL 74 HG11 VAL 74 22.859 -25.950 31.595 567 HG12 VAL 74 HG12 VAL 74 23.367 -25.488 29.971 568 HG13 VAL 74 HG13 VAL 74 24.572 -25.734 31.235 569 HG21 VAL 74 HG21 VAL 74 24.320 -29.404 31.324 570 HG22 VAL 74 HG22 VAL 74 23.457 -28.332 32.426 571 HG23 VAL 74 HG23 VAL 74 25.135 -27.993 32.001 572 H ARG 75 H ARG 75 21.518 -29.973 31.368 573 HA ARG 75 HA ARG 75 19.497 -28.254 32.635 574 HB2 ARG 75 HB3 ARG 75 18.672 -29.791 30.735 575 HB3 ARG 75 HB2 ARG 75 18.931 -31.105 31.875 576 HG2 ARG 75 HG3 ARG 75 17.355 -30.140 33.417 577 HG3 ARG 75 HG2 ARG 75 17.157 -28.728 32.373 578 HD2 ARG 75 HD3 ARG 75 16.398 -30.318 30.574 579 HD3 ARG 75 HD2 ARG 75 16.359 -31.575 31.810 580 HE ARG 75 HE ARG 75 14.855 -29.228 32.519 581 HH11 ARG 75 HH11 ARG 75 14.768 -32.247 30.756 582 HH12 ARG 75 HH12 ARG 75 13.040 -32.414 30.846 583 HH21 ARG 75 HH21 ARG 75 12.571 -29.424 32.643 584 HH22 ARG 75 HH22 ARG 75 11.786 -30.791 31.899 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 5.119 2.467 -3.498 2 H2 GLY 1 HT2 GLY 1 5.214 2.242 -5.177 3 H3 GLY 1 HT3 GLY 1 6.622 2.213 -4.237 4 HA2 GLY 1 HA2 GLY 1 4.419 0.233 -4.150 5 HA3 GLY 1 HA3 GLY 1 6.019 -0.021 -4.836 6 HA PRO 2 HA PRO 2 5.776 -0.579 -0.043 7 HB2 PRO 2 HB3 PRO 2 4.853 -3.336 -0.349 8 HB3 PRO 2 HB2 PRO 2 4.198 -2.047 0.663 9 HG2 PRO 2 HG3 PRO 2 2.898 -2.986 -1.511 10 HG3 PRO 2 HG2 PRO 2 2.773 -1.300 -0.976 11 HD2 PRO 2 HD3 PRO 2 4.420 -2.469 -3.189 12 HD3 PRO 2 HD2 PRO 2 3.491 -0.955 -3.153 13 H THR 3 H THR 3 7.643 -1.216 0.829 14 HA THR 3 HA THR 3 9.512 -2.744 -0.719 15 HB THR 3 HB THR 3 10.828 -2.483 1.556 16 HG1 THR 3 HG1 THR 3 9.206 -1.706 2.872 17 HG21 THR 3 HG21 THR 3 10.179 -0.127 -0.220 18 HG22 THR 3 HG22 THR 3 11.390 -1.363 -0.553 19 HG23 THR 3 HG23 THR 3 11.594 -0.281 0.822 20 H SER 4 H SER 4 10.097 -4.853 -0.443 21 HA SER 4 HA SER 4 8.481 -6.498 1.267 22 HB2 SER 4 HB3 SER 4 10.872 -7.221 -0.451 23 HB3 SER 4 HB2 SER 4 9.776 -8.369 0.320 24 HG SER 4 HG SER 4 8.083 -7.535 -0.942 25 H GLU 5 H GLU 5 8.854 -6.216 3.359 26 HA GLU 5 HA GLU 5 11.643 -6.337 4.304 27 HB2 GLU 5 HB3 GLU 5 9.295 -4.845 5.494 28 HB3 GLU 5 HB2 GLU 5 10.891 -4.964 6.225 29 HG2 GLU 5 HG3 GLU 5 11.875 -3.631 4.591 30 HG3 GLU 5 HG2 GLU 5 10.533 -3.857 3.469 31 H GLY 6 H GLY 6 11.824 -8.431 4.852 32 HA2 GLY 6 HA3 GLY 6 10.412 -9.304 7.204 33 HA3 GLY 6 HA2 GLY 6 10.024 -10.236 5.764 34 H CYS 7 H CYS 7 11.479 -10.944 8.278 35 HA CYS 7 HA CYS 7 14.208 -11.364 7.443 36 HB2 CYS 7 HB3 CYS 7 12.733 -12.492 9.826 37 HB3 CYS 7 HB2 CYS 7 14.477 -12.459 9.603 38 H GLN 8 H GLN 8 15.021 -13.140 6.498 39 HA GLN 8 HA GLN 8 13.207 -15.180 5.598 40 HB2 GLN 8 HB3 GLN 8 15.203 -16.123 4.478 41 HB3 GLN 8 HB2 GLN 8 14.886 -14.452 4.049 42 HG2 GLN 8 HG3 GLN 8 16.701 -13.671 5.310 43 HG3 GLN 8 HG2 GLN 8 16.854 -15.194 6.184 44 HE21 GLN 8 HE21 GLN 8 16.623 -16.891 3.868 45 HE22 GLN 8 HE22 GLN 8 18.087 -16.721 2.977 46 H ILE 9 H ILE 9 14.409 -17.486 5.576 47 HA ILE 9 HA ILE 9 14.466 -18.313 8.349 48 HB ILE 9 HB ILE 9 14.664 -19.896 5.775 49 HG12 ILE 9 HG13 ILE 9 12.395 -19.592 7.756 50 HG13 ILE 9 HG12 ILE 9 12.470 -18.855 6.159 51 HG21 ILE 9 HG21 ILE 9 14.346 -21.898 7.144 52 HG22 ILE 9 HG22 ILE 9 14.422 -20.914 8.605 53 HG23 ILE 9 HG23 ILE 9 15.838 -21.056 7.562 54 HD11 ILE 9 HD11 ILE 9 12.464 -21.079 5.144 55 HD12 ILE 9 HD12 ILE 9 11.038 -20.806 6.146 56 HD13 ILE 9 HD13 ILE 9 12.363 -21.802 6.749 57 H ILE 10 H ILE 10 16.248 -19.128 9.403 58 HA ILE 10 HA ILE 10 18.752 -18.092 8.319 59 HB ILE 10 HB ILE 10 18.263 -19.054 11.130 60 HG12 ILE 10 HG13 ILE 10 17.898 -16.225 10.131 61 HG13 ILE 10 HG12 ILE 10 16.563 -17.344 10.392 62 HG21 ILE 10 HG21 ILE 10 20.198 -17.043 9.981 63 HG22 ILE 10 HG22 ILE 10 20.595 -18.687 10.482 64 HG23 ILE 10 HG23 ILE 10 20.069 -17.502 11.679 65 HD11 ILE 10 HD11 ILE 10 16.864 -15.813 12.259 66 HD12 ILE 10 HD12 ILE 10 18.502 -16.423 12.493 67 HD13 ILE 10 HD13 ILE 10 17.119 -17.489 12.740 68 H HIS 11 H HIS 11 20.640 -19.288 8.198 69 HA HIS 11 HA HIS 11 20.577 -22.077 7.899 70 HB2 HIS 11 HB3 HIS 11 23.001 -21.981 7.835 71 HB3 HIS 11 HB2 HIS 11 22.358 -20.596 6.964 72 HD1 HIS 11 HD1 HIS 11 24.681 -21.505 9.628 73 HD2 HIS 11 HD2 HIS 11 22.524 -18.116 8.528 74 HE1 HIS 11 HE1 HIS 11 25.754 -19.584 10.848 75 HE2 HIS 11 HE2 HIS 11 24.343 -17.571 10.289 76 HA PRO 12 HA PRO 12 20.474 -23.395 12.138 77 HB2 PRO 12 HB3 PRO 12 21.400 -25.937 11.770 78 HB3 PRO 12 HB2 PRO 12 19.747 -25.439 11.390 79 HG2 PRO 12 HG3 PRO 12 22.097 -25.761 9.564 80 HG3 PRO 12 HG2 PRO 12 20.411 -26.251 9.315 81 HD2 PRO 12 HD3 PRO 12 21.436 -24.019 8.205 82 HD3 PRO 12 HD2 PRO 12 19.745 -24.116 8.739 83 HA PRO 13 HA PRO 13 24.821 -22.680 13.128 84 HB2 PRO 13 HB3 PRO 13 23.926 -22.191 15.837 85 HB3 PRO 13 HB2 PRO 13 24.547 -21.034 14.660 86 HG2 PRO 13 HG3 PRO 13 21.957 -21.071 15.541 87 HG3 PRO 13 HG2 PRO 13 22.456 -20.430 13.966 88 HD2 PRO 13 HD3 PRO 13 21.236 -23.082 14.636 89 HD3 PRO 13 HD2 PRO 13 20.929 -22.015 13.248 90 H TRP 14 H TRP 14 24.877 -23.230 16.211 91 HA TRP 14 HA TRP 14 25.869 -25.868 16.120 92 HB2 TRP 14 HB3 TRP 14 26.427 -24.082 17.835 93 HB3 TRP 14 HB2 TRP 14 24.866 -24.411 18.579 94 HD1 TRP 14 HD1 TRP 14 25.149 -25.891 20.642 95 HE1 TRP 14 HE1 TRP 14 26.674 -27.852 21.332 96 HE3 TRP 14 HE3 TRP 14 27.984 -26.235 16.393 97 HZ2 TRP 14 HZ2 TRP 14 28.789 -29.347 20.206 98 HZ3 TRP 14 HZ3 TRP 14 29.735 -27.963 16.282 99 HH2 TRP 14 HH2 TRP 14 30.126 -29.484 18.152 100 H GLU 15 H GLU 15 24.867 -27.543 17.822 101 HA GLU 15 HA GLU 15 22.440 -28.365 16.615 102 HB2 GLU 15 HB3 GLU 15 24.106 -29.465 18.849 103 HB3 GLU 15 HB2 GLU 15 22.531 -30.154 18.484 104 HG2 GLU 15 HG3 GLU 15 24.278 -31.411 17.397 105 HG3 GLU 15 HG2 GLU 15 23.258 -30.616 16.201 106 H GLY 16 H GLY 16 21.238 -26.422 17.131 107 HA2 GLY 16 HA3 GLY 16 19.532 -27.024 19.437 108 HA3 GLY 16 HA2 GLY 16 20.113 -25.371 19.218 109 H GLY 17 H GLY 17 17.357 -26.182 19.150 110 HA2 GLY 17 HA3 GLY 17 16.766 -25.929 16.271 111 HA3 GLY 17 HA2 GLY 17 15.662 -26.588 17.471 112 H ILE 18 H ILE 18 14.316 -24.950 16.222 113 HA ILE 18 HA ILE 18 14.381 -22.458 17.757 114 HB ILE 18 HB ILE 18 13.997 -22.709 14.777 115 HG12 ILE 18 HG13 ILE 18 15.845 -21.103 16.545 116 HG13 ILE 18 HG12 ILE 18 16.291 -22.459 15.516 117 HG21 ILE 18 HG21 ILE 18 13.343 -20.353 16.544 118 HG22 ILE 18 HG22 ILE 18 12.203 -21.302 15.591 119 HG23 ILE 18 HG23 ILE 18 13.414 -20.307 14.783 120 HD11 ILE 18 HD11 ILE 18 15.784 -21.163 13.530 121 HD12 ILE 18 HD12 ILE 18 16.952 -20.315 14.544 122 HD13 ILE 18 HD13 ILE 18 15.265 -19.804 14.530 123 H ARG 19 H ARG 19 12.529 -21.899 18.616 124 HA ARG 19 HA ARG 19 10.157 -23.476 17.877 125 HB2 ARG 19 HB3 ARG 19 11.447 -23.305 20.301 126 HB3 ARG 19 HB2 ARG 19 10.135 -22.143 20.481 127 HG2 ARG 19 HG3 ARG 19 9.470 -24.344 21.284 128 HG3 ARG 19 HG2 ARG 19 8.507 -23.855 19.886 129 HD2 ARG 19 HD3 ARG 19 10.044 -25.186 18.446 130 HD3 ARG 19 HD2 ARG 19 10.839 -25.767 19.907 131 HE ARG 19 HE ARG 19 8.532 -26.657 20.506 132 HH11 ARG 19 HH11 ARG 19 9.691 -26.302 17.228 133 HH12 ARG 19 HH12 ARG 19 8.684 -27.559 16.577 134 HH21 ARG 19 HH21 ARG 19 7.186 -28.320 19.668 135 HH22 ARG 19 HH22 ARG 19 7.262 -28.718 17.972 136 H TYR 20 H TYR 20 8.532 -22.358 17.013 137 HA TYR 20 HA TYR 20 8.841 -19.471 16.852 138 HB2 TYR 20 HB3 TYR 20 6.890 -21.333 15.477 139 HB3 TYR 20 HB2 TYR 20 7.066 -19.612 15.142 140 HD1 TYR 20 HD1 TYR 20 8.669 -22.914 14.827 141 HD2 TYR 20 HD2 TYR 20 8.889 -18.791 13.804 142 HE1 TYR 20 HE1 TYR 20 10.411 -23.425 13.168 143 HE2 TYR 20 HE2 TYR 20 10.630 -19.290 12.142 144 HH TYR 20 HH TYR 20 12.306 -21.018 11.698 145 H ARG 21 H ARG 21 6.335 -18.536 16.577 146 HA ARG 21 HA ARG 21 5.425 -18.653 19.334 147 HB2 ARG 21 HB3 ARG 21 5.792 -16.461 18.255 148 HB3 ARG 21 HB2 ARG 21 4.553 -16.844 17.068 149 HG2 ARG 21 HG3 ARG 21 2.907 -17.006 18.912 150 HG3 ARG 21 HG2 ARG 21 4.165 -16.480 20.031 151 HD2 ARG 21 HD3 ARG 21 3.318 -14.902 17.615 152 HD3 ARG 21 HD2 ARG 21 2.606 -14.683 19.211 153 HE ARG 21 HE ARG 21 5.172 -14.329 19.789 154 HH11 ARG 21 HH11 ARG 21 3.370 -13.172 17.015 155 HH12 ARG 21 HH12 ARG 21 4.211 -11.651 16.944 156 HH21 ARG 21 HH21 ARG 21 6.273 -12.308 19.708 157 HH22 ARG 21 HH22 ARG 21 5.855 -11.163 18.463 158 H GLY 22 H GLY 22 4.015 -18.960 16.074 159 HA2 GLY 22 HA3 GLY 22 1.959 -20.717 17.244 160 HA3 GLY 22 HA2 GLY 22 1.478 -19.373 16.222 161 H LEU 23 H LEU 23 4.420 -20.788 15.274 162 HA LEU 23 HA LEU 23 3.096 -21.912 12.940 163 HB2 LEU 23 HB3 LEU 23 5.997 -21.391 13.573 164 HB3 LEU 23 HB2 LEU 23 5.473 -22.226 12.125 165 HG LEU 23 HG LEU 23 4.727 -19.395 12.857 166 HD11 LEU 23 HD11 LEU 23 7.087 -19.597 12.303 167 HD12 LEU 23 HD12 LEU 23 6.210 -18.755 11.023 168 HD13 LEU 23 HD13 LEU 23 6.675 -20.444 10.813 169 HD21 LEU 23 HD21 LEU 23 3.014 -20.515 11.539 170 HD22 LEU 23 HD22 LEU 23 4.227 -20.993 10.352 171 HD23 LEU 23 HD23 LEU 23 3.842 -19.286 10.584 172 H THR 24 H THR 24 2.792 -23.982 12.598 173 HA THR 24 HA THR 24 3.961 -25.904 14.476 174 HB THR 24 HB THR 24 1.479 -25.830 14.293 175 HG1 THR 24 HG1 THR 24 1.295 -28.012 14.376 176 HG21 THR 24 HG21 THR 24 1.974 -26.800 11.477 177 HG22 THR 24 HG22 THR 24 1.276 -25.248 11.938 178 HG23 THR 24 HG23 THR 24 0.403 -26.743 12.279 179 H ARG 25 H ARG 25 3.964 -28.215 13.194 180 HA ARG 25 HA ARG 25 6.253 -28.012 11.519 181 HB2 ARG 25 HB3 ARG 25 4.478 -30.366 12.194 182 HB3 ARG 25 HB2 ARG 25 6.018 -30.484 11.348 183 HG2 ARG 25 HG3 ARG 25 7.235 -29.810 13.240 184 HG3 ARG 25 HG2 ARG 25 5.787 -29.227 14.063 185 HD2 ARG 25 HD3 ARG 25 6.489 -31.313 15.040 186 HD3 ARG 25 HD2 ARG 25 4.964 -31.547 14.189 187 HE ARG 25 HE ARG 25 7.469 -32.225 12.820 188 HH11 ARG 25 HH11 ARG 25 4.473 -33.228 14.324 189 HH12 ARG 25 HH12 ARG 25 4.569 -34.860 13.734 190 HH21 ARG 25 HH21 ARG 25 7.625 -34.394 12.075 191 HH22 ARG 25 HH22 ARG 25 6.381 -35.537 12.494 192 H ASP 26 H ASP 26 6.001 -29.870 9.564 193 HA ASP 26 HA ASP 26 5.483 -30.090 7.363 194 HB2 ASP 26 HB3 ASP 26 3.163 -30.486 7.956 195 HB3 ASP 26 HB2 ASP 26 2.874 -28.757 8.133 196 H GLN 27 H GLN 27 4.732 -26.970 8.741 197 HA GLN 27 HA GLN 27 5.492 -25.520 6.355 198 HB2 GLN 27 HB3 GLN 27 4.824 -24.542 9.136 199 HB3 GLN 27 HB2 GLN 27 4.965 -23.543 7.698 200 HG2 GLN 27 HG3 GLN 27 3.032 -24.559 6.721 201 HG3 GLN 27 HG2 GLN 27 2.944 -25.746 8.021 202 HE21 GLN 27 HE21 GLN 27 3.553 -23.844 10.113 203 HE22 GLN 27 HE22 GLN 27 2.142 -22.861 10.317 204 H VAL 28 H VAL 28 6.746 -23.348 7.548 205 HA VAL 28 HA VAL 28 8.761 -22.471 7.983 206 HB VAL 28 HB VAL 28 9.834 -22.996 10.001 207 HG11 VAL 28 HG11 VAL 28 7.995 -23.159 11.600 208 HG12 VAL 28 HG12 VAL 28 6.921 -23.691 10.306 209 HG13 VAL 28 HG13 VAL 28 7.613 -22.069 10.267 210 HG21 VAL 28 HG21 VAL 28 10.249 -25.362 9.731 211 HG22 VAL 28 HG22 VAL 28 8.532 -25.714 9.935 212 HG23 VAL 28 HG23 VAL 28 9.465 -25.065 11.283 213 H LYS 29 H LYS 29 8.610 -25.107 6.233 214 HA LYS 29 HA LYS 29 11.486 -25.586 6.128 215 HB2 LYS 29 HB3 LYS 29 10.943 -27.396 4.566 216 HB3 LYS 29 HB2 LYS 29 10.038 -27.551 6.063 217 HG2 LYS 29 HG3 LYS 29 8.066 -26.595 4.954 218 HG3 LYS 29 HG2 LYS 29 8.980 -26.507 3.446 219 HD2 LYS 29 HD3 LYS 29 9.298 -28.950 3.524 220 HD3 LYS 29 HD2 LYS 29 8.335 -29.014 5.002 221 HE2 LYS 29 HE3 LYS 29 6.416 -28.090 3.765 222 HE3 LYS 29 HE2 LYS 29 7.387 -28.077 2.294 223 HZ1 LYS 29 HZ1 LYS 29 7.620 -30.499 2.512 224 HZ2 LYS 29 HZ2 LYS 29 6.007 -30.021 2.331 225 HZ3 LYS 29 HZ3 LYS 29 6.588 -30.472 3.859 226 H ALA 30 H ALA 30 9.013 -23.812 4.603 227 HA ALA 30 HA ALA 30 10.924 -22.612 2.800 228 HB1 ALA 30 HB1 ALA 30 10.069 -24.454 1.451 229 HB2 ALA 30 HB2 ALA 30 9.535 -22.903 0.805 230 HB3 ALA 30 HB3 ALA 30 8.416 -23.905 1.729 231 H ILE 31 H ILE 31 10.645 -20.719 3.908 232 HA ILE 31 HA ILE 31 8.071 -19.366 3.487 233 HB ILE 31 HB ILE 31 9.775 -19.134 5.983 234 HG12 ILE 31 HG13 ILE 31 7.000 -20.286 5.607 235 HG13 ILE 31 HG12 ILE 31 8.460 -21.219 5.918 236 HG21 ILE 31 HG21 ILE 31 8.790 -17.004 5.416 237 HG22 ILE 31 HG22 ILE 31 7.952 -17.685 6.810 238 HG23 ILE 31 HG23 ILE 31 7.204 -17.755 5.215 239 HD11 ILE 31 HD11 ILE 31 7.146 -20.982 7.935 240 HD12 ILE 31 HD12 ILE 31 7.193 -19.224 7.784 241 HD13 ILE 31 HD13 ILE 31 8.677 -20.124 8.100 242 H ASN 32 H ASN 32 8.246 -17.312 2.730 243 HA ASN 32 HA ASN 32 10.810 -16.559 1.666 244 HB2 ASN 32 HB3 ASN 32 8.151 -15.114 1.623 245 HB3 ASN 32 HB2 ASN 32 9.583 -14.613 0.732 246 HD21 ASN 32 HD21 ASN 32 6.926 -15.381 -0.198 247 HD22 ASN 32 HD22 ASN 32 7.172 -16.688 -1.309 248 H PHE 33 H PHE 33 8.477 -14.726 3.632 249 HA PHE 33 HA PHE 33 10.738 -13.496 5.050 250 HB2 PHE 33 HB3 PHE 33 8.354 -11.975 3.980 251 HB3 PHE 33 HB2 PHE 33 9.724 -11.295 4.846 252 HD1 PHE 33 HD1 PHE 33 8.353 -12.083 1.673 253 HD2 PHE 33 HD2 PHE 33 12.029 -11.516 3.734 254 HE1 PHE 33 HE1 PHE 33 9.488 -11.690 -0.472 255 HE2 PHE 33 HE2 PHE 33 13.174 -11.118 1.593 256 HZ PHE 33 HZ PHE 33 11.902 -11.206 -0.513 257 H LEU 34 H LEU 34 10.490 -13.657 7.174 258 HA LEU 34 HA LEU 34 7.884 -14.083 8.373 259 HB2 LEU 34 HB3 LEU 34 10.689 -13.907 9.454 260 HB3 LEU 34 HB2 LEU 34 9.311 -13.874 10.532 261 HG LEU 34 HG LEU 34 10.189 -16.099 10.488 262 HD11 LEU 34 HD11 LEU 34 7.659 -15.955 8.861 263 HD12 LEU 34 HD12 LEU 34 7.778 -15.926 10.620 264 HD13 LEU 34 HD13 LEU 34 8.246 -17.373 9.729 265 HD21 LEU 34 HD21 LEU 34 9.846 -16.039 7.492 266 HD22 LEU 34 HD22 LEU 34 10.361 -17.428 8.450 267 HD23 LEU 34 HD23 LEU 34 11.381 -15.991 8.360 268 HA PRO 35 HA PRO 35 6.980 -9.790 8.730 269 HB2 PRO 35 HB3 PRO 35 5.223 -9.909 10.828 270 HB3 PRO 35 HB2 PRO 35 4.807 -10.339 9.167 271 HG2 PRO 35 HG3 PRO 35 5.560 -12.117 11.450 272 HG3 PRO 35 HG2 PRO 35 4.280 -12.328 10.241 273 HD2 PRO 35 HD3 PRO 35 6.618 -13.640 10.059 274 HD3 PRO 35 HD2 PRO 35 5.763 -13.058 8.614 275 H VAL 36 H VAL 36 7.784 -8.063 9.752 276 HA VAL 36 HA VAL 36 9.574 -8.365 11.946 277 HB VAL 36 HB VAL 36 10.057 -6.639 10.363 278 HG11 VAL 36 HG11 VAL 36 8.605 -4.669 10.041 279 HG12 VAL 36 HG12 VAL 36 7.371 -5.445 11.034 280 HG13 VAL 36 HG13 VAL 36 7.855 -6.171 9.501 281 HG21 VAL 36 HG21 VAL 36 10.692 -6.152 12.669 282 HG22 VAL 36 HG22 VAL 36 9.147 -5.344 12.931 283 HG23 VAL 36 HG23 VAL 36 10.308 -4.675 11.785 284 H ASP 37 H ASP 37 8.328 -9.350 13.502 285 HA ASP 37 HA ASP 37 7.222 -7.878 15.555 286 HB2 ASP 37 HB3 ASP 37 5.425 -7.535 13.670 287 HB3 ASP 37 HB2 ASP 37 4.966 -9.190 14.048 288 H TYR 38 H TYR 38 7.433 -10.752 13.670 289 HA TYR 38 HA TYR 38 6.417 -12.577 15.614 290 HB2 TYR 38 HB3 TYR 38 6.720 -12.799 13.001 291 HB3 TYR 38 HB2 TYR 38 8.308 -13.411 13.449 292 HD1 TYR 38 HD1 TYR 38 8.574 -15.628 14.254 293 HD2 TYR 38 HD2 TYR 38 4.680 -13.967 13.867 294 HE1 TYR 38 HE1 TYR 38 7.591 -17.848 14.649 295 HE2 TYR 38 HE2 TYR 38 3.687 -16.178 14.260 296 HH TYR 38 HH TYR 38 4.383 -18.569 13.994 297 H GLU 39 H GLU 39 7.547 -13.993 16.944 298 HA GLU 39 HA GLU 39 10.396 -13.387 17.381 299 HB2 GLU 39 HB3 GLU 39 8.328 -14.034 19.491 300 HB3 GLU 39 HB2 GLU 39 10.035 -13.744 19.780 301 HG2 GLU 39 HG3 GLU 39 9.828 -11.455 19.147 302 HG3 GLU 39 HG2 GLU 39 8.170 -11.703 18.599 303 H ILE 40 H ILE 40 11.630 -15.136 18.325 304 HA ILE 40 HA ILE 40 10.405 -17.796 18.203 305 HB ILE 40 HB ILE 40 12.423 -18.715 17.078 306 HG12 ILE 40 HG13 ILE 40 13.051 -15.810 16.507 307 HG13 ILE 40 HG12 ILE 40 13.958 -16.855 17.595 308 HG21 ILE 40 HG21 ILE 40 10.378 -18.320 15.822 309 HG22 ILE 40 HG22 ILE 40 11.800 -18.034 14.818 310 HG23 ILE 40 HG23 ILE 40 10.895 -16.668 15.473 311 HD11 ILE 40 HD11 ILE 40 15.071 -16.611 15.447 312 HD12 ILE 40 HD12 ILE 40 13.649 -17.259 14.629 313 HD13 ILE 40 HD13 ILE 40 14.578 -18.279 15.727 314 H GLU 41 H GLU 41 11.388 -19.346 19.522 315 HA GLU 41 HA GLU 41 13.330 -18.268 21.465 316 HB2 GLU 41 HB3 GLU 41 10.989 -18.958 22.278 317 HB3 GLU 41 HB2 GLU 41 11.492 -20.612 21.954 318 HG2 GLU 41 HG3 GLU 41 13.437 -20.215 23.490 319 HG3 GLU 41 HG2 GLU 41 12.683 -18.686 23.932 320 H TYR 42 H TYR 42 14.690 -20.069 22.485 321 HA TYR 42 HA TYR 42 15.647 -21.808 20.318 322 HB2 TYR 42 HB3 TYR 42 17.148 -20.355 22.478 323 HB3 TYR 42 HB2 TYR 42 17.854 -21.713 21.608 324 HD1 TYR 42 HD1 TYR 42 18.438 -21.523 19.265 325 HD2 TYR 42 HD2 TYR 42 16.767 -18.230 21.373 326 HE1 TYR 42 HE1 TYR 42 19.125 -20.021 17.446 327 HE2 TYR 42 HE2 TYR 42 17.454 -16.721 19.563 328 HH TYR 42 HH TYR 42 18.579 -17.863 16.532 329 H VAL 43 H VAL 43 14.711 -23.720 20.733 330 HA VAL 43 HA VAL 43 15.114 -24.934 23.367 331 HB VAL 43 HB VAL 43 13.786 -26.827 22.486 332 HG11 VAL 43 HG11 VAL 43 12.455 -24.149 22.085 333 HG12 VAL 43 HG12 VAL 43 12.665 -24.972 23.631 334 HG13 VAL 43 HG13 VAL 43 11.636 -25.682 22.385 335 HG21 VAL 43 HG21 VAL 43 13.519 -25.131 20.001 336 HG22 VAL 43 HG22 VAL 43 12.649 -26.631 20.324 337 HG23 VAL 43 HG23 VAL 43 14.402 -26.653 20.129 338 H CYS 44 H CYS 44 16.258 -26.988 23.528 339 HA CYS 44 HA CYS 44 18.443 -27.097 21.605 340 HB2 CYS 44 HB3 CYS 44 18.858 -27.181 24.086 341 HB3 CYS 44 HB2 CYS 44 18.058 -28.746 24.117 342 H ARG 45 H ARG 45 19.168 -29.399 20.969 343 HA ARG 45 HA ARG 45 17.157 -30.450 19.324 344 HB2 ARG 45 HB3 ARG 45 19.824 -30.669 19.321 345 HB3 ARG 45 HB2 ARG 45 19.445 -32.204 20.087 346 HG2 ARG 45 HG3 ARG 45 18.333 -31.295 17.440 347 HG3 ARG 45 HG2 ARG 45 19.725 -32.358 17.636 348 HD2 ARG 45 HD3 ARG 45 18.367 -34.042 18.670 349 HD3 ARG 45 HD2 ARG 45 16.975 -32.960 18.713 350 HE ARG 45 HE ARG 45 17.444 -33.053 16.100 351 HH11 ARG 45 HH11 ARG 45 17.400 -35.667 18.430 352 HH12 ARG 45 HH12 ARG 45 16.825 -36.838 17.286 353 HH21 ARG 45 HH21 ARG 45 16.695 -34.585 14.607 354 HH22 ARG 45 HH22 ARG 45 16.447 -36.234 15.114 355 H GLY 46 H GLY 46 15.445 -31.615 19.858 356 HA2 GLY 46 HA3 GLY 46 14.497 -33.634 20.779 357 HA3 GLY 46 HA2 GLY 46 15.658 -33.523 22.099 358 H GLU 47 H GLU 47 14.734 -32.961 23.946 359 HA GLU 47 HA GLU 47 12.713 -30.824 23.897 360 HB2 GLU 47 HB3 GLU 47 11.532 -31.952 25.747 361 HB3 GLU 47 HB2 GLU 47 11.544 -32.918 24.278 362 HG2 GLU 47 HG3 GLU 47 13.272 -34.337 25.171 363 HG3 GLU 47 HG2 GLU 47 13.419 -33.313 26.600 364 H ARG 48 H ARG 48 15.611 -30.842 24.373 365 HA ARG 48 HA ARG 48 15.868 -30.421 27.241 366 HB2 ARG 48 HB3 ARG 48 17.935 -30.228 25.039 367 HB3 ARG 48 HB2 ARG 48 18.269 -30.102 26.760 368 HG2 ARG 48 HG3 ARG 48 17.141 -32.527 25.374 369 HG3 ARG 48 HG2 ARG 48 18.823 -32.312 25.863 370 HD2 ARG 48 HD3 ARG 48 16.499 -32.203 27.773 371 HD3 ARG 48 HD2 ARG 48 17.402 -33.677 27.425 372 HE ARG 48 HE ARG 48 19.374 -32.051 28.155 373 HH11 ARG 48 HH11 ARG 48 16.199 -32.445 29.599 374 HH12 ARG 48 HH12 ARG 48 16.787 -32.265 31.229 375 HH21 ARG 48 HH21 ARG 48 20.136 -31.791 30.305 376 HH22 ARG 48 HH22 ARG 48 18.999 -31.838 31.624 377 H GLU 49 H GLU 49 16.072 -28.483 28.193 378 HA GLU 49 HA GLU 49 15.532 -26.140 26.538 379 HB2 GLU 49 HB3 GLU 49 15.559 -26.347 29.552 380 HB3 GLU 49 HB2 GLU 49 14.871 -25.050 28.582 381 HG2 GLU 49 HG3 GLU 49 13.172 -26.552 27.731 382 HG3 GLU 49 HG2 GLU 49 13.881 -27.893 28.631 383 H VAL 50 H VAL 50 16.713 -24.141 26.989 384 HA VAL 50 HA VAL 50 19.463 -24.664 27.917 385 HB VAL 50 HB VAL 50 20.304 -23.062 26.290 386 HG11 VAL 50 HG11 VAL 50 19.913 -24.328 24.232 387 HG12 VAL 50 HG12 VAL 50 18.557 -25.151 25.004 388 HG13 VAL 50 HG13 VAL 50 20.194 -25.389 25.611 389 HG21 VAL 50 HG21 VAL 50 18.398 -21.575 26.128 390 HG22 VAL 50 HG22 VAL 50 17.447 -22.839 25.348 391 HG23 VAL 50 HG23 VAL 50 18.848 -22.153 24.523 392 H VAL 51 H VAL 51 20.477 -23.009 29.093 393 HA VAL 51 HA VAL 51 18.703 -20.850 29.970 394 HB VAL 51 HB VAL 51 19.639 -22.052 31.824 395 HG11 VAL 51 HG11 VAL 51 21.567 -23.054 30.734 396 HG12 VAL 51 HG12 VAL 51 22.039 -22.243 32.227 397 HG13 VAL 51 HG13 VAL 51 22.366 -21.481 30.670 398 HG21 VAL 51 HG21 VAL 51 20.806 -20.256 33.015 399 HG22 VAL 51 HG22 VAL 51 19.419 -19.648 32.111 400 HG23 VAL 51 HG23 VAL 51 21.052 -19.407 31.490 401 H GLY 52 H GLY 52 18.791 -19.357 28.445 402 HA2 GLY 52 HA3 GLY 52 21.281 -17.944 28.016 403 HA3 GLY 52 HA2 GLY 52 20.622 -18.736 26.590 404 HA PRO 53 HA PRO 53 18.408 -14.617 27.061 405 HB2 PRO 53 HB3 PRO 53 19.677 -13.243 25.108 406 HB3 PRO 53 HB2 PRO 53 20.225 -13.209 26.789 407 HG2 PRO 53 HG3 PRO 53 21.275 -14.797 24.481 408 HG3 PRO 53 HG2 PRO 53 22.170 -13.942 25.748 409 HD2 PRO 53 HD3 PRO 53 21.741 -16.635 25.771 410 HD3 PRO 53 HD2 PRO 53 21.939 -15.666 27.245 411 H LYS 54 H LYS 54 17.445 -16.870 26.056 412 HA LYS 54 HA LYS 54 17.454 -17.003 23.203 413 HB2 LYS 54 HB3 LYS 54 15.724 -18.818 23.596 414 HB3 LYS 54 HB2 LYS 54 17.313 -19.080 24.298 415 HG2 LYS 54 HG3 LYS 54 16.534 -18.561 26.477 416 HG3 LYS 54 HG2 LYS 54 14.996 -17.961 25.855 417 HD2 LYS 54 HD3 LYS 54 14.509 -20.260 25.031 418 HD3 LYS 54 HD2 LYS 54 15.989 -20.808 25.820 419 HE2 LYS 54 HE3 LYS 54 15.137 -20.183 27.978 420 HE3 LYS 54 HE2 LYS 54 13.720 -19.433 27.248 421 HZ1 LYS 54 HZ1 LYS 54 12.995 -21.595 26.475 422 HZ2 LYS 54 HZ2 LYS 54 13.218 -21.621 28.161 423 HZ3 LYS 54 HZ3 LYS 54 14.373 -22.330 27.140 424 H VAL 55 H VAL 55 16.645 -14.969 22.617 425 HA VAL 55 HA VAL 55 13.849 -15.134 22.046 426 HB VAL 55 HB VAL 55 13.692 -14.008 24.215 427 HG11 VAL 55 HG11 VAL 55 14.650 -11.774 24.557 428 HG12 VAL 55 HG12 VAL 55 15.498 -11.915 23.016 429 HG13 VAL 55 HG13 VAL 55 15.891 -13.010 24.342 430 HG21 VAL 55 HG21 VAL 55 13.153 -12.150 21.904 431 HG22 VAL 55 HG22 VAL 55 12.451 -12.011 23.515 432 HG23 VAL 55 HG23 VAL 55 12.076 -13.408 22.506 433 H ARG 56 H ARG 56 13.547 -14.401 20.043 434 HA ARG 56 HA ARG 56 15.434 -12.415 18.970 435 HB2 ARG 56 HB3 ARG 56 14.427 -14.816 17.446 436 HB3 ARG 56 HB2 ARG 56 15.525 -13.585 16.852 437 HG2 ARG 56 HG3 ARG 56 16.118 -15.509 19.080 438 HG3 ARG 56 HG2 ARG 56 16.656 -15.676 17.409 439 HD2 ARG 56 HD3 ARG 56 17.758 -13.405 17.704 440 HD3 ARG 56 HD2 ARG 56 17.452 -13.602 19.431 441 HE ARG 56 HE ARG 56 18.807 -15.813 18.136 442 HH11 ARG 56 HH11 ARG 56 19.157 -12.851 20.000 443 HH12 ARG 56 HH12 ARG 56 20.773 -13.234 20.504 444 HH21 ARG 56 HH21 ARG 56 20.909 -16.294 18.805 445 HH22 ARG 56 HH22 ARG 56 21.783 -15.176 19.807 446 H LYS 57 H LYS 57 14.527 -10.887 17.688 447 HA LYS 57 HA LYS 57 11.731 -11.278 16.881 448 HB2 LYS 57 HB3 LYS 57 11.868 -9.794 18.878 449 HB3 LYS 57 HB2 LYS 57 12.892 -8.700 17.958 450 HG2 LYS 57 HG3 LYS 57 11.099 -8.230 16.425 451 HG3 LYS 57 HG2 LYS 57 10.070 -9.433 17.207 452 HD2 LYS 57 HD3 LYS 57 9.479 -7.189 17.943 453 HD3 LYS 57 HD2 LYS 57 10.136 -8.128 19.284 454 HE2 LYS 57 HE3 LYS 57 12.326 -7.050 18.916 455 HE3 LYS 57 HE2 LYS 57 11.603 -6.066 17.643 456 HZ1 LYS 57 HZ1 LYS 57 11.595 -4.742 19.556 457 HZ2 LYS 57 HZ2 LYS 57 11.041 -5.998 20.549 458 HZ3 LYS 57 HZ3 LYS 57 9.995 -5.295 19.415 459 H CYS 58 H CYS 58 11.257 -10.643 14.853 460 HA CYS 58 HA CYS 58 13.409 -10.178 13.048 461 HB2 CYS 58 HB3 CYS 58 11.429 -11.444 12.367 462 HB3 CYS 58 HB2 CYS 58 10.417 -10.026 12.612 463 H LEU 59 H LEU 59 13.871 -8.344 11.825 464 HA LEU 59 HA LEU 59 12.797 -5.826 12.918 465 HB2 LEU 59 HB3 LEU 59 15.562 -6.395 11.836 466 HB3 LEU 59 HB2 LEU 59 14.987 -4.818 12.346 467 HG LEU 59 HG LEU 59 15.325 -7.228 14.135 468 HD11 LEU 59 HD11 LEU 59 17.450 -6.268 13.416 469 HD12 LEU 59 HD12 LEU 59 17.155 -5.964 15.127 470 HD13 LEU 59 HD13 LEU 59 16.914 -4.676 13.946 471 HD21 LEU 59 HD21 LEU 59 13.477 -5.801 14.849 472 HD22 LEU 59 HD22 LEU 59 14.539 -4.392 14.793 473 HD23 LEU 59 HD23 LEU 59 14.842 -5.680 15.959 474 H ALA 60 H ALA 60 13.482 -3.968 11.220 475 HA ALA 60 HA ALA 60 11.954 -4.597 8.854 476 HB1 ALA 60 HB1 ALA 60 13.348 -2.035 9.629 477 HB2 ALA 60 HB2 ALA 60 11.671 -2.446 9.989 478 HB3 ALA 60 HB3 ALA 60 12.184 -2.229 8.316 479 H ASN 61 H ASN 61 15.184 -4.854 9.684 480 HA ASN 61 HA ASN 61 16.082 -4.597 6.905 481 HB2 ASN 61 HB3 ASN 61 18.365 -4.802 7.819 482 HB3 ASN 61 HB2 ASN 61 17.490 -3.467 8.555 483 HD21 ASN 61 HD21 ASN 61 18.988 -6.531 9.055 484 HD22 ASN 61 HD22 ASN 61 18.838 -6.559 10.782 485 H GLY 62 H GLY 62 17.627 -6.390 6.188 486 HA2 GLY 62 HA3 GLY 62 16.168 -8.859 6.385 487 HA3 GLY 62 HA2 GLY 62 17.616 -8.574 5.430 488 H SER 63 H SER 63 16.808 -8.581 8.893 489 HA SER 63 HA SER 63 18.254 -10.921 9.485 490 HB2 SER 63 HB3 SER 63 20.202 -9.409 9.034 491 HB3 SER 63 HB2 SER 63 19.635 -8.354 10.326 492 HG SER 63 HG SER 63 20.654 -9.600 11.641 493 H TRP 64 H TRP 64 18.558 -11.035 11.963 494 HA TRP 64 HA TRP 64 16.095 -9.970 13.138 495 HB2 TRP 64 HB3 TRP 64 17.851 -12.279 14.013 496 HB3 TRP 64 HB2 TRP 64 16.364 -11.777 14.811 497 HD1 TRP 64 HD1 TRP 64 17.432 -13.007 11.268 498 HE1 TRP 64 HE1 TRP 64 15.533 -14.480 10.331 499 HE3 TRP 64 HE3 TRP 64 14.082 -12.537 15.110 500 HZ2 TRP 64 HZ2 TRP 64 12.960 -15.329 11.132 501 HZ3 TRP 64 HZ3 TRP 64 11.930 -13.717 14.945 502 HH2 TRP 64 HH2 TRP 64 11.381 -15.080 13.000 503 H THR 65 H THR 65 16.492 -9.926 15.735 504 HA THR 65 HA THR 65 17.713 -7.533 16.274 505 HB THR 65 HB THR 65 17.798 -8.454 18.700 506 HG1 THR 65 HG1 THR 65 17.334 -10.508 18.903 507 HG21 THR 65 HG21 THR 65 15.360 -8.239 18.902 508 HG22 THR 65 HG22 THR 65 15.203 -8.388 17.151 509 HG23 THR 65 HG23 THR 65 16.028 -6.994 17.848 510 H ASP 66 H ASP 66 19.081 -10.731 17.024 511 HA ASP 66 HA ASP 66 21.765 -9.789 16.436 512 HB2 ASP 66 HB3 ASP 66 21.286 -9.327 18.933 513 HB3 ASP 66 HB2 ASP 66 21.210 -11.067 19.125 514 H MET 67 H MET 67 22.794 -11.506 15.373 515 HA MET 67 HA MET 67 21.905 -14.178 16.214 516 HB2 MET 67 HB3 MET 67 22.208 -13.180 13.393 517 HB3 MET 67 HB2 MET 67 22.240 -14.893 13.785 518 HG2 MET 67 HG3 MET 67 19.974 -13.000 14.361 519 HG3 MET 67 HG2 MET 67 20.037 -14.171 13.042 520 HE1 MET 67 HE1 MET 67 17.717 -13.883 15.260 521 HE2 MET 67 HE2 MET 67 17.365 -15.578 15.601 522 HE3 MET 67 HE3 MET 67 17.632 -15.048 13.939 523 H ASP 68 H ASP 68 23.918 -13.739 17.495 524 HA ASP 68 HA ASP 68 25.403 -15.947 16.567 525 HB2 ASP 68 HB3 ASP 68 26.726 -14.139 15.459 526 HB3 ASP 68 HB2 ASP 68 27.023 -13.429 17.044 527 H THR 69 H THR 69 24.561 -16.871 18.409 528 HA THR 69 HA THR 69 25.692 -15.960 20.937 529 HB THR 69 HB THR 69 22.723 -16.369 20.856 530 HG1 THR 69 HG1 THR 69 24.008 -13.847 20.433 531 HG21 THR 69 HG21 THR 69 24.538 -14.697 22.598 532 HG22 THR 69 HG22 THR 69 23.839 -16.260 23.029 533 HG23 THR 69 HG23 THR 69 22.791 -14.858 22.792 534 HA PRO 70 HA PRO 70 25.577 -20.512 20.651 535 HB2 PRO 70 HB3 PRO 70 27.647 -20.885 22.396 536 HB3 PRO 70 HB2 PRO 70 27.866 -20.579 20.668 537 HG2 PRO 70 HG3 PRO 70 28.063 -18.683 22.972 538 HG3 PRO 70 HG2 PRO 70 29.093 -18.808 21.533 539 HD2 PRO 70 HD3 PRO 70 27.169 -16.923 21.786 540 HD3 PRO 70 HD2 PRO 70 27.611 -17.627 20.218 541 H SER 71 H SER 71 23.576 -20.632 21.721 542 HA SER 71 HA SER 71 23.432 -20.347 24.578 543 HB2 SER 71 HB3 SER 71 21.403 -21.562 22.684 544 HB3 SER 71 HB2 SER 71 21.109 -21.005 24.332 545 HG SER 71 HG SER 71 22.190 -19.216 22.459 546 H ARG 72 H ARG 72 24.137 -21.811 25.940 547 HA ARG 72 HA ARG 72 24.992 -24.384 24.995 548 HB2 ARG 72 HB3 ARG 72 25.768 -24.635 27.396 549 HB3 ARG 72 HB2 ARG 72 26.482 -23.317 26.478 550 HG2 ARG 72 HG3 ARG 72 24.828 -21.780 27.539 551 HG3 ARG 72 HG2 ARG 72 24.321 -23.126 28.563 552 HD2 ARG 72 HD3 ARG 72 25.966 -21.641 29.667 553 HD3 ARG 72 HD2 ARG 72 26.531 -23.304 29.508 554 HE ARG 72 HE ARG 72 27.786 -22.458 27.494 555 HH11 ARG 72 HH11 ARG 72 26.961 -20.305 30.140 556 HH12 ARG 72 HH12 ARG 72 28.330 -19.264 29.870 557 HH21 ARG 72 HH21 ARG 72 29.593 -21.126 27.176 558 HH22 ARG 72 HH22 ARG 72 29.843 -19.755 28.215 559 H CYS 73 H CYS 73 24.083 -26.304 25.295 560 HA CYS 73 HA CYS 73 21.430 -26.416 26.436 561 HB2 CYS 73 HB3 CYS 73 23.141 -28.566 25.169 562 HB3 CYS 73 HB2 CYS 73 21.471 -28.781 25.679 563 H VAL 74 H VAL 74 21.528 -26.235 28.596 564 HA VAL 74 HA VAL 74 22.466 -28.581 30.004 565 HB VAL 74 HB VAL 74 24.414 -27.181 30.235 566 HG11 VAL 74 HG11 VAL 74 23.429 -25.007 29.753 567 HG12 VAL 74 HG12 VAL 74 24.348 -24.961 31.257 568 HG13 VAL 74 HG13 VAL 74 22.586 -25.033 31.302 569 HG21 VAL 74 HG21 VAL 74 23.754 -28.482 32.184 570 HG22 VAL 74 HG22 VAL 74 22.790 -27.126 32.772 571 HG23 VAL 74 HG23 VAL 74 24.544 -26.979 32.661 572 H ARG 75 H ARG 75 20.797 -29.248 31.122 573 HA ARG 75 HA ARG 75 18.897 -27.270 32.165 574 HB2 ARG 75 HB3 ARG 75 18.307 -28.526 29.937 575 HB3 ARG 75 HB2 ARG 75 17.973 -29.881 31.002 576 HG2 ARG 75 HG3 ARG 75 16.675 -27.186 31.296 577 HG3 ARG 75 HG2 ARG 75 15.994 -28.498 30.336 578 HD2 ARG 75 HD3 ARG 75 16.053 -29.915 32.401 579 HD3 ARG 75 HD2 ARG 75 16.511 -28.470 33.303 580 HE ARG 75 HE ARG 75 14.223 -27.818 31.881 581 HH11 ARG 75 HH11 ARG 75 15.135 -30.065 34.430 582 HH12 ARG 75 HH12 ARG 75 13.523 -30.149 35.090 583 HH21 ARG 75 HH21 ARG 75 12.143 -27.918 32.753 584 HH22 ARG 75 HH22 ARG 75 11.819 -28.915 34.140 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 -1.037 -1.410 1.999 2 H2 GLY 1 HT2 GLY 1 -0.125 -2.823 2.204 3 H3 GLY 1 HT3 GLY 1 -0.941 -2.548 0.745 4 HA2 GLY 1 HA2 GLY 1 0.467 -0.660 0.262 5 HA3 GLY 1 HA3 GLY 1 1.296 -0.900 1.794 6 HA PRO 2 HA PRO 2 3.066 -3.669 -1.671 7 HB2 PRO 2 HB3 PRO 2 4.776 -2.090 -2.998 8 HB3 PRO 2 HB2 PRO 2 3.058 -2.130 -3.412 9 HG2 PRO 2 HG3 PRO 2 4.572 -0.122 -1.799 10 HG3 PRO 2 HG2 PRO 2 3.316 0.142 -3.021 11 HD2 PRO 2 HD3 PRO 2 2.870 0.175 -0.305 12 HD3 PRO 2 HD2 PRO 2 1.625 -0.182 -1.517 13 H THR 3 H THR 3 3.701 -3.361 1.022 14 HA THR 3 HA THR 3 6.640 -3.241 1.028 15 HB THR 3 HB THR 3 6.313 -2.772 3.533 16 HG1 THR 3 HG1 THR 3 4.124 -3.210 3.768 17 HG21 THR 3 HG21 THR 3 6.018 -0.375 3.151 18 HG22 THR 3 HG22 THR 3 5.403 -0.700 1.530 19 HG23 THR 3 HG23 THR 3 7.079 -1.079 1.930 20 H SER 4 H SER 4 7.736 -4.941 1.856 21 HA SER 4 HA SER 4 6.309 -6.847 3.545 22 HB2 SER 4 HB3 SER 4 7.918 -7.645 1.104 23 HB3 SER 4 HB2 SER 4 7.298 -8.765 2.315 24 HG SER 4 HG SER 4 5.362 -7.099 1.368 25 H GLU 5 H GLU 5 7.428 -6.304 5.336 26 HA GLU 5 HA GLU 5 10.356 -6.241 5.198 27 HB2 GLU 5 HB3 GLU 5 8.588 -5.517 7.539 28 HB3 GLU 5 HB2 GLU 5 10.300 -5.167 7.358 29 HG2 GLU 5 HG3 GLU 5 8.021 -3.971 5.800 30 HG3 GLU 5 HG2 GLU 5 9.043 -3.164 6.986 31 H GLY 6 H GLY 6 11.442 -8.028 5.729 32 HA2 GLY 6 HA3 GLY 6 10.446 -9.741 7.843 33 HA3 GLY 6 HA2 GLY 6 10.466 -10.457 6.240 34 H CYS 7 H CYS 7 11.893 -11.220 8.619 35 HA CYS 7 HA CYS 7 14.691 -10.727 7.912 36 HB2 CYS 7 HB3 CYS 7 13.504 -12.247 10.252 37 HB3 CYS 7 HB2 CYS 7 15.195 -11.803 10.050 38 H GLN 8 H GLN 8 16.128 -12.507 7.482 39 HA GLN 8 HA GLN 8 14.884 -14.468 5.823 40 HB2 GLN 8 HB3 GLN 8 17.180 -15.308 5.455 41 HB3 GLN 8 HB2 GLN 8 17.012 -13.586 5.155 42 HG2 GLN 8 HG3 GLN 8 18.229 -13.000 7.026 43 HG3 GLN 8 HG2 GLN 8 17.951 -14.550 7.819 44 HE21 GLN 8 HE21 GLN 8 18.647 -16.191 5.589 45 HE22 GLN 8 HE22 GLN 8 20.356 -16.062 5.357 46 H ILE 9 H ILE 9 15.758 -16.798 5.950 47 HA ILE 9 HA ILE 9 14.936 -17.876 8.520 48 HB ILE 9 HB ILE 9 15.534 -19.176 5.860 49 HG12 ILE 9 HG13 ILE 9 12.960 -18.784 7.398 50 HG13 ILE 9 HG12 ILE 9 13.430 -17.948 5.921 51 HG21 ILE 9 HG21 ILE 9 14.694 -21.270 6.820 52 HG22 ILE 9 HG22 ILE 9 14.632 -20.502 8.408 53 HG23 ILE 9 HG23 ILE 9 16.184 -20.726 7.594 54 HD11 ILE 9 HD11 ILE 9 12.881 -20.890 6.200 55 HD12 ILE 9 HD12 ILE 9 13.392 -20.081 4.719 56 HD13 ILE 9 HD13 ILE 9 11.832 -19.694 5.443 57 H ILE 10 H ILE 10 16.310 -18.577 10.013 58 HA ILE 10 HA ILE 10 19.153 -18.652 9.484 59 HB ILE 10 HB ILE 10 17.643 -19.288 12.028 60 HG12 ILE 10 HG13 ILE 10 19.075 -16.746 11.212 61 HG13 ILE 10 HG12 ILE 10 17.329 -16.952 11.235 62 HG21 ILE 10 HG21 ILE 10 19.850 -20.303 11.986 63 HG22 ILE 10 HG22 ILE 10 19.811 -18.965 13.135 64 HG23 ILE 10 HG23 ILE 10 20.573 -18.754 11.558 65 HD11 ILE 10 HD11 ILE 10 18.073 -15.757 13.193 66 HD12 ILE 10 HD12 ILE 10 19.162 -17.079 13.614 67 HD13 ILE 10 HD13 ILE 10 17.417 -17.331 13.650 68 H HIS 11 H HIS 11 20.303 -20.437 9.068 69 HA HIS 11 HA HIS 11 18.895 -22.924 8.680 70 HB2 HIS 11 HB3 HIS 11 20.940 -21.764 7.354 71 HB3 HIS 11 HB2 HIS 11 21.857 -22.810 8.432 72 HD1 HIS 11 HD1 HIS 11 22.011 -25.246 7.813 73 HD2 HIS 11 HD2 HIS 11 19.150 -23.190 5.596 74 HE1 HIS 11 HE1 HIS 11 21.246 -26.847 6.033 75 HE2 HIS 11 HE2 HIS 11 19.634 -25.532 4.607 76 HA PRO 12 HA PRO 12 19.458 -24.655 12.719 77 HB2 PRO 12 HB3 PRO 12 19.914 -27.159 11.152 78 HB3 PRO 12 HB2 PRO 12 18.836 -26.872 12.524 79 HG2 PRO 12 HG3 PRO 12 17.858 -27.005 10.058 80 HG3 PRO 12 HG2 PRO 12 17.236 -25.812 11.214 81 HD2 PRO 12 HD3 PRO 12 19.063 -25.430 8.886 82 HD3 PRO 12 HD2 PRO 12 17.815 -24.347 9.534 83 HA PRO 13 HA PRO 13 23.962 -24.669 12.635 84 HB2 PRO 13 HB3 PRO 13 23.883 -23.909 15.414 85 HB3 PRO 13 HB2 PRO 13 24.295 -22.914 14.017 86 HG2 PRO 13 HG3 PRO 13 22.046 -22.556 15.553 87 HG3 PRO 13 HG2 PRO 13 22.188 -22.046 13.862 88 HD2 PRO 13 HD3 PRO 13 20.886 -24.487 15.005 89 HD3 PRO 13 HD2 PRO 13 20.339 -23.431 13.684 90 H TRP 14 H TRP 14 23.764 -25.155 15.994 91 HA TRP 14 HA TRP 14 24.969 -27.762 15.775 92 HB2 TRP 14 HB3 TRP 14 25.721 -26.033 17.422 93 HB3 TRP 14 HB2 TRP 14 24.182 -26.202 18.255 94 HD1 TRP 14 HD1 TRP 14 24.397 -27.643 20.346 95 HE1 TRP 14 HE1 TRP 14 25.813 -29.666 21.077 96 HE3 TRP 14 HE3 TRP 14 27.127 -28.312 16.076 97 HZ2 TRP 14 HZ2 TRP 14 27.822 -31.325 19.988 98 HZ3 TRP 14 HZ3 TRP 14 28.773 -30.140 16.003 99 HH2 TRP 14 HH2 TRP 14 29.111 -31.613 17.922 100 H GLU 15 H GLU 15 24.118 -29.399 17.568 101 HA GLU 15 HA GLU 15 21.711 -30.443 16.689 102 HB2 GLU 15 HB3 GLU 15 23.319 -30.894 19.185 103 HB3 GLU 15 HB2 GLU 15 21.806 -31.748 18.908 104 HG2 GLU 15 HG3 GLU 15 24.192 -31.798 17.073 105 HG3 GLU 15 HG2 GLU 15 23.759 -33.059 18.230 106 H GLY 16 H GLY 16 19.926 -29.301 16.710 107 HA2 GLY 16 HA3 GLY 16 18.293 -28.951 18.891 108 HA3 GLY 16 HA2 GLY 16 19.201 -27.448 18.751 109 H GLY 17 H GLY 17 17.458 -26.178 18.134 110 HA2 GLY 17 HA3 GLY 17 16.959 -26.090 15.350 111 HA3 GLY 17 HA2 GLY 17 15.581 -26.813 16.171 112 H ILE 18 H ILE 18 14.609 -24.814 15.145 113 HA ILE 18 HA ILE 18 14.780 -22.643 17.114 114 HB ILE 18 HB ILE 18 14.591 -22.402 14.122 115 HG12 ILE 18 HG13 ILE 18 16.371 -21.180 16.236 116 HG13 ILE 18 HG12 ILE 18 16.823 -22.456 15.107 117 HG21 ILE 18 HG21 ILE 18 14.154 -19.998 14.429 118 HG22 ILE 18 HG22 ILE 18 13.965 -20.266 16.161 119 HG23 ILE 18 HG23 ILE 18 12.826 -20.993 15.029 120 HD11 ILE 18 HD11 ILE 18 16.546 -20.904 13.242 121 HD12 ILE 18 HD12 ILE 18 17.729 -20.314 14.410 122 HD13 ILE 18 HD13 ILE 18 16.106 -19.627 14.375 123 H ARG 19 H ARG 19 12.998 -22.204 18.097 124 HA ARG 19 HA ARG 19 10.476 -23.348 17.154 125 HB2 ARG 19 HB3 ARG 19 11.660 -23.108 19.659 126 HB3 ARG 19 HB2 ARG 19 10.408 -21.871 19.667 127 HG2 ARG 19 HG3 ARG 19 9.488 -23.886 20.566 128 HG3 ARG 19 HG2 ARG 19 8.760 -23.598 18.983 129 HD2 ARG 19 HD3 ARG 19 10.455 -25.173 18.019 130 HD3 ARG 19 HD2 ARG 19 10.947 -25.560 19.667 131 HE ARG 19 HE ARG 19 8.319 -26.159 18.470 132 HH11 ARG 19 HH11 ARG 19 10.697 -26.666 20.992 133 HH12 ARG 19 HH12 ARG 19 9.935 -28.105 21.601 134 HH21 ARG 19 HH21 ARG 19 7.307 -28.034 19.262 135 HH22 ARG 19 HH22 ARG 19 7.991 -28.872 20.625 136 H TYR 20 H TYR 20 8.532 -21.933 17.297 137 HA TYR 20 HA TYR 20 9.254 -19.162 16.608 138 HB2 TYR 20 HB3 TYR 20 7.094 -20.846 15.311 139 HB3 TYR 20 HB2 TYR 20 7.523 -19.191 14.882 140 HD1 TYR 20 HD1 TYR 20 8.459 -22.708 14.606 141 HD2 TYR 20 HD2 TYR 20 9.637 -18.716 13.714 142 HE1 TYR 20 HE1 TYR 20 10.153 -23.564 13.046 143 HE2 TYR 20 HE2 TYR 20 11.331 -19.561 12.145 144 HH TYR 20 HH TYR 20 12.613 -21.594 11.744 145 H ARG 21 H ARG 21 6.781 -18.071 16.350 146 HA ARG 21 HA ARG 21 5.996 -17.929 19.128 147 HB2 ARG 21 HB3 ARG 21 6.223 -15.848 17.934 148 HB3 ARG 21 HB2 ARG 21 5.115 -16.386 16.681 149 HG2 ARG 21 HG3 ARG 21 3.297 -16.430 18.351 150 HG3 ARG 21 HG2 ARG 21 4.422 -15.796 19.552 151 HD2 ARG 21 HD3 ARG 21 3.892 -14.385 16.953 152 HD3 ARG 21 HD2 ARG 21 2.893 -14.126 18.381 153 HE ARG 21 HE ARG 21 5.377 -13.695 19.327 154 HH11 ARG 21 HH11 ARG 21 3.711 -12.452 16.490 155 HH12 ARG 21 HH12 ARG 21 4.509 -10.901 16.558 156 HH21 ARG 21 HH21 ARG 21 6.401 -11.656 19.422 157 HH22 ARG 21 HH22 ARG 21 6.052 -10.472 18.191 158 H GLY 22 H GLY 22 4.650 -19.051 16.075 159 HA2 GLY 22 HA3 GLY 22 2.783 -20.735 17.466 160 HA3 GLY 22 HA2 GLY 22 2.003 -19.384 16.658 161 H LEU 23 H LEU 23 4.308 -22.017 16.044 162 HA LEU 23 HA LEU 23 2.900 -22.549 13.542 163 HB2 LEU 23 HB3 LEU 23 5.856 -22.060 13.805 164 HB3 LEU 23 HB2 LEU 23 5.189 -23.000 12.486 165 HG LEU 23 HG LEU 23 4.442 -20.137 13.072 166 HD11 LEU 23 HD11 LEU 23 5.812 -19.574 11.128 167 HD12 LEU 23 HD12 LEU 23 6.314 -21.259 10.994 168 HD13 LEU 23 HD13 LEU 23 6.782 -20.310 12.404 169 HD21 LEU 23 HD21 LEU 23 2.698 -21.397 11.921 170 HD22 LEU 23 HD22 LEU 23 3.865 -21.915 10.705 171 HD23 LEU 23 HD23 LEU 23 3.433 -20.210 10.844 172 H THR 24 H THR 24 2.728 -24.656 13.033 173 HA THR 24 HA THR 24 3.689 -26.574 14.999 174 HB THR 24 HB THR 24 1.299 -26.648 14.378 175 HG1 THR 24 HG1 THR 24 1.730 -29.024 13.321 176 HG21 THR 24 HG21 THR 24 2.307 -27.403 11.635 177 HG22 THR 24 HG22 THR 24 1.515 -25.886 12.062 178 HG23 THR 24 HG23 THR 24 0.622 -27.404 12.157 179 H ARG 25 H ARG 25 4.134 -28.873 13.762 180 HA ARG 25 HA ARG 25 6.577 -28.481 12.354 181 HB2 ARG 25 HB3 ARG 25 6.480 -30.959 12.019 182 HB3 ARG 25 HB2 ARG 25 6.288 -30.464 13.697 183 HG2 ARG 25 HG3 ARG 25 3.896 -30.766 13.545 184 HG3 ARG 25 HG2 ARG 25 4.032 -31.180 11.836 185 HD2 ARG 25 HD3 ARG 25 5.315 -33.157 12.389 186 HD3 ARG 25 HD2 ARG 25 5.295 -32.724 14.100 187 HE ARG 25 HE ARG 25 3.085 -33.410 14.242 188 HH11 ARG 25 HH11 ARG 25 4.207 -33.544 10.925 189 HH12 ARG 25 HH12 ARG 25 2.820 -34.426 10.362 190 HH21 ARG 25 HH21 ARG 25 1.267 -34.561 13.505 191 HH22 ARG 25 HH22 ARG 25 1.145 -35.016 11.831 192 H ASP 26 H ASP 26 6.699 -30.157 10.282 193 HA ASP 26 HA ASP 26 6.504 -30.226 8.030 194 HB2 ASP 26 HB3 ASP 26 4.262 -31.156 8.517 195 HB3 ASP 26 HB2 ASP 26 3.598 -29.527 8.480 196 H GLN 27 H GLN 27 5.352 -27.383 9.624 197 HA GLN 27 HA GLN 27 5.270 -25.634 7.388 198 HB2 GLN 27 HB3 GLN 27 5.707 -24.993 10.313 199 HB3 GLN 27 HB2 GLN 27 5.161 -23.873 9.072 200 HG2 GLN 27 HG3 GLN 27 3.587 -26.342 9.611 201 HG3 GLN 27 HG2 GLN 27 3.465 -24.974 10.715 202 HE21 GLN 27 HE21 GLN 27 2.455 -23.143 10.078 203 HE22 GLN 27 HE22 GLN 27 1.533 -23.013 8.614 204 H VAL 28 H VAL 28 6.719 -23.581 7.592 205 HA VAL 28 HA VAL 28 8.699 -22.629 7.126 206 HB VAL 28 HB VAL 28 10.377 -22.628 8.813 207 HG11 VAL 28 HG11 VAL 28 9.031 -22.189 10.824 208 HG12 VAL 28 HG12 VAL 28 7.643 -22.935 10.032 209 HG13 VAL 28 HG13 VAL 28 8.350 -21.462 9.368 210 HG21 VAL 28 HG21 VAL 28 10.676 -25.014 9.179 211 HG22 VAL 28 HG22 VAL 28 9.103 -25.107 9.970 212 HG23 VAL 28 HG23 VAL 28 10.408 -24.179 10.710 213 H LYS 29 H LYS 29 8.216 -25.388 6.002 214 HA LYS 29 HA LYS 29 10.805 -26.527 5.609 215 HB2 LYS 29 HB3 LYS 29 9.640 -27.803 3.770 216 HB3 LYS 29 HB2 LYS 29 8.928 -27.980 5.367 217 HG2 LYS 29 HG3 LYS 29 7.294 -26.165 4.683 218 HG3 LYS 29 HG2 LYS 29 7.904 -26.383 3.041 219 HD2 LYS 29 HD3 LYS 29 7.201 -28.667 3.010 220 HD3 LYS 29 HD2 LYS 29 6.800 -28.623 4.728 221 HE2 LYS 29 HE3 LYS 29 5.103 -26.855 4.175 222 HE3 LYS 29 HE2 LYS 29 5.406 -27.195 2.472 223 HZ1 LYS 29 HZ1 LYS 29 4.300 -29.040 4.519 224 HZ2 LYS 29 HZ2 LYS 29 4.821 -29.558 2.989 225 HZ3 LYS 29 HZ3 LYS 29 3.533 -28.464 3.117 226 H ALA 30 H ALA 30 8.977 -23.994 4.193 227 HA ALA 30 HA ALA 30 11.249 -23.022 2.779 228 HB1 ALA 30 HB1 ALA 30 8.913 -23.925 1.099 229 HB2 ALA 30 HB2 ALA 30 10.496 -24.701 1.157 230 HB3 ALA 30 HB3 ALA 30 10.340 -23.059 0.531 231 H ILE 31 H ILE 31 11.022 -21.088 3.715 232 HA ILE 31 HA ILE 31 8.637 -19.531 2.963 233 HB ILE 31 HB ILE 31 10.104 -19.290 5.611 234 HG12 ILE 31 HG13 ILE 31 7.347 -20.384 5.005 235 HG13 ILE 31 HG12 ILE 31 8.737 -21.323 5.534 236 HG21 ILE 31 HG21 ILE 31 7.629 -17.883 4.621 237 HG22 ILE 31 HG22 ILE 31 9.226 -17.161 4.813 238 HG23 ILE 31 HG23 ILE 31 8.337 -17.726 6.228 239 HD11 ILE 31 HD11 ILE 31 7.183 -20.933 7.354 240 HD12 ILE 31 HD12 ILE 31 7.338 -19.190 7.131 241 HD13 ILE 31 HD13 ILE 31 8.726 -20.138 7.666 242 H ASN 32 H ASN 32 9.135 -17.198 2.744 243 HA ASN 32 HA ASN 32 11.826 -16.873 1.693 244 HB2 ASN 32 HB3 ASN 32 9.356 -15.141 1.537 245 HB3 ASN 32 HB2 ASN 32 10.924 -14.630 0.919 246 HD21 ASN 32 HD21 ASN 32 8.215 -16.759 0.466 247 HD22 ASN 32 HD22 ASN 32 8.659 -17.306 -1.113 248 H PHE 33 H PHE 33 9.679 -15.029 3.880 249 HA PHE 33 HA PHE 33 12.006 -14.367 5.517 250 HB2 PHE 33 HB3 PHE 33 10.159 -12.302 4.301 251 HB3 PHE 33 HB2 PHE 33 11.279 -11.964 5.615 252 HD1 PHE 33 HD1 PHE 33 10.840 -12.149 2.092 253 HD2 PHE 33 HD2 PHE 33 13.768 -12.374 5.174 254 HE1 PHE 33 HE1 PHE 33 12.607 -11.685 0.443 255 HE2 PHE 33 HE2 PHE 33 15.537 -11.908 3.533 256 HZ PHE 33 HZ PHE 33 14.962 -11.562 1.163 257 H LEU 34 H LEU 34 11.549 -13.979 7.654 258 HA LEU 34 HA LEU 34 8.887 -14.653 8.600 259 HB2 LEU 34 HB3 LEU 34 11.454 -13.953 10.034 260 HB3 LEU 34 HB2 LEU 34 9.945 -14.228 10.875 261 HG LEU 34 HG LEU 34 11.224 -16.214 11.056 262 HD11 LEU 34 HD11 LEU 34 9.155 -16.609 8.904 263 HD12 LEU 34 HD12 LEU 34 8.854 -16.560 10.642 264 HD13 LEU 34 HD13 LEU 34 9.818 -17.865 9.948 265 HD21 LEU 34 HD21 LEU 34 11.544 -16.155 8.059 266 HD22 LEU 34 HD22 LEU 34 12.085 -17.449 9.127 267 HD23 LEU 34 HD23 LEU 34 12.807 -15.844 9.250 268 HA PRO 35 HA PRO 35 7.552 -10.477 8.382 269 HB2 PRO 35 HB3 PRO 35 5.611 -11.100 10.495 270 HB3 PRO 35 HB2 PRO 35 5.328 -10.635 8.818 271 HG2 PRO 35 HG3 PRO 35 4.879 -13.140 9.719 272 HG3 PRO 35 HG2 PRO 35 5.415 -12.805 8.061 273 HD2 PRO 35 HD3 PRO 35 6.979 -13.805 10.399 274 HD3 PRO 35 HD2 PRO 35 7.110 -14.240 8.683 275 H VAL 36 H VAL 36 7.866 -8.558 9.405 276 HA VAL 36 HA VAL 36 9.402 -8.249 11.682 277 HB VAL 36 HB VAL 36 8.995 -6.441 10.076 278 HG11 VAL 36 HG11 VAL 36 6.914 -5.139 10.147 279 HG12 VAL 36 HG12 VAL 36 6.229 -6.320 11.265 280 HG13 VAL 36 HG13 VAL 36 6.648 -6.802 9.621 281 HG21 VAL 36 HG21 VAL 36 9.835 -5.822 12.256 282 HG22 VAL 36 HG22 VAL 36 8.193 -5.731 12.894 283 HG23 VAL 36 HG23 VAL 36 8.726 -4.582 11.668 284 H ASP 37 H ASP 37 8.944 -7.733 13.839 285 HA ASP 37 HA ASP 37 7.803 -7.648 15.819 286 HB2 ASP 37 HB3 ASP 37 5.860 -6.609 14.865 287 HB3 ASP 37 HB2 ASP 37 5.348 -8.116 14.115 288 H TYR 38 H TYR 38 7.411 -10.300 13.599 289 HA TYR 38 HA TYR 38 6.449 -12.207 15.456 290 HB2 TYR 38 HB3 TYR 38 6.416 -12.364 12.909 291 HB3 TYR 38 HB2 TYR 38 8.104 -12.847 13.016 292 HD1 TYR 38 HD1 TYR 38 8.691 -15.091 13.542 293 HD2 TYR 38 HD2 TYR 38 4.676 -13.777 14.038 294 HE1 TYR 38 HE1 TYR 38 7.975 -17.416 13.915 295 HE2 TYR 38 HE2 TYR 38 3.952 -16.092 14.416 296 HH TYR 38 HH TYR 38 4.723 -18.365 13.888 297 H GLU 39 H GLU 39 7.511 -13.716 16.696 298 HA GLU 39 HA GLU 39 10.375 -13.194 17.121 299 HB2 GLU 39 HB3 GLU 39 8.241 -14.043 19.078 300 HB3 GLU 39 HB2 GLU 39 9.956 -13.996 19.455 301 HG2 GLU 39 HG3 GLU 39 10.021 -11.626 19.179 302 HG3 GLU 39 HG2 GLU 39 8.367 -11.605 18.562 303 H ILE 40 H ILE 40 11.762 -14.873 17.348 304 HA ILE 40 HA ILE 40 10.673 -17.607 17.173 305 HB ILE 40 HB ILE 40 12.719 -18.301 16.035 306 HG12 ILE 40 HG13 ILE 40 13.435 -15.360 15.990 307 HG13 ILE 40 HG12 ILE 40 14.196 -16.570 17.015 308 HG21 ILE 40 HG21 ILE 40 12.337 -17.180 13.867 309 HG22 ILE 40 HG22 ILE 40 11.321 -15.992 14.687 310 HG23 ILE 40 HG23 ILE 40 10.842 -17.689 14.650 311 HD11 ILE 40 HD11 ILE 40 14.242 -16.538 14.011 312 HD12 ILE 40 HD12 ILE 40 15.018 -17.734 15.051 313 HD13 ILE 40 HD13 ILE 40 15.558 -16.056 15.082 314 H GLU 41 H GLU 41 12.179 -19.247 18.153 315 HA GLU 41 HA GLU 41 13.818 -18.122 20.314 316 HB2 GLU 41 HB3 GLU 41 11.575 -18.674 21.219 317 HB3 GLU 41 HB2 GLU 41 11.793 -20.336 20.687 318 HG2 GLU 41 HG3 GLU 41 13.662 -20.609 22.191 319 HG3 GLU 41 HG2 GLU 41 13.548 -18.919 22.678 320 H TYR 42 H TYR 42 15.588 -19.324 20.883 321 HA TYR 42 HA TYR 42 16.390 -21.381 18.996 322 HB2 TYR 42 HB3 TYR 42 17.925 -20.032 21.226 323 HB3 TYR 42 HB2 TYR 42 18.608 -21.182 20.083 324 HD1 TYR 42 HD1 TYR 42 18.787 -20.560 17.675 325 HD2 TYR 42 HD2 TYR 42 17.624 -17.751 20.650 326 HE1 TYR 42 HE1 TYR 42 19.312 -18.719 16.131 327 HE2 TYR 42 HE2 TYR 42 18.140 -15.903 19.117 328 HH TYR 42 HH TYR 42 18.714 -16.355 15.801 329 H VAL 43 H VAL 43 15.532 -23.324 19.478 330 HA VAL 43 HA VAL 43 15.627 -24.215 22.271 331 HB VAL 43 HB VAL 43 14.100 -26.033 21.589 332 HG11 VAL 43 HG11 VAL 43 13.202 -23.984 22.532 333 HG12 VAL 43 HG12 VAL 43 12.105 -24.633 21.311 334 HG13 VAL 43 HG13 VAL 43 13.134 -23.252 20.929 335 HG21 VAL 43 HG21 VAL 43 14.051 -24.614 18.923 336 HG22 VAL 43 HG22 VAL 43 12.985 -25.934 19.404 337 HG23 VAL 43 HG23 VAL 43 14.717 -26.216 19.242 338 H CYS 44 H CYS 44 16.140 -26.536 22.595 339 HA CYS 44 HA CYS 44 18.519 -27.177 21.005 340 HB2 CYS 44 HB3 CYS 44 18.731 -26.718 23.486 341 HB3 CYS 44 HB2 CYS 44 17.822 -28.199 23.761 342 H ARG 45 H ARG 45 18.960 -29.739 21.467 343 HA ARG 45 HA ARG 45 17.350 -31.084 19.649 344 HB2 ARG 45 HB3 ARG 45 19.568 -31.676 21.415 345 HB3 ARG 45 HB2 ARG 45 18.462 -33.038 21.315 346 HG2 ARG 45 HG3 ARG 45 19.655 -31.658 18.923 347 HG3 ARG 45 HG2 ARG 45 20.331 -33.101 19.681 348 HD2 ARG 45 HD3 ARG 45 18.083 -34.192 19.312 349 HD3 ARG 45 HD2 ARG 45 17.670 -32.801 18.310 350 HE ARG 45 HE ARG 45 20.074 -33.709 17.325 351 HH11 ARG 45 HH11 ARG 45 16.895 -35.095 17.814 352 HH12 ARG 45 HH12 ARG 45 17.044 -36.227 16.510 353 HH21 ARG 45 HH21 ARG 45 20.270 -35.160 15.603 354 HH22 ARG 45 HH22 ARG 45 18.965 -36.236 15.218 355 H GLY 46 H GLY 46 15.350 -31.806 19.799 356 HA2 GLY 46 HA3 GLY 46 13.501 -32.904 20.613 357 HA3 GLY 46 HA2 GLY 46 14.459 -33.398 22.001 358 H GLU 47 H GLU 47 14.356 -32.247 23.870 359 HA GLU 47 HA GLU 47 12.971 -29.699 23.915 360 HB2 GLU 47 HB3 GLU 47 11.560 -30.526 25.880 361 HB3 GLU 47 HB2 GLU 47 11.072 -31.033 24.271 362 HG2 GLU 47 HG3 GLU 47 12.259 -33.187 24.672 363 HG3 GLU 47 HG2 GLU 47 12.517 -32.664 26.338 364 H ARG 48 H ARG 48 15.592 -30.082 24.193 365 HA ARG 48 HA ARG 48 16.255 -30.167 27.019 366 HB2 ARG 48 HB3 ARG 48 17.865 -29.792 24.499 367 HB3 ARG 48 HB2 ARG 48 18.569 -29.537 26.087 368 HG2 ARG 48 HG3 ARG 48 17.228 -32.116 25.360 369 HG3 ARG 48 HG2 ARG 48 18.923 -31.801 24.972 370 HD2 ARG 48 HD3 ARG 48 17.663 -31.766 27.716 371 HD3 ARG 48 HD2 ARG 48 18.763 -32.989 27.076 372 HE ARG 48 HE ARG 48 19.532 -30.188 27.594 373 HH11 ARG 48 HH11 ARG 48 20.316 -33.601 27.430 374 HH12 ARG 48 HH12 ARG 48 21.925 -33.381 28.050 375 HH21 ARG 48 HH21 ARG 48 21.670 -29.917 28.408 376 HH22 ARG 48 HH22 ARG 48 22.687 -31.311 28.609 377 H GLU 49 H GLU 49 16.402 -28.414 28.279 378 HA GLU 49 HA GLU 49 15.678 -25.856 27.210 379 HB2 GLU 49 HB3 GLU 49 16.479 -26.697 29.999 380 HB3 GLU 49 HB2 GLU 49 15.880 -25.099 29.565 381 HG2 GLU 49 HG3 GLU 49 13.757 -26.031 28.901 382 HG3 GLU 49 HG2 GLU 49 14.348 -27.666 29.193 383 H VAL 50 H VAL 50 16.925 -23.964 27.303 384 HA VAL 50 HA VAL 50 19.830 -24.422 27.443 385 HB VAL 50 HB VAL 50 20.152 -22.900 25.545 386 HG11 VAL 50 HG11 VAL 50 18.312 -25.198 24.902 387 HG12 VAL 50 HG12 VAL 50 20.059 -25.291 25.118 388 HG13 VAL 50 HG13 VAL 50 19.386 -24.387 23.761 389 HG21 VAL 50 HG21 VAL 50 18.273 -22.212 24.138 390 HG22 VAL 50 HG22 VAL 50 18.126 -21.560 25.771 391 HG23 VAL 50 HG23 VAL 50 17.146 -22.943 25.280 392 H VAL 51 H VAL 51 21.076 -22.690 28.185 393 HA VAL 51 HA VAL 51 19.530 -20.410 29.214 394 HB VAL 51 HB VAL 51 20.747 -21.458 31.002 395 HG11 VAL 51 HG11 VAL 51 23.166 -21.733 31.007 396 HG12 VAL 51 HG12 VAL 51 23.247 -21.115 29.357 397 HG13 VAL 51 HG13 VAL 51 22.428 -22.641 29.687 398 HG21 VAL 51 HG21 VAL 51 22.150 -19.616 31.782 399 HG22 VAL 51 HG22 VAL 51 20.662 -19.021 31.043 400 HG23 VAL 51 HG23 VAL 51 22.180 -18.946 30.151 401 H GLY 52 H GLY 52 19.374 -19.115 27.524 402 HA2 GLY 52 HA3 GLY 52 21.779 -17.744 26.660 403 HA3 GLY 52 HA2 GLY 52 20.908 -18.606 25.395 404 HA PRO 53 HA PRO 53 18.768 -14.484 26.058 405 HB2 PRO 53 HB3 PRO 53 19.794 -13.048 24.028 406 HB3 PRO 53 HB2 PRO 53 20.577 -13.098 25.611 407 HG2 PRO 53 HG3 PRO 53 21.273 -14.583 23.110 408 HG3 PRO 53 HG2 PRO 53 22.344 -13.803 24.288 409 HD2 PRO 53 HD3 PRO 53 21.826 -16.501 24.231 410 HD3 PRO 53 HD2 PRO 53 22.323 -15.610 25.685 411 H LYS 54 H LYS 54 17.556 -16.618 25.174 412 HA LYS 54 HA LYS 54 17.334 -16.697 22.303 413 HB2 LYS 54 HB3 LYS 54 15.748 -18.579 22.726 414 HB3 LYS 54 HB2 LYS 54 17.342 -18.808 23.426 415 HG2 LYS 54 HG3 LYS 54 16.535 -18.348 25.617 416 HG3 LYS 54 HG2 LYS 54 14.979 -17.801 24.990 417 HD2 LYS 54 HD3 LYS 54 14.678 -20.131 24.060 418 HD3 LYS 54 HD2 LYS 54 16.090 -20.598 25.011 419 HE2 LYS 54 HE3 LYS 54 14.991 -20.022 27.053 420 HE3 LYS 54 HE2 LYS 54 13.638 -19.297 26.184 421 HZ1 LYS 54 HZ1 LYS 54 13.108 -21.505 25.293 422 HZ2 LYS 54 HZ2 LYS 54 13.046 -21.480 26.986 423 HZ3 LYS 54 HZ3 LYS 54 14.371 -22.178 26.204 424 H VAL 55 H VAL 55 16.525 -14.615 21.976 425 HA VAL 55 HA VAL 55 13.674 -14.697 21.573 426 HB VAL 55 HB VAL 55 13.511 -12.228 22.383 427 HG11 VAL 55 HG11 VAL 55 13.603 -14.450 24.419 428 HG12 VAL 55 HG12 VAL 55 12.231 -14.038 23.390 429 HG13 VAL 55 HG13 VAL 55 12.788 -12.897 24.615 430 HG21 VAL 55 HG21 VAL 55 15.802 -13.174 24.103 431 HG22 VAL 55 HG22 VAL 55 14.898 -11.675 24.318 432 HG23 VAL 55 HG23 VAL 55 15.876 -11.914 22.871 433 H ARG 56 H ARG 56 13.345 -13.964 19.567 434 HA ARG 56 HA ARG 56 15.112 -11.886 18.517 435 HB2 ARG 56 HB3 ARG 56 14.561 -14.509 17.117 436 HB3 ARG 56 HB2 ARG 56 15.340 -13.123 16.370 437 HG2 ARG 56 HG3 ARG 56 16.411 -14.664 18.726 438 HG3 ARG 56 HG2 ARG 56 16.943 -14.840 17.053 439 HD2 ARG 56 HD3 ARG 56 17.697 -12.528 17.033 440 HD3 ARG 56 HD2 ARG 56 17.102 -12.301 18.677 441 HE ARG 56 HE ARG 56 19.285 -14.175 18.001 442 HH11 ARG 56 HH11 ARG 56 17.844 -11.752 20.067 443 HH12 ARG 56 HH12 ARG 56 19.182 -11.697 21.165 444 HH21 ARG 56 HH21 ARG 56 21.050 -14.145 19.471 445 HH22 ARG 56 HH22 ARG 56 21.011 -13.061 20.829 446 H LYS 57 H LYS 57 13.533 -10.389 18.413 447 HA LYS 57 HA LYS 57 11.089 -10.997 16.951 448 HB2 LYS 57 HB3 LYS 57 10.852 -9.633 18.954 449 HB3 LYS 57 HB2 LYS 57 12.035 -8.483 18.351 450 HG2 LYS 57 HG3 LYS 57 10.500 -7.960 16.477 451 HG3 LYS 57 HG2 LYS 57 9.303 -9.027 17.213 452 HD2 LYS 57 HD3 LYS 57 10.516 -6.625 18.576 453 HD3 LYS 57 HD2 LYS 57 8.962 -6.621 17.740 454 HE2 LYS 57 HE3 LYS 57 8.083 -8.259 19.275 455 HE3 LYS 57 HE2 LYS 57 9.655 -8.423 20.059 456 HZ1 LYS 57 HZ1 LYS 57 8.064 -5.912 19.985 457 HZ2 LYS 57 HZ2 LYS 57 9.509 -6.178 20.839 458 HZ3 LYS 57 HZ3 LYS 57 8.095 -6.998 21.289 459 H CYS 58 H CYS 58 10.922 -10.615 14.829 460 HA CYS 58 HA CYS 58 13.133 -9.699 13.335 461 HB2 CYS 58 HB3 CYS 58 11.409 -11.243 12.443 462 HB3 CYS 58 HB2 CYS 58 10.254 -9.913 12.430 463 H LEU 59 H LEU 59 13.598 -7.781 12.413 464 HA LEU 59 HA LEU 59 12.232 -5.484 13.610 465 HB2 LEU 59 HB3 LEU 59 14.941 -5.670 12.284 466 HB3 LEU 59 HB2 LEU 59 14.290 -4.261 13.100 467 HG LEU 59 HG LEU 59 14.901 -6.897 14.445 468 HD11 LEU 59 HD11 LEU 59 16.418 -4.295 14.537 469 HD12 LEU 59 HD12 LEU 59 16.922 -5.743 13.666 470 HD13 LEU 59 HD13 LEU 59 16.805 -5.767 15.426 471 HD21 LEU 59 HD21 LEU 59 13.101 -5.651 15.526 472 HD22 LEU 59 HD22 LEU 59 14.121 -4.213 15.584 473 HD23 LEU 59 HD23 LEU 59 14.560 -5.645 16.517 474 H ALA 60 H ALA 60 12.638 -3.419 12.098 475 HA ALA 60 HA ALA 60 11.073 -3.819 9.741 476 HB1 ALA 60 HB1 ALA 60 10.984 -1.739 11.045 477 HB2 ALA 60 HB2 ALA 60 11.390 -1.435 9.356 478 HB3 ALA 60 HB3 ALA 60 12.650 -1.389 10.589 479 H ASN 61 H ASN 61 14.313 -4.242 10.422 480 HA ASN 61 HA ASN 61 15.026 -4.135 7.571 481 HB2 ASN 61 HB3 ASN 61 17.398 -4.201 8.372 482 HB3 ASN 61 HB2 ASN 61 16.526 -2.757 8.874 483 HD21 ASN 61 HD21 ASN 61 18.129 -5.624 9.893 484 HD22 ASN 61 HD22 ASN 61 18.038 -5.328 11.593 485 H GLY 62 H GLY 62 16.429 -5.954 6.838 486 HA2 GLY 62 HA3 GLY 62 15.064 -8.387 7.566 487 HA3 GLY 62 HA2 GLY 62 16.250 -8.201 6.288 488 H SER 63 H SER 63 16.326 -7.796 9.822 489 HA SER 63 HA SER 63 18.142 -10.024 10.132 490 HB2 SER 63 HB3 SER 63 19.074 -7.245 10.909 491 HB3 SER 63 HB2 SER 63 19.964 -8.753 11.119 492 HG SER 63 HG SER 63 19.353 -8.656 8.585 493 H TRP 64 H TRP 64 18.620 -10.385 12.465 494 HA TRP 64 HA TRP 64 16.227 -9.727 14.006 495 HB2 TRP 64 HB3 TRP 64 18.466 -11.661 14.656 496 HB3 TRP 64 HB2 TRP 64 16.924 -11.527 15.497 497 HD1 TRP 64 HD1 TRP 64 18.546 -13.136 12.499 498 HE1 TRP 64 HE1 TRP 64 16.830 -14.610 11.271 499 HE3 TRP 64 HE3 TRP 64 14.300 -11.643 14.925 500 HZ2 TRP 64 HZ2 TRP 64 14.047 -15.080 11.321 501 HZ3 TRP 64 HZ3 TRP 64 12.152 -12.652 14.270 502 HH2 TRP 64 HH2 TRP 64 12.031 -14.334 12.505 503 H THR 65 H THR 65 16.870 -9.624 16.532 504 HA THR 65 HA THR 65 18.029 -7.095 16.876 505 HB THR 65 HB THR 65 17.992 -7.664 19.331 506 HG1 THR 65 HG1 THR 65 17.615 -9.662 19.945 507 HG21 THR 65 HG21 THR 65 15.539 -7.773 19.466 508 HG22 THR 65 HG22 THR 65 15.471 -8.196 17.756 509 HG23 THR 65 HG23 THR 65 16.076 -6.615 18.250 510 H ASP 66 H ASP 66 19.348 -10.337 17.286 511 HA ASP 66 HA ASP 66 22.050 -9.235 17.153 512 HB2 ASP 66 HB3 ASP 66 21.339 -9.599 19.619 513 HB3 ASP 66 HB2 ASP 66 21.367 -11.322 19.235 514 H MET 67 H MET 67 23.323 -10.562 15.827 515 HA MET 67 HA MET 67 22.325 -13.329 15.571 516 HB2 MET 67 HB3 MET 67 22.203 -11.891 13.489 517 HB3 MET 67 HB2 MET 67 23.958 -11.834 13.511 518 HG2 MET 67 HG3 MET 67 23.280 -13.486 11.947 519 HG3 MET 67 HG2 MET 67 23.982 -14.308 13.340 520 HE1 MET 67 HE1 MET 67 21.034 -16.580 11.859 521 HE2 MET 67 HE2 MET 67 22.782 -16.468 12.071 522 HE3 MET 67 HE3 MET 67 21.960 -15.403 10.928 523 H ASP 68 H ASP 68 23.689 -13.320 17.612 524 HA ASP 68 HA ASP 68 25.559 -15.299 16.886 525 HB2 ASP 68 HB3 ASP 68 27.108 -13.344 16.783 526 HB3 ASP 68 HB2 ASP 68 26.715 -12.983 18.464 527 H THR 69 H THR 69 24.176 -16.620 18.089 528 HA THR 69 HA THR 69 23.644 -15.696 20.826 529 HB THR 69 HB THR 69 21.979 -17.712 19.341 530 HG1 THR 69 HG1 THR 69 21.280 -16.118 18.163 531 HG21 THR 69 HG21 THR 69 21.702 -17.592 21.782 532 HG22 THR 69 HG22 THR 69 20.259 -17.048 20.927 533 HG23 THR 69 HG23 THR 69 21.358 -15.867 21.639 534 HA PRO 70 HA PRO 70 26.088 -19.329 21.825 535 HB2 PRO 70 HB3 PRO 70 26.998 -18.189 24.182 536 HB3 PRO 70 HB2 PRO 70 27.750 -17.992 22.599 537 HG2 PRO 70 HG3 PRO 70 26.449 -15.997 24.174 538 HG3 PRO 70 HG2 PRO 70 27.147 -15.821 22.557 539 HD2 PRO 70 HD3 PRO 70 24.326 -16.227 23.361 540 HD3 PRO 70 HD2 PRO 70 24.990 -15.450 21.906 541 H SER 71 H SER 71 23.317 -19.479 22.352 542 HA SER 71 HA SER 71 22.846 -19.977 25.127 543 HB2 SER 71 HB3 SER 71 20.858 -21.320 23.807 544 HB3 SER 71 HB2 SER 71 20.814 -19.598 24.195 545 HG SER 71 HG SER 71 21.782 -20.745 21.770 546 H ARG 72 H ARG 72 23.312 -21.766 26.271 547 HA ARG 72 HA ARG 72 24.201 -24.139 24.764 548 HB2 ARG 72 HB3 ARG 72 25.678 -24.688 26.529 549 HB3 ARG 72 HB2 ARG 72 25.871 -22.958 26.283 550 HG2 ARG 72 HG3 ARG 72 24.384 -22.541 28.191 551 HG3 ARG 72 HG2 ARG 72 24.252 -24.281 28.448 552 HD2 ARG 72 HD3 ARG 72 25.890 -23.576 29.965 553 HD3 ARG 72 HD2 ARG 72 26.791 -24.279 28.623 554 HE ARG 72 HE ARG 72 26.737 -21.688 27.939 555 HH11 ARG 72 HH11 ARG 72 27.596 -23.331 30.912 556 HH12 ARG 72 HH12 ARG 72 28.647 -22.053 31.459 557 HH21 ARG 72 HH21 ARG 72 28.111 -20.012 28.663 558 HH22 ARG 72 HH22 ARG 72 28.923 -20.168 30.191 559 H CYS 73 H CYS 73 23.562 -26.220 25.503 560 HA CYS 73 HA CYS 73 20.857 -26.186 26.559 561 HB2 CYS 73 HB3 CYS 73 22.447 -28.562 25.578 562 HB3 CYS 73 HB2 CYS 73 20.701 -28.454 25.775 563 H VAL 74 H VAL 74 20.538 -26.336 28.687 564 HA VAL 74 HA VAL 74 21.776 -28.482 30.161 565 HB VAL 74 HB VAL 74 23.480 -26.723 30.389 566 HG11 VAL 74 HG11 VAL 74 22.066 -24.762 30.140 567 HG12 VAL 74 HG12 VAL 74 23.009 -24.673 31.626 568 HG13 VAL 74 HG13 VAL 74 21.298 -25.101 31.691 569 HG21 VAL 74 HG21 VAL 74 23.188 -28.308 32.198 570 HG22 VAL 74 HG22 VAL 74 21.948 -27.287 32.928 571 HG23 VAL 74 HG23 VAL 74 23.618 -26.725 32.843 572 H ARG 75 H ARG 75 20.440 -29.228 31.713 573 HA ARG 75 HA ARG 75 18.492 -27.515 32.968 574 HB2 ARG 75 HB3 ARG 75 16.525 -28.807 32.304 575 HB3 ARG 75 HB2 ARG 75 17.314 -28.119 30.895 576 HG2 ARG 75 HG3 ARG 75 18.370 -30.323 30.472 577 HG3 ARG 75 HG2 ARG 75 17.440 -30.983 31.819 578 HD2 ARG 75 HD3 ARG 75 16.465 -29.955 29.175 579 HD3 ARG 75 HD2 ARG 75 16.183 -31.526 29.921 580 HE ARG 75 HE ARG 75 15.042 -29.115 31.162 581 HH11 ARG 75 HH11 ARG 75 14.586 -32.226 29.599 582 HH12 ARG 75 HH12 ARG 75 12.860 -32.207 29.799 583 HH21 ARG 75 HH21 ARG 75 12.812 -29.089 31.438 584 HH22 ARG 75 HH22 ARG 75 11.839 -30.426 30.872 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 11.587 -6.145 -8.941 2 H2 GLY 1 HT2 GLY 1 11.030 -5.457 -7.492 3 H3 GLY 1 HT3 GLY 1 9.987 -6.403 -8.439 4 HA2 GLY 1 HA2 GLY 1 11.296 -8.361 -8.024 5 HA3 GLY 1 HA3 GLY 1 12.424 -7.397 -7.080 6 HA PRO 2 HA PRO 2 9.180 -9.192 -4.205 7 HB2 PRO 2 HB3 PRO 2 11.038 -10.104 -2.404 8 HB3 PRO 2 HB2 PRO 2 10.368 -11.086 -3.712 9 HG2 PRO 2 HG3 PRO 2 12.968 -9.614 -3.587 10 HG3 PRO 2 HG2 PRO 2 12.626 -11.230 -4.233 11 HD2 PRO 2 HD3 PRO 2 12.927 -9.086 -5.836 12 HD3 PRO 2 HD2 PRO 2 11.787 -10.392 -6.219 13 H THR 3 H THR 3 8.356 -7.775 -2.820 14 HA THR 3 HA THR 3 10.189 -6.069 -1.296 15 HB THR 3 HB THR 3 9.507 -4.667 -3.120 16 HG1 THR 3 HG1 THR 3 7.777 -3.782 -1.089 17 HG21 THR 3 HG21 THR 3 6.659 -5.367 -2.405 18 HG22 THR 3 HG22 THR 3 7.513 -5.814 -3.882 19 HG23 THR 3 HG23 THR 3 7.137 -4.121 -3.556 20 H SER 4 H SER 4 9.867 -6.968 0.637 21 HA SER 4 HA SER 4 7.298 -6.538 1.911 22 HB2 SER 4 HB3 SER 4 8.616 -9.273 1.881 23 HB3 SER 4 HB2 SER 4 7.193 -8.831 2.824 24 HG SER 4 HG SER 4 6.582 -8.150 0.402 25 H GLU 5 H GLU 5 7.479 -6.394 4.197 26 HA GLU 5 HA GLU 5 10.230 -5.931 5.087 27 HB2 GLU 5 HB3 GLU 5 7.599 -5.208 6.401 28 HB3 GLU 5 HB2 GLU 5 9.194 -4.743 6.980 29 HG2 GLU 5 HG3 GLU 5 9.560 -3.359 5.072 30 HG3 GLU 5 HG2 GLU 5 8.097 -3.960 4.292 31 H GLY 6 H GLY 6 11.045 -7.890 5.615 32 HA2 GLY 6 HA3 GLY 6 10.041 -9.153 7.991 33 HA3 GLY 6 HA2 GLY 6 9.825 -10.123 6.540 34 H CYS 7 H CYS 7 11.333 -10.996 8.643 35 HA CYS 7 HA CYS 7 14.128 -10.632 7.853 36 HB2 CYS 7 HB3 CYS 7 12.947 -12.146 10.195 37 HB3 CYS 7 HB2 CYS 7 14.656 -11.823 9.926 38 H GLN 8 H GLN 8 15.479 -12.489 7.462 39 HA GLN 8 HA GLN 8 14.095 -14.476 5.882 40 HB2 GLN 8 HB3 GLN 8 16.345 -15.247 5.263 41 HB3 GLN 8 HB2 GLN 8 16.160 -13.518 5.017 42 HG2 GLN 8 HG3 GLN 8 17.506 -12.986 6.848 43 HG3 GLN 8 HG2 GLN 8 17.363 -14.601 7.536 44 HE21 GLN 8 HE21 GLN 8 17.882 -16.011 5.088 45 HE22 GLN 8 HE22 GLN 8 19.560 -15.805 4.738 46 H ILE 9 H ILE 9 15.258 -16.758 6.036 47 HA ILE 9 HA ILE 9 14.643 -17.758 8.694 48 HB ILE 9 HB ILE 9 15.219 -19.157 6.080 49 HG12 ILE 9 HG13 ILE 9 12.701 -18.921 7.742 50 HG13 ILE 9 HG12 ILE 9 13.024 -18.077 6.232 51 HG21 ILE 9 HG21 ILE 9 14.582 -20.381 8.757 52 HG22 ILE 9 HG22 ILE 9 16.090 -20.534 7.856 53 HG23 ILE 9 HG23 ILE 9 14.609 -21.251 7.220 54 HD11 ILE 9 HD11 ILE 9 13.080 -20.214 5.052 55 HD12 ILE 9 HD12 ILE 9 11.544 -19.968 5.884 56 HD13 ILE 9 HD13 ILE 9 12.753 -21.057 6.566 57 H ILE 10 H ILE 10 16.165 -18.075 10.146 58 HA ILE 10 HA ILE 10 18.948 -17.838 9.563 59 HB ILE 10 HB ILE 10 17.654 -18.861 12.101 60 HG12 ILE 10 HG13 ILE 10 18.479 -16.037 11.382 61 HG13 ILE 10 HG12 ILE 10 16.819 -16.619 11.447 62 HG21 ILE 10 HG21 ILE 10 19.740 -18.121 13.168 63 HG22 ILE 10 HG22 ILE 10 20.387 -17.694 11.583 64 HG23 ILE 10 HG23 ILE 10 20.020 -19.377 11.961 65 HD11 ILE 10 HD11 ILE 10 17.438 -15.360 13.444 66 HD12 ILE 10 HD12 ILE 10 18.721 -16.523 13.775 67 HD13 ILE 10 HD13 ILE 10 17.035 -17.035 13.823 68 H HIS 11 H HIS 11 20.364 -19.384 9.073 69 HA HIS 11 HA HIS 11 19.479 -21.988 8.409 70 HB2 HIS 11 HB3 HIS 11 21.546 -20.493 7.595 71 HB3 HIS 11 HB2 HIS 11 22.384 -21.461 8.803 72 HD1 HIS 11 HD1 HIS 11 23.101 -23.765 8.103 73 HD2 HIS 11 HD2 HIS 11 20.335 -22.066 5.499 74 HE1 HIS 11 HE1 HIS 11 22.953 -25.340 6.142 75 HE2 HIS 11 HE2 HIS 11 21.428 -24.186 4.494 76 HA PRO 12 HA PRO 12 19.458 -23.816 12.492 77 HB2 PRO 12 HB3 PRO 12 19.913 -26.251 10.817 78 HB3 PRO 12 HB2 PRO 12 18.751 -25.983 12.123 79 HG2 PRO 12 HG3 PRO 12 17.966 -25.925 9.585 80 HG3 PRO 12 HG2 PRO 12 17.302 -24.782 10.768 81 HD2 PRO 12 HD3 PRO 12 19.298 -24.325 8.601 82 HD3 PRO 12 HD2 PRO 12 18.070 -23.225 9.257 83 HA PRO 13 HA PRO 13 23.903 -24.117 12.871 84 HB2 PRO 13 HB3 PRO 13 23.711 -23.590 15.638 85 HB3 PRO 13 HB2 PRO 13 23.997 -22.413 14.357 86 HG2 PRO 13 HG3 PRO 13 21.719 -22.581 15.983 87 HG3 PRO 13 HG2 PRO 13 21.875 -21.630 14.498 88 HD2 PRO 13 HD3 PRO 13 20.609 -24.292 14.926 89 HD3 PRO 13 HD2 PRO 13 20.169 -22.997 13.792 90 H TRP 14 H TRP 14 24.558 -24.786 15.741 91 HA TRP 14 HA TRP 14 25.015 -27.560 15.433 92 HB2 TRP 14 HB3 TRP 14 26.244 -25.707 16.860 93 HB3 TRP 14 HB2 TRP 14 25.137 -26.243 18.117 94 HD1 TRP 14 HD1 TRP 14 25.896 -28.295 19.495 95 HE1 TRP 14 HE1 TRP 14 27.761 -30.062 19.275 96 HE3 TRP 14 HE3 TRP 14 27.656 -27.040 14.858 97 HZ2 TRP 14 HZ2 TRP 14 29.717 -30.819 17.378 98 HZ3 TRP 14 HZ3 TRP 14 29.518 -28.340 13.911 99 HH2 TRP 14 HH2 TRP 14 30.527 -30.187 15.145 100 H GLU 15 H GLU 15 24.489 -28.884 17.658 101 HA GLU 15 HA GLU 15 22.079 -30.029 17.364 102 HB2 GLU 15 HB3 GLU 15 23.452 -29.638 20.026 103 HB3 GLU 15 HB2 GLU 15 22.269 -30.880 19.647 104 HG2 GLU 15 HG3 GLU 15 24.997 -30.596 18.408 105 HG3 GLU 15 HG2 GLU 15 24.521 -31.772 19.634 106 H GLY 16 H GLY 16 20.241 -28.892 17.103 107 HA2 GLY 16 HA3 GLY 16 18.532 -28.246 19.067 108 HA3 GLY 16 HA2 GLY 16 19.497 -26.781 18.931 109 H GLY 17 H GLY 17 17.278 -25.949 18.395 110 HA2 GLY 17 HA3 GLY 17 17.117 -25.682 15.520 111 HA3 GLY 17 HA2 GLY 17 15.735 -26.495 16.244 112 H ILE 18 H ILE 18 14.713 -24.508 15.204 113 HA ILE 18 HA ILE 18 14.834 -22.278 17.107 114 HB ILE 18 HB ILE 18 14.512 -22.249 14.129 115 HG12 ILE 18 HG13 ILE 18 16.166 -20.714 16.129 116 HG13 ILE 18 HG12 ILE 18 16.739 -22.006 15.076 117 HG21 ILE 18 HG21 ILE 18 13.682 -20.030 16.002 118 HG22 ILE 18 HG22 ILE 18 12.622 -20.951 14.934 119 HG23 ILE 18 HG23 ILE 18 13.847 -19.881 14.252 120 HD11 ILE 18 HD11 ILE 18 15.730 -19.320 14.162 121 HD12 ILE 18 HD12 ILE 18 16.328 -20.613 13.121 122 HD13 ILE 18 HD13 ILE 18 17.419 -19.819 14.257 123 H ARG 19 H ARG 19 13.067 -21.526 17.971 124 HA ARG 19 HA ARG 19 10.580 -23.011 17.486 125 HB2 ARG 19 HB3 ARG 19 11.689 -22.944 19.770 126 HB3 ARG 19 HB2 ARG 19 11.287 -21.236 19.824 127 HG2 ARG 19 HG3 ARG 19 9.646 -22.504 21.049 128 HG3 ARG 19 HG2 ARG 19 8.909 -21.786 19.613 129 HD2 ARG 19 HD3 ARG 19 9.227 -23.958 18.444 130 HD3 ARG 19 HD2 ARG 19 9.798 -24.646 19.964 131 HE ARG 19 HE ARG 19 7.181 -23.402 20.048 132 HH11 ARG 19 HH11 ARG 19 9.016 -26.356 19.686 133 HH12 ARG 19 HH12 ARG 19 7.676 -27.394 20.073 134 HH21 ARG 19 HH21 ARG 19 5.406 -24.750 20.544 135 HH22 ARG 19 HH22 ARG 19 5.623 -26.478 20.555 136 H TYR 20 H TYR 20 8.704 -21.901 16.950 137 HA TYR 20 HA TYR 20 9.125 -19.059 16.329 138 HB2 TYR 20 HB3 TYR 20 7.280 -21.100 15.078 139 HB3 TYR 20 HB2 TYR 20 7.249 -19.380 14.688 140 HD1 TYR 20 HD1 TYR 20 9.295 -22.451 14.520 141 HD2 TYR 20 HD2 TYR 20 8.889 -18.414 13.247 142 HE1 TYR 20 HE1 TYR 20 11.101 -22.791 12.888 143 HE2 TYR 20 HE2 TYR 20 10.689 -18.745 11.605 144 HH TYR 20 HH TYR 20 12.622 -20.227 11.272 145 H ARG 21 H ARG 21 6.543 -18.218 15.998 146 HA ARG 21 HA ARG 21 5.807 -17.977 18.808 147 HB2 ARG 21 HB3 ARG 21 5.898 -16.211 16.630 148 HB3 ARG 21 HB2 ARG 21 4.191 -16.419 16.983 149 HG2 ARG 21 HG3 ARG 21 6.283 -15.584 18.984 150 HG3 ARG 21 HG2 ARG 21 5.182 -14.494 18.141 151 HD2 ARG 21 HD3 ARG 21 3.275 -15.750 19.144 152 HD3 ARG 21 HD2 ARG 21 4.439 -16.678 20.088 153 HE ARG 21 HE ARG 21 4.606 -13.787 20.358 154 HH11 ARG 21 HH11 ARG 21 3.297 -16.780 21.621 155 HH12 ARG 21 HH12 ARG 21 3.022 -16.141 23.213 156 HH21 ARG 21 HH21 ARG 21 4.237 -12.936 22.444 157 HH22 ARG 21 HH22 ARG 21 3.573 -13.955 23.691 158 H GLY 22 H GLY 22 4.322 -18.817 15.706 159 HA2 GLY 22 HA3 GLY 22 2.360 -20.456 17.109 160 HA3 GLY 22 HA2 GLY 22 1.724 -19.122 16.160 161 H LEU 23 H LEU 23 4.292 -21.531 15.641 162 HA LEU 23 HA LEU 23 2.855 -22.447 13.259 163 HB2 LEU 23 HB3 LEU 23 5.744 -21.592 13.366 164 HB3 LEU 23 HB2 LEU 23 5.085 -22.577 12.075 165 HG LEU 23 HG LEU 23 4.119 -19.803 12.764 166 HD11 LEU 23 HD11 LEU 23 5.280 -19.090 10.741 167 HD12 LEU 23 HD12 LEU 23 5.917 -20.720 10.523 168 HD13 LEU 23 HD13 LEU 23 6.409 -19.758 11.917 169 HD21 LEU 23 HD21 LEU 23 2.963 -19.949 10.606 170 HD22 LEU 23 HD22 LEU 23 2.411 -21.194 11.727 171 HD23 LEU 23 HD23 LEU 23 3.523 -21.611 10.424 172 H THR 24 H THR 24 2.695 -24.583 13.202 173 HA THR 24 HA THR 24 4.300 -26.205 15.003 174 HB THR 24 HB THR 24 1.859 -26.645 14.734 175 HG1 THR 24 HG1 THR 24 2.122 -28.830 14.845 176 HG21 THR 24 HG21 THR 24 2.650 -27.567 11.967 177 HG22 THR 24 HG22 THR 24 1.614 -26.194 12.358 178 HG23 THR 24 HG23 THR 24 1.076 -27.833 12.725 179 H ARG 25 H ARG 25 4.843 -28.509 13.762 180 HA ARG 25 HA ARG 25 6.974 -27.650 12.012 181 HB2 ARG 25 HB3 ARG 25 6.299 -30.255 13.334 182 HB3 ARG 25 HB2 ARG 25 7.484 -30.198 12.037 183 HG2 ARG 25 HG3 ARG 25 8.735 -30.040 14.002 184 HG3 ARG 25 HG2 ARG 25 8.657 -28.392 13.381 185 HD2 ARG 25 HD3 ARG 25 8.241 -28.133 15.649 186 HD3 ARG 25 HD2 ARG 25 6.626 -28.130 14.943 187 HE ARG 25 HE ARG 25 7.450 -30.751 15.729 188 HH11 ARG 25 HH11 ARG 25 6.129 -27.743 16.941 189 HH12 ARG 25 HH12 ARG 25 5.406 -28.477 18.345 190 HH21 ARG 25 HH21 ARG 25 6.519 -31.723 17.561 191 HH22 ARG 25 HH22 ARG 25 5.647 -30.752 18.711 192 H ASP 26 H ASP 26 7.360 -29.797 10.339 193 HA ASP 26 HA ASP 26 7.028 -30.195 8.140 194 HB2 ASP 26 HB3 ASP 26 5.102 -31.529 8.993 195 HB3 ASP 26 HB2 ASP 26 4.069 -30.117 8.783 196 H GLN 27 H GLN 27 6.811 -27.467 9.419 197 HA GLN 27 HA GLN 27 6.146 -26.026 6.961 198 HB2 GLN 27 HB3 GLN 27 5.318 -25.286 9.776 199 HB3 GLN 27 HB2 GLN 27 5.277 -24.154 8.431 200 HG2 GLN 27 HG3 GLN 27 3.652 -25.513 7.281 201 HG3 GLN 27 HG2 GLN 27 3.766 -26.756 8.525 202 HE21 GLN 27 HE21 GLN 27 3.877 -24.869 10.715 203 HE22 GLN 27 HE22 GLN 27 2.279 -24.223 10.895 204 H VAL 28 H VAL 28 6.945 -23.550 7.647 205 HA VAL 28 HA VAL 28 8.773 -22.235 7.647 206 HB VAL 28 HB VAL 28 10.061 -22.076 9.586 207 HG11 VAL 28 HG11 VAL 28 7.423 -23.297 10.355 208 HG12 VAL 28 HG12 VAL 28 7.746 -21.600 9.996 209 HG13 VAL 28 HG13 VAL 28 8.456 -22.350 11.426 210 HG21 VAL 28 HG21 VAL 28 10.982 -24.336 9.673 211 HG22 VAL 28 HG22 VAL 28 9.435 -24.948 10.260 212 HG23 VAL 28 HG23 VAL 28 10.373 -23.827 11.247 213 H LYS 29 H LYS 29 8.973 -25.159 6.525 214 HA LYS 29 HA LYS 29 11.806 -25.545 6.298 215 HB2 LYS 29 HB3 LYS 29 11.083 -27.283 4.590 216 HB3 LYS 29 HB2 LYS 29 10.469 -27.513 6.221 217 HG2 LYS 29 HG3 LYS 29 8.346 -26.417 5.497 218 HG3 LYS 29 HG2 LYS 29 8.974 -26.420 3.849 219 HD2 LYS 29 HD3 LYS 29 9.102 -28.837 3.860 220 HD3 LYS 29 HD2 LYS 29 8.612 -28.885 5.556 221 HE2 LYS 29 HE3 LYS 29 6.460 -27.864 4.936 222 HE3 LYS 29 HE2 LYS 29 6.954 -27.881 3.243 223 HZ1 LYS 29 HZ1 LYS 29 7.041 -30.274 3.302 224 HZ2 LYS 29 HZ2 LYS 29 5.513 -29.755 3.824 225 HZ3 LYS 29 HZ3 LYS 29 6.652 -30.294 4.955 226 H ALA 30 H ALA 30 9.384 -23.773 4.677 227 HA ALA 30 HA ALA 30 11.324 -22.591 2.921 228 HB1 ALA 30 HB1 ALA 30 10.079 -23.022 0.854 229 HB2 ALA 30 HB2 ALA 30 8.960 -24.051 1.747 230 HB3 ALA 30 HB3 ALA 30 10.652 -24.519 1.591 231 H ILE 31 H ILE 31 10.723 -20.852 4.332 232 HA ILE 31 HA ILE 31 8.216 -19.555 3.492 233 HB ILE 31 HB ILE 31 9.648 -19.300 6.149 234 HG12 ILE 31 HG13 ILE 31 6.911 -20.368 5.414 235 HG13 ILE 31 HG12 ILE 31 8.282 -21.315 5.981 236 HG21 ILE 31 HG21 ILE 31 8.822 -17.123 5.441 237 HG22 ILE 31 HG22 ILE 31 7.867 -17.738 6.790 238 HG23 ILE 31 HG23 ILE 31 7.222 -17.806 5.150 239 HD11 ILE 31 HD11 ILE 31 8.174 -20.140 8.132 240 HD12 ILE 31 HD12 ILE 31 6.682 -21.000 7.757 241 HD13 ILE 31 HD13 ILE 31 6.766 -19.249 7.557 242 H ASN 32 H ASN 32 8.376 -17.453 2.780 243 HA ASN 32 HA ASN 32 10.909 -16.698 1.738 244 HB2 ASN 32 HB3 ASN 32 8.316 -15.146 1.865 245 HB3 ASN 32 HB2 ASN 32 9.731 -14.669 0.934 246 HD21 ASN 32 HD21 ASN 32 10.319 -15.876 -0.880 247 HD22 ASN 32 HD22 ASN 32 9.193 -16.922 -1.670 248 H PHE 33 H PHE 33 8.758 -14.924 3.963 249 HA PHE 33 HA PHE 33 11.101 -13.995 5.428 250 HB2 PHE 33 HB3 PHE 33 9.083 -12.148 4.142 251 HB3 PHE 33 HB2 PHE 33 10.240 -11.640 5.365 252 HD1 PHE 33 HD1 PHE 33 9.666 -12.211 1.883 253 HD2 PHE 33 HD2 PHE 33 12.708 -11.877 4.846 254 HE1 PHE 33 HE1 PHE 33 11.332 -11.777 0.124 255 HE2 PHE 33 HE2 PHE 33 14.372 -11.443 3.089 256 HZ PHE 33 HZ PHE 33 13.687 -11.391 0.727 257 H LEU 34 H LEU 34 10.742 -13.657 7.542 258 HA LEU 34 HA LEU 34 8.048 -14.106 8.575 259 HB2 LEU 34 HB3 LEU 34 10.744 -13.862 9.922 260 HB3 LEU 34 HB2 LEU 34 9.242 -13.935 10.820 261 HG LEU 34 HG LEU 34 10.189 -16.108 10.861 262 HD11 LEU 34 HD11 LEU 34 7.985 -16.039 8.809 263 HD12 LEU 34 HD12 LEU 34 7.790 -16.075 10.561 264 HD13 LEU 34 HD13 LEU 34 8.491 -17.459 9.724 265 HD21 LEU 34 HD21 LEU 34 10.396 -15.964 7.856 266 HD22 LEU 34 HD22 LEU 34 10.784 -17.369 8.851 267 HD23 LEU 34 HD23 LEU 34 11.740 -15.893 8.996 268 HA PRO 35 HA PRO 35 7.311 -9.742 8.224 269 HB2 PRO 35 HB3 PRO 35 5.211 -9.728 10.070 270 HB3 PRO 35 HB2 PRO 35 5.066 -10.017 8.335 271 HG2 PRO 35 HG3 PRO 35 5.210 -11.979 10.581 272 HG3 PRO 35 HG2 PRO 35 4.238 -12.036 9.098 273 HD2 PRO 35 HD3 PRO 35 6.435 -13.527 9.349 274 HD3 PRO 35 HD2 PRO 35 6.041 -12.744 7.801 275 H VAL 36 H VAL 36 7.891 -7.924 9.271 276 HA VAL 36 HA VAL 36 9.495 -8.103 11.584 277 HB VAL 36 HB VAL 36 10.029 -6.392 10.027 278 HG11 VAL 36 HG11 VAL 36 7.267 -5.267 10.450 279 HG12 VAL 36 HG12 VAL 36 7.870 -6.056 8.992 280 HG13 VAL 36 HG13 VAL 36 8.549 -4.511 9.506 281 HG21 VAL 36 HG21 VAL 36 10.474 -5.803 12.339 282 HG22 VAL 36 HG22 VAL 36 8.864 -5.098 12.488 283 HG23 VAL 36 HG23 VAL 36 10.052 -4.368 11.407 284 H ASP 37 H ASP 37 8.258 -9.049 13.144 285 HA ASP 37 HA ASP 37 7.182 -7.546 15.157 286 HB2 ASP 37 HB3 ASP 37 5.313 -7.074 13.492 287 HB3 ASP 37 HB2 ASP 37 4.912 -8.787 13.573 288 H TYR 38 H TYR 38 7.267 -10.435 13.309 289 HA TYR 38 HA TYR 38 6.380 -12.282 15.262 290 HB2 TYR 38 HB3 TYR 38 6.749 -12.484 12.661 291 HB3 TYR 38 HB2 TYR 38 8.363 -13.000 13.133 292 HD1 TYR 38 HD1 TYR 38 8.727 -15.159 14.131 293 HD2 TYR 38 HD2 TYR 38 4.786 -13.825 13.250 294 HE1 TYR 38 HE1 TYR 38 7.879 -17.445 14.469 295 HE2 TYR 38 HE2 TYR 38 3.931 -16.102 13.587 296 HH TYR 38 HH TYR 38 4.807 -18.429 13.491 297 H GLU 39 H GLU 39 7.552 -13.574 16.675 298 HA GLU 39 HA GLU 39 10.380 -12.871 17.083 299 HB2 GLU 39 HB3 GLU 39 8.255 -13.290 19.201 300 HB3 GLU 39 HB2 GLU 39 9.972 -13.108 19.534 301 HG2 GLU 39 HG3 GLU 39 9.956 -10.856 18.705 302 HG3 GLU 39 HG2 GLU 39 8.291 -11.026 18.149 303 H ILE 40 H ILE 40 11.731 -14.570 17.783 304 HA ILE 40 HA ILE 40 10.508 -17.249 17.728 305 HB ILE 40 HB ILE 40 12.487 -18.106 16.520 306 HG12 ILE 40 HG13 ILE 40 13.140 -15.185 16.089 307 HG13 ILE 40 HG12 ILE 40 14.039 -16.279 17.134 308 HG21 ILE 40 HG21 ILE 40 10.447 -17.647 15.304 309 HG22 ILE 40 HG22 ILE 40 11.847 -17.252 14.305 310 HG23 ILE 40 HG23 ILE 40 10.928 -15.963 15.085 311 HD11 ILE 40 HD11 ILE 40 14.632 -17.639 15.200 312 HD12 ILE 40 HD12 ILE 40 15.164 -15.967 15.010 313 HD13 ILE 40 HD13 ILE 40 13.732 -16.540 14.154 314 H GLU 41 H GLU 41 12.064 -18.955 18.490 315 HA GLU 41 HA GLU 41 13.716 -18.005 20.737 316 HB2 GLU 41 HB3 GLU 41 11.491 -18.634 21.576 317 HB3 GLU 41 HB2 GLU 41 11.636 -20.207 20.810 318 HG2 GLU 41 HG3 GLU 41 13.432 -20.817 22.297 319 HG3 GLU 41 HG2 GLU 41 13.427 -19.206 23.013 320 H TYR 42 H TYR 42 15.135 -19.817 21.587 321 HA TYR 42 HA TYR 42 16.050 -21.518 19.359 322 HB2 TYR 42 HB3 TYR 42 17.680 -20.141 21.497 323 HB3 TYR 42 HB2 TYR 42 18.326 -21.354 20.399 324 HD1 TYR 42 HD1 TYR 42 18.525 -20.860 17.986 325 HD2 TYR 42 HD2 TYR 42 17.319 -17.893 20.785 326 HE1 TYR 42 HE1 TYR 42 19.033 -19.106 16.335 327 HE2 TYR 42 HE2 TYR 42 17.820 -16.132 19.144 328 HH TYR 42 HH TYR 42 18.452 -16.806 15.849 329 H VAL 43 H VAL 43 15.266 -23.497 19.844 330 HA VAL 43 HA VAL 43 15.530 -24.477 22.592 331 HB VAL 43 HB VAL 43 14.123 -26.381 21.849 332 HG11 VAL 43 HG11 VAL 43 13.092 -24.405 22.857 333 HG12 VAL 43 HG12 VAL 43 12.035 -25.139 21.649 334 HG13 VAL 43 HG13 VAL 43 12.935 -23.673 21.259 335 HG21 VAL 43 HG21 VAL 43 14.737 -26.419 19.491 336 HG22 VAL 43 HG22 VAL 43 13.954 -24.857 19.252 337 HG23 VAL 43 HG23 VAL 43 12.988 -26.269 19.676 338 H CYS 44 H CYS 44 16.414 -26.625 22.956 339 HA CYS 44 HA CYS 44 18.677 -27.166 21.193 340 HB2 CYS 44 HB3 CYS 44 19.059 -26.970 23.646 341 HB3 CYS 44 HB2 CYS 44 18.004 -28.351 23.903 342 H ARG 45 H ARG 45 19.186 -29.695 21.242 343 HA ARG 45 HA ARG 45 17.235 -30.764 19.483 344 HB2 ARG 45 HB3 ARG 45 19.785 -31.114 19.465 345 HB3 ARG 45 HB2 ARG 45 19.503 -32.323 20.712 346 HG2 ARG 45 HG3 ARG 45 18.081 -32.395 18.078 347 HG3 ARG 45 HG2 ARG 45 19.671 -33.124 18.301 348 HD2 ARG 45 HD3 ARG 45 18.864 -34.702 19.829 349 HD3 ARG 45 HD2 ARG 45 17.382 -33.791 20.121 350 HE ARG 45 HE ARG 45 17.746 -34.788 17.416 351 HH11 ARG 45 HH11 ARG 45 16.427 -35.409 20.602 352 HH12 ARG 45 HH12 ARG 45 15.135 -36.420 20.016 353 HH21 ARG 45 HH21 ARG 45 16.063 -36.130 16.635 354 HH22 ARG 45 HH22 ARG 45 14.935 -36.841 17.758 355 H GLY 46 H GLY 46 15.387 -31.642 20.106 356 HA2 GLY 46 HA3 GLY 46 14.154 -33.428 20.990 357 HA3 GLY 46 HA2 GLY 46 15.458 -33.740 22.127 358 H GLU 47 H GLU 47 14.788 -33.475 24.128 359 HA GLU 47 HA GLU 47 12.941 -31.253 24.696 360 HB2 GLU 47 HB3 GLU 47 12.116 -32.575 26.599 361 HB3 GLU 47 HB2 GLU 47 11.876 -33.406 25.071 362 HG2 GLU 47 HG3 GLU 47 13.744 -34.855 25.510 363 HG3 GLU 47 HG2 GLU 47 14.129 -33.965 26.984 364 H ARG 48 H ARG 48 15.885 -31.286 24.621 365 HA ARG 48 HA ARG 48 16.674 -31.001 27.411 366 HB2 ARG 48 HB3 ARG 48 18.315 -30.489 24.917 367 HB3 ARG 48 HB2 ARG 48 18.920 -30.669 26.558 368 HG2 ARG 48 HG3 ARG 48 17.566 -32.832 24.959 369 HG3 ARG 48 HG2 ARG 48 19.308 -32.658 25.168 370 HD2 ARG 48 HD3 ARG 48 17.362 -33.005 27.443 371 HD3 ARG 48 HD2 ARG 48 18.224 -34.337 26.677 372 HE ARG 48 HE ARG 48 20.140 -32.476 27.443 373 HH11 ARG 48 HH11 ARG 48 17.764 -34.558 28.967 374 HH12 ARG 48 HH12 ARG 48 18.677 -34.745 30.434 375 HH21 ARG 48 HH21 ARG 48 21.337 -32.697 29.379 376 HH22 ARG 48 HH22 ARG 48 20.695 -33.649 30.687 377 H GLU 49 H GLU 49 16.398 -29.122 28.422 378 HA GLU 49 HA GLU 49 15.591 -26.796 26.938 379 HB2 GLU 49 HB3 GLU 49 16.163 -26.991 29.898 380 HB3 GLU 49 HB2 GLU 49 15.206 -25.764 29.082 381 HG2 GLU 49 HG3 GLU 49 13.489 -27.022 29.787 382 HG3 GLU 49 HG2 GLU 49 13.856 -27.963 28.342 383 H VAL 50 H VAL 50 16.561 -24.683 27.248 384 HA VAL 50 HA VAL 50 19.470 -24.782 27.695 385 HB VAL 50 HB VAL 50 19.726 -23.050 25.931 386 HG11 VAL 50 HG11 VAL 50 20.220 -25.324 25.348 387 HG12 VAL 50 HG12 VAL 50 19.389 -24.560 23.993 388 HG13 VAL 50 HG13 VAL 50 18.515 -25.665 25.054 389 HG21 VAL 50 HG21 VAL 50 17.918 -22.679 24.321 390 HG22 VAL 50 HG22 VAL 50 17.458 -22.151 25.938 391 HG23 VAL 50 HG23 VAL 50 16.841 -23.675 25.300 392 H VAL 51 H VAL 51 20.283 -23.156 28.971 393 HA VAL 51 HA VAL 51 18.402 -21.037 29.728 394 HB VAL 51 HB VAL 51 19.249 -22.150 31.664 395 HG11 VAL 51 HG11 VAL 51 21.637 -22.329 32.183 396 HG12 VAL 51 HG12 VAL 51 22.023 -21.646 30.602 397 HG13 VAL 51 HG13 VAL 51 21.206 -23.204 30.712 398 HG21 VAL 51 HG21 VAL 51 20.660 -19.510 31.306 399 HG22 VAL 51 HG22 VAL 51 20.420 -20.332 32.848 400 HG23 VAL 51 HG23 VAL 51 19.030 -19.765 31.925 401 H GLY 52 H GLY 52 18.534 -19.623 28.113 402 HA2 GLY 52 HA3 GLY 52 20.971 -18.075 27.867 403 HA3 GLY 52 HA2 GLY 52 20.459 -18.910 26.406 404 HA PRO 53 HA PRO 53 18.026 -14.907 26.775 405 HB2 PRO 53 HB3 PRO 53 19.384 -13.341 25.064 406 HB3 PRO 53 HB2 PRO 53 19.844 -13.460 26.765 407 HG2 PRO 53 HG3 PRO 53 21.049 -14.808 24.379 408 HG3 PRO 53 HG2 PRO 53 21.859 -14.046 25.760 409 HD2 PRO 53 HD3 PRO 53 21.463 -16.745 25.513 410 HD3 PRO 53 HD2 PRO 53 21.627 -15.909 27.070 411 H LYS 54 H LYS 54 17.317 -17.181 25.488 412 HA LYS 54 HA LYS 54 17.535 -16.946 22.640 413 HB2 LYS 54 HB3 LYS 54 15.842 -18.967 22.816 414 HB3 LYS 54 HB2 LYS 54 17.554 -19.161 23.144 415 HG2 LYS 54 HG3 LYS 54 16.476 -20.337 24.851 416 HG3 LYS 54 HG2 LYS 54 16.964 -18.819 25.602 417 HD2 LYS 54 HD3 LYS 54 14.743 -17.961 25.484 418 HD3 LYS 54 HD2 LYS 54 14.217 -19.299 24.463 419 HE2 LYS 54 HE3 LYS 54 14.628 -20.854 26.321 420 HE3 LYS 54 HE2 LYS 54 15.107 -19.495 27.340 421 HZ1 LYS 54 HZ1 LYS 54 12.432 -19.811 26.075 422 HZ2 LYS 54 HZ2 LYS 54 12.899 -18.584 27.150 423 HZ3 LYS 54 HZ3 LYS 54 12.791 -20.186 27.692 424 H VAL 55 H VAL 55 16.572 -14.999 22.218 425 HA VAL 55 HA VAL 55 13.838 -15.293 21.450 426 HB VAL 55 HB VAL 55 13.443 -14.498 23.724 427 HG11 VAL 55 HG11 VAL 55 14.212 -12.283 24.459 428 HG12 VAL 55 HG12 VAL 55 15.176 -12.144 22.989 429 HG13 VAL 55 HG13 VAL 55 15.550 -13.397 24.173 430 HG21 VAL 55 HG21 VAL 55 12.102 -12.518 23.232 431 HG22 VAL 55 HG22 VAL 55 11.933 -13.733 21.963 432 HG23 VAL 55 HG23 VAL 55 12.951 -12.315 21.700 433 H ARG 56 H ARG 56 13.581 -14.286 19.538 434 HA ARG 56 HA ARG 56 15.413 -12.068 18.898 435 HB2 ARG 56 HB3 ARG 56 14.581 -14.269 17.003 436 HB3 ARG 56 HB2 ARG 56 15.561 -12.872 16.585 437 HG2 ARG 56 HG3 ARG 56 16.319 -15.042 18.520 438 HG3 ARG 56 HG2 ARG 56 16.903 -14.877 16.865 439 HD2 ARG 56 HD3 ARG 56 17.761 -12.585 17.565 440 HD3 ARG 56 HD2 ARG 56 17.441 -13.095 19.225 441 HE ARG 56 HE ARG 56 19.064 -14.870 17.590 442 HH11 ARG 56 HH11 ARG 56 18.967 -12.464 20.142 443 HH12 ARG 56 HH12 ARG 56 20.596 -12.764 20.656 444 HH21 ARG 56 HH21 ARG 56 21.180 -15.262 18.261 445 HH22 ARG 56 HH22 ARG 56 21.865 -14.358 19.578 446 H LYS 57 H LYS 57 14.449 -10.328 18.140 447 HA LYS 57 HA LYS 57 11.639 -10.525 17.298 448 HB2 LYS 57 HB3 LYS 57 12.191 -9.042 19.226 449 HB3 LYS 57 HB2 LYS 57 13.223 -8.096 18.166 450 HG2 LYS 57 HG3 LYS 57 11.296 -7.461 16.824 451 HG3 LYS 57 HG2 LYS 57 10.249 -8.455 17.842 452 HD2 LYS 57 HD3 LYS 57 11.883 -6.097 18.775 453 HD3 LYS 57 HD2 LYS 57 10.145 -6.087 18.474 454 HE2 LYS 57 HE3 LYS 57 9.734 -7.579 20.264 455 HE3 LYS 57 HE2 LYS 57 11.445 -7.961 20.434 456 HZ1 LYS 57 HZ1 LYS 57 11.863 -5.740 21.208 457 HZ2 LYS 57 HZ2 LYS 57 10.642 -6.434 22.156 458 HZ3 LYS 57 HZ3 LYS 57 10.243 -5.295 20.966 459 H CYS 58 H CYS 58 11.096 -9.974 15.233 460 HA CYS 58 HA CYS 58 13.215 -9.714 13.334 461 HB2 CYS 58 HB3 CYS 58 11.150 -10.971 12.841 462 HB3 CYS 58 HB2 CYS 58 10.231 -9.471 12.916 463 H LEU 59 H LEU 59 13.687 -7.997 11.991 464 HA LEU 59 HA LEU 59 12.811 -5.371 12.984 465 HB2 LEU 59 HB3 LEU 59 15.426 -6.180 11.710 466 HB3 LEU 59 HB2 LEU 59 14.997 -4.541 12.158 467 HG LEU 59 HG LEU 59 15.341 -6.850 14.075 468 HD11 LEU 59 HD11 LEU 59 17.077 -4.438 13.560 469 HD12 LEU 59 HD12 LEU 59 17.448 -6.097 13.094 470 HD13 LEU 59 HD13 LEU 59 17.344 -5.663 14.800 471 HD21 LEU 59 HD21 LEU 59 13.678 -5.282 14.877 472 HD22 LEU 59 HD22 LEU 59 14.763 -3.930 14.559 473 HD23 LEU 59 HD23 LEU 59 15.167 -5.109 15.807 474 H ALA 60 H ALA 60 13.486 -3.673 11.081 475 HA ALA 60 HA ALA 60 11.677 -4.341 8.928 476 HB1 ALA 60 HB1 ALA 60 13.306 -1.841 9.393 477 HB2 ALA 60 HB2 ALA 60 11.652 -2.111 9.943 478 HB3 ALA 60 HB3 ALA 60 12.003 -2.026 8.217 479 H ASN 61 H ASN 61 14.212 -5.797 9.145 480 HA ASN 61 HA ASN 61 15.077 -5.494 6.401 481 HB2 ASN 61 HB3 ASN 61 17.482 -5.497 7.016 482 HB3 ASN 61 HB2 ASN 61 16.654 -4.036 7.538 483 HD21 ASN 61 HD21 ASN 61 18.466 -6.759 8.481 484 HD22 ASN 61 HD22 ASN 61 18.480 -6.453 10.189 485 H GLY 62 H GLY 62 16.821 -7.359 6.017 486 HA2 GLY 62 HA3 GLY 62 15.257 -9.697 6.400 487 HA3 GLY 62 HA2 GLY 62 16.832 -9.628 5.630 488 H SER 63 H SER 63 17.767 -8.342 8.281 489 HA SER 63 HA SER 63 18.386 -10.915 9.524 490 HB2 SER 63 HB3 SER 63 19.722 -8.238 9.973 491 HB3 SER 63 HB2 SER 63 20.307 -9.819 10.495 492 HG SER 63 HG SER 63 20.990 -10.244 8.528 493 H TRP 64 H TRP 64 18.143 -11.271 11.707 494 HA TRP 64 HA TRP 64 15.996 -9.854 12.971 495 HB2 TRP 64 HB3 TRP 64 17.722 -12.148 13.935 496 HB3 TRP 64 HB2 TRP 64 16.312 -11.530 14.791 497 HD1 TRP 64 HD1 TRP 64 17.183 -13.236 11.420 498 HE1 TRP 64 HE1 TRP 64 15.134 -14.593 10.649 499 HE3 TRP 64 HE3 TRP 64 13.894 -11.898 15.099 500 HZ2 TRP 64 HZ2 TRP 64 12.486 -15.036 11.495 501 HZ3 TRP 64 HZ3 TRP 64 11.624 -12.837 15.043 502 HH2 TRP 64 HH2 TRP 64 10.936 -14.374 13.280 503 H THR 65 H THR 65 16.450 -9.627 15.552 504 HA THR 65 HA THR 65 17.794 -7.234 15.838 505 HB THR 65 HB THR 65 17.785 -7.891 18.353 506 HG1 THR 65 HG1 THR 65 16.372 -9.653 18.781 507 HG21 THR 65 HG21 THR 65 15.379 -7.435 18.480 508 HG22 THR 65 HG22 THR 65 15.227 -7.759 16.752 509 HG23 THR 65 HG23 THR 65 16.170 -6.378 17.310 510 H ASP 66 H ASP 66 18.973 -10.461 16.788 511 HA ASP 66 HA ASP 66 21.722 -9.429 16.707 512 HB2 ASP 66 HB3 ASP 66 20.878 -9.410 19.096 513 HB3 ASP 66 HB2 ASP 66 20.654 -11.145 18.964 514 H MET 67 H MET 67 23.172 -10.907 15.829 515 HA MET 67 HA MET 67 22.438 -13.730 16.125 516 HB2 MET 67 HB3 MET 67 23.425 -12.501 13.547 517 HB3 MET 67 HB2 MET 67 23.330 -14.228 13.849 518 HG2 MET 67 HG3 MET 67 20.901 -14.022 14.131 519 HG3 MET 67 HG2 MET 67 21.022 -12.302 13.758 520 HE1 MET 67 HE1 MET 67 19.389 -13.682 10.494 521 HE2 MET 67 HE2 MET 67 19.295 -12.473 11.776 522 HE3 MET 67 HE3 MET 67 19.067 -14.180 12.154 523 H ASP 68 H ASP 68 24.063 -13.236 17.914 524 HA ASP 68 HA ASP 68 26.058 -15.083 17.098 525 HB2 ASP 68 HB3 ASP 68 27.220 -12.862 16.604 526 HB3 ASP 68 HB2 ASP 68 27.176 -12.559 18.341 527 H THR 69 H THR 69 25.010 -16.395 18.583 528 HA THR 69 HA THR 69 25.507 -15.775 21.379 529 HB THR 69 HB THR 69 22.659 -16.357 20.627 530 HG1 THR 69 HG1 THR 69 23.912 -13.789 20.753 531 HG21 THR 69 HG21 THR 69 23.943 -14.952 22.964 532 HG22 THR 69 HG22 THR 69 23.254 -16.578 22.970 533 HG23 THR 69 HG23 THR 69 22.211 -15.169 22.738 534 HA PRO 70 HA PRO 70 25.806 -20.291 20.830 535 HB2 PRO 70 HB3 PRO 70 27.521 -20.639 22.898 536 HB3 PRO 70 HB2 PRO 70 28.060 -20.122 21.296 537 HG2 PRO 70 HG3 PRO 70 27.537 -18.474 23.741 538 HG3 PRO 70 HG2 PRO 70 28.895 -18.382 22.603 539 HD2 PRO 70 HD3 PRO 70 26.793 -16.676 22.502 540 HD3 PRO 70 HD2 PRO 70 27.673 -17.193 21.048 541 H SER 71 H SER 71 24.020 -21.265 21.561 542 HA SER 71 HA SER 71 23.038 -20.683 24.243 543 HB2 SER 71 HB3 SER 71 21.477 -20.670 22.280 544 HB3 SER 71 HB2 SER 71 21.763 -22.400 22.095 545 HG SER 71 HG SER 71 20.029 -22.382 23.361 546 H ARG 72 H ARG 72 23.050 -22.106 25.880 547 HA ARG 72 HA ARG 72 24.613 -24.546 25.445 548 HB2 ARG 72 HB3 ARG 72 25.052 -24.463 27.873 549 HB3 ARG 72 HB2 ARG 72 25.585 -23.006 27.046 550 HG2 ARG 72 HG3 ARG 72 23.466 -21.907 27.780 551 HG3 ARG 72 HG2 ARG 72 23.126 -23.344 28.745 552 HD2 ARG 72 HD3 ARG 72 24.153 -21.579 30.091 553 HD3 ARG 72 HD2 ARG 72 25.186 -23.007 29.999 554 HE ARG 72 HE ARG 72 26.531 -21.817 28.364 555 HH11 ARG 72 HH11 ARG 72 24.373 -19.908 30.366 556 HH12 ARG 72 HH12 ARG 72 25.207 -18.417 30.042 557 HH21 ARG 72 HH21 ARG 72 27.626 -19.891 27.975 558 HH22 ARG 72 HH22 ARG 72 27.071 -18.407 28.695 559 H CYS 73 H CYS 73 23.610 -26.437 25.472 560 HA CYS 73 HA CYS 73 20.885 -26.667 26.334 561 HB2 CYS 73 HB3 CYS 73 22.836 -28.853 25.573 562 HB3 CYS 73 HB2 CYS 73 21.090 -29.023 25.708 563 H VAL 74 H VAL 74 20.624 -26.343 28.426 564 HA VAL 74 HA VAL 74 21.122 -28.252 30.360 565 HB VAL 74 HB VAL 74 23.521 -27.541 30.068 566 HG11 VAL 74 HG11 VAL 74 23.166 -25.183 29.583 567 HG12 VAL 74 HG12 VAL 74 24.237 -25.381 30.970 568 HG13 VAL 74 HG13 VAL 74 22.550 -24.924 31.215 569 HG21 VAL 74 HG21 VAL 74 22.805 -28.567 32.146 570 HG22 VAL 74 HG22 VAL 74 22.286 -27.003 32.771 571 HG23 VAL 74 HG23 VAL 74 23.998 -27.309 32.474 572 H ARG 75 H ARG 75 20.240 -27.572 32.400 573 HA ARG 75 HA ARG 75 18.913 -24.961 32.335 574 HB2 ARG 75 HB3 ARG 75 17.196 -26.677 33.748 575 HB3 ARG 75 HB2 ARG 75 16.911 -25.936 32.182 576 HG2 ARG 75 HG3 ARG 75 16.559 -28.118 31.652 577 HG3 ARG 75 HG2 ARG 75 18.285 -28.016 31.322 578 HD2 ARG 75 HD3 ARG 75 17.054 -29.029 33.885 579 HD3 ARG 75 HD2 ARG 75 17.664 -30.045 32.581 580 HE ARG 75 HE ARG 75 19.371 -28.211 34.157 581 HH11 ARG 75 HH11 ARG 75 18.799 -31.281 32.549 582 HH12 ARG 75 HH12 ARG 75 20.356 -31.934 32.962 583 HH21 ARG 75 HH21 ARG 75 21.435 -29.071 34.691 584 HH22 ARG 75 HH22 ARG 75 21.837 -30.695 34.201 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 4.369 -1.019 -4.267 2 H2 GLY 1 HT2 GLY 1 5.363 -1.517 -2.989 3 H3 GLY 1 HT3 GLY 1 4.005 -2.441 -3.411 4 HA2 GLY 1 HA2 GLY 1 5.035 -2.827 -5.627 5 HA3 GLY 1 HA3 GLY 1 6.483 -2.056 -4.993 6 HA PRO 2 HA PRO 2 6.759 -6.551 -3.988 7 HB2 PRO 2 HB3 PRO 2 9.130 -7.075 -5.107 8 HB3 PRO 2 HB2 PRO 2 7.663 -6.943 -6.084 9 HG2 PRO 2 HG3 PRO 2 9.858 -4.958 -5.677 10 HG3 PRO 2 HG2 PRO 2 8.962 -5.352 -7.154 11 HD2 PRO 2 HD3 PRO 2 8.452 -3.179 -5.509 12 HD3 PRO 2 HD2 PRO 2 7.300 -3.875 -6.664 13 H THR 3 H THR 3 7.904 -3.926 -2.644 14 HA THR 3 HA THR 3 10.238 -4.971 -1.300 15 HB THR 3 HB THR 3 9.893 -2.767 0.050 16 HG1 THR 3 HG1 THR 3 7.966 -1.978 -0.521 17 HG21 THR 3 HG21 THR 3 11.680 -3.124 -1.582 18 HG22 THR 3 HG22 THR 3 11.027 -1.490 -1.708 19 HG23 THR 3 HG23 THR 3 10.575 -2.715 -2.894 20 H SER 4 H SER 4 9.958 -6.434 0.242 21 HA SER 4 HA SER 4 7.967 -5.871 2.327 22 HB2 SER 4 HB3 SER 4 7.626 -8.367 2.512 23 HB3 SER 4 HB2 SER 4 6.997 -7.649 1.028 24 HG SER 4 HG SER 4 9.627 -8.552 0.951 25 H GLU 5 H GLU 5 9.311 -5.208 3.920 26 HA GLU 5 HA GLU 5 11.888 -6.321 4.366 27 HB2 GLU 5 HB3 GLU 5 10.159 -4.658 6.208 28 HB3 GLU 5 HB2 GLU 5 11.845 -5.055 6.498 29 HG2 GLU 5 HG3 GLU 5 11.973 -2.927 5.642 30 HG3 GLU 5 HG2 GLU 5 12.264 -3.925 4.217 31 H GLY 6 H GLY 6 12.290 -8.245 5.128 32 HA2 GLY 6 HA3 GLY 6 11.030 -9.162 7.545 33 HA3 GLY 6 HA2 GLY 6 10.642 -10.128 6.126 34 H CYS 7 H CYS 7 12.005 -11.117 8.360 35 HA CYS 7 HA CYS 7 14.809 -11.276 7.581 36 HB2 CYS 7 HB3 CYS 7 13.402 -12.588 9.915 37 HB3 CYS 7 HB2 CYS 7 15.140 -12.414 9.692 38 H GLN 8 H GLN 8 15.833 -13.233 7.019 39 HA GLN 8 HA GLN 8 14.060 -15.122 5.705 40 HB2 GLN 8 HB3 GLN 8 16.081 -16.097 4.776 41 HB3 GLN 8 HB2 GLN 8 16.088 -14.354 4.545 42 HG2 GLN 8 HG3 GLN 8 17.702 -14.033 6.218 43 HG3 GLN 8 HG2 GLN 8 17.495 -15.664 6.849 44 HE21 GLN 8 HE21 GLN 8 17.497 -16.899 4.198 45 HE22 GLN 8 HE22 GLN 8 19.132 -16.841 3.640 46 H ILE 9 H ILE 9 15.057 -17.517 5.829 47 HA ILE 9 HA ILE 9 14.831 -18.305 8.612 48 HB ILE 9 HB ILE 9 15.011 -19.893 6.051 49 HG12 ILE 9 HG13 ILE 9 12.806 -19.549 8.096 50 HG13 ILE 9 HG12 ILE 9 12.853 -18.829 6.489 51 HG21 ILE 9 HG21 ILE 9 14.639 -21.911 7.410 52 HG22 ILE 9 HG22 ILE 9 14.853 -20.947 8.872 53 HG23 ILE 9 HG23 ILE 9 16.193 -21.147 7.741 54 HD11 ILE 9 HD11 ILE 9 11.375 -20.746 6.538 55 HD12 ILE 9 HD12 ILE 9 12.693 -21.771 7.109 56 HD13 ILE 9 HD13 ILE 9 12.762 -21.064 5.494 57 H ILE 10 H ILE 10 16.484 -18.712 9.880 58 HA ILE 10 HA ILE 10 19.182 -18.453 8.908 59 HB ILE 10 HB ILE 10 18.232 -19.148 11.695 60 HG12 ILE 10 HG13 ILE 10 18.942 -16.431 10.571 61 HG13 ILE 10 HG12 ILE 10 17.297 -16.995 10.847 62 HG21 ILE 10 HG21 ILE 10 20.414 -18.347 12.412 63 HG22 ILE 10 HG22 ILE 10 20.850 -17.998 10.740 64 HG23 ILE 10 HG23 ILE 10 20.590 -19.665 11.253 65 HD11 ILE 10 HD11 ILE 10 17.770 -17.178 13.238 66 HD12 ILE 10 HD12 ILE 10 18.038 -15.541 12.639 67 HD13 ILE 10 HD13 ILE 10 19.411 -16.600 12.953 68 H HIS 11 H HIS 11 20.608 -20.076 8.539 69 HA HIS 11 HA HIS 11 19.939 -22.760 8.344 70 HB2 HIS 11 HB3 HIS 11 22.588 -21.389 8.764 71 HB3 HIS 11 HB2 HIS 11 22.477 -23.142 8.670 72 HD1 HIS 11 HD1 HIS 11 24.128 -21.685 6.604 73 HD2 HIS 11 HD2 HIS 11 20.088 -22.551 6.106 74 HE1 HIS 11 HE1 HIS 11 23.733 -21.692 4.118 75 HE2 HIS 11 HE2 HIS 11 21.268 -22.167 3.836 76 HA PRO 12 HA PRO 12 19.374 -24.051 12.567 77 HB2 PRO 12 HB3 PRO 12 20.330 -26.623 11.391 78 HB3 PRO 12 HB2 PRO 12 18.914 -26.306 12.401 79 HG2 PRO 12 HG3 PRO 12 18.649 -26.694 9.781 80 HG3 PRO 12 HG2 PRO 12 17.669 -25.481 10.625 81 HD2 PRO 12 HD3 PRO 12 20.022 -25.105 8.836 82 HD3 PRO 12 HD2 PRO 12 18.586 -24.084 9.046 83 HA PRO 13 HA PRO 13 23.695 -23.653 13.741 84 HB2 PRO 13 HB3 PRO 13 22.614 -23.740 16.470 85 HB3 PRO 13 HB2 PRO 13 23.495 -22.442 15.659 86 HG2 PRO 13 HG3 PRO 13 20.870 -22.247 16.229 87 HG3 PRO 13 HG2 PRO 13 21.573 -21.516 14.774 88 HD2 PRO 13 HD3 PRO 13 20.031 -24.072 15.058 89 HD3 PRO 13 HD2 PRO 13 19.919 -22.821 13.799 90 H TRP 14 H TRP 14 24.605 -24.701 16.155 91 HA TRP 14 HA TRP 14 24.978 -27.417 15.566 92 HB2 TRP 14 HB3 TRP 14 26.227 -25.724 17.219 93 HB3 TRP 14 HB2 TRP 14 25.217 -26.551 18.403 94 HD1 TRP 14 HD1 TRP 14 26.393 -28.569 19.457 95 HE1 TRP 14 HE1 TRP 14 28.179 -30.265 18.707 96 HE3 TRP 14 HE3 TRP 14 27.158 -26.899 14.682 97 HZ2 TRP 14 HZ2 TRP 14 29.703 -30.820 16.403 98 HZ3 TRP 14 HZ3 TRP 14 28.792 -28.073 13.270 99 HH2 TRP 14 HH2 TRP 14 30.036 -29.992 14.114 100 H GLU 15 H GLU 15 24.336 -29.249 17.020 101 HA GLU 15 HA GLU 15 21.769 -29.847 16.539 102 HB2 GLU 15 HB3 GLU 15 23.549 -30.886 18.723 103 HB3 GLU 15 HB2 GLU 15 21.958 -31.570 18.405 104 HG2 GLU 15 HG3 GLU 15 24.250 -31.407 16.458 105 HG3 GLU 15 HG2 GLU 15 23.674 -32.856 17.284 106 H GLY 16 H GLY 16 20.150 -28.577 16.936 107 HA2 GLY 16 HA3 GLY 16 18.973 -28.545 19.537 108 HA3 GLY 16 HA2 GLY 16 19.572 -26.957 19.058 109 H GLY 17 H GLY 17 17.622 -25.925 18.732 110 HA2 GLY 17 HA3 GLY 17 16.439 -26.374 16.170 111 HA3 GLY 17 HA2 GLY 17 15.367 -26.888 17.468 112 H ILE 18 H ILE 18 14.082 -25.139 16.335 113 HA ILE 18 HA ILE 18 14.520 -22.647 17.795 114 HB ILE 18 HB ILE 18 14.159 -22.882 14.824 115 HG12 ILE 18 HG13 ILE 18 15.942 -21.270 16.647 116 HG13 ILE 18 HG12 ILE 18 16.418 -22.687 15.713 117 HG21 ILE 18 HG21 ILE 18 13.646 -20.471 14.746 118 HG22 ILE 18 HG22 ILE 18 13.503 -20.462 16.505 119 HG23 ILE 18 HG23 ILE 18 12.369 -21.401 15.534 120 HD11 ILE 18 HD11 ILE 18 15.995 -21.437 13.638 121 HD12 ILE 18 HD12 ILE 18 17.221 -20.673 14.652 122 HD13 ILE 18 HD13 ILE 18 15.584 -20.016 14.599 123 H ARG 19 H ARG 19 12.763 -21.703 18.572 124 HA ARG 19 HA ARG 19 10.236 -23.162 18.228 125 HB2 ARG 19 HB3 ARG 19 11.427 -23.069 20.471 126 HB3 ARG 19 HB2 ARG 19 11.041 -21.357 20.503 127 HG2 ARG 19 HG3 ARG 19 9.461 -22.732 21.807 128 HG3 ARG 19 HG2 ARG 19 8.685 -21.819 20.510 129 HD2 ARG 19 HD3 ARG 19 8.556 -23.774 19.130 130 HD3 ARG 19 HD2 ARG 19 9.532 -24.701 20.268 131 HE ARG 19 HE ARG 19 7.684 -24.729 21.776 132 HH11 ARG 19 HH11 ARG 19 6.913 -23.339 18.655 133 HH12 ARG 19 HH12 ARG 19 5.216 -23.667 18.778 134 HH21 ARG 19 HH21 ARG 19 5.472 -25.152 21.956 135 HH22 ARG 19 HH22 ARG 19 4.380 -24.696 20.674 136 H TYR 20 H TYR 20 8.727 -22.134 17.095 137 HA TYR 20 HA TYR 20 8.945 -19.247 16.724 138 HB2 TYR 20 HB3 TYR 20 7.262 -21.318 15.294 139 HB3 TYR 20 HB2 TYR 20 7.271 -19.599 14.912 140 HD1 TYR 20 HD1 TYR 20 8.996 -22.761 14.533 141 HD2 TYR 20 HD2 TYR 20 9.320 -18.562 13.964 142 HE1 TYR 20 HE1 TYR 20 10.893 -23.122 13.010 143 HE2 TYR 20 HE2 TYR 20 11.218 -18.908 12.438 144 HH TYR 20 HH TYR 20 12.930 -20.603 11.986 145 H ARG 21 H ARG 21 6.405 -18.512 16.173 146 HA ARG 21 HA ARG 21 5.215 -18.521 18.828 147 HB2 ARG 21 HB3 ARG 21 5.025 -16.776 16.423 148 HB3 ARG 21 HB2 ARG 21 3.668 -16.798 17.538 149 HG2 ARG 21 HG3 ARG 21 6.356 -16.434 18.711 150 HG3 ARG 21 HG2 ARG 21 5.700 -15.097 17.763 151 HD2 ARG 21 HD3 ARG 21 5.135 -14.846 20.122 152 HD3 ARG 21 HD2 ARG 21 3.685 -15.099 19.154 153 HE ARG 21 HE ARG 21 4.953 -17.153 20.865 154 HH11 ARG 21 HH11 ARG 21 2.142 -15.792 19.258 155 HH12 ARG 21 HH12 ARG 21 1.012 -16.830 20.082 156 HH21 ARG 21 HH21 ARG 21 3.473 -18.528 21.934 157 HH22 ARG 21 HH22 ARG 21 1.773 -18.411 21.569 158 H GLY 22 H GLY 22 3.751 -18.519 15.568 159 HA2 GLY 22 HA3 GLY 22 1.867 -20.562 16.573 160 HA3 GLY 22 HA2 GLY 22 1.304 -19.142 15.700 161 H LEU 23 H LEU 23 3.702 -21.741 15.314 162 HA LEU 23 HA LEU 23 2.755 -22.030 12.548 163 HB2 LEU 23 HB3 LEU 23 5.591 -22.140 13.560 164 HB3 LEU 23 HB2 LEU 23 5.111 -22.734 11.981 165 HG LEU 23 HG LEU 23 4.871 -19.876 12.936 166 HD11 LEU 23 HD11 LEU 23 7.177 -20.541 12.517 167 HD12 LEU 23 HD12 LEU 23 6.607 -19.423 11.280 168 HD13 LEU 23 HD13 LEU 23 6.724 -21.146 10.925 169 HD21 LEU 23 HD21 LEU 23 3.077 -20.437 11.406 170 HD22 LEU 23 HD22 LEU 23 4.230 -21.133 10.270 171 HD23 LEU 23 HD23 LEU 23 4.254 -19.400 10.599 172 H THR 24 H THR 24 1.890 -23.920 12.197 173 HA THR 24 HA THR 24 2.372 -26.157 13.950 174 HB THR 24 HB THR 24 0.099 -25.691 13.090 175 HG1 THR 24 HG1 THR 24 -0.345 -27.876 12.456 176 HG21 THR 24 HG21 THR 24 0.715 -24.859 10.862 177 HG22 THR 24 HG22 THR 24 -0.470 -26.163 10.759 178 HG23 THR 24 HG23 THR 24 1.228 -26.483 10.401 179 H ARG 25 H ARG 25 2.463 -28.374 12.483 180 HA ARG 25 HA ARG 25 5.174 -28.303 11.534 181 HB2 ARG 25 HB3 ARG 25 3.134 -30.451 11.972 182 HB3 ARG 25 HB2 ARG 25 4.586 -30.806 11.050 183 HG2 ARG 25 HG3 ARG 25 4.588 -29.688 13.841 184 HG3 ARG 25 HG2 ARG 25 4.737 -31.402 13.449 185 HD2 ARG 25 HD3 ARG 25 6.724 -30.796 12.033 186 HD3 ARG 25 HD2 ARG 25 6.622 -29.175 12.714 187 HE ARG 25 HE ARG 25 6.931 -30.299 14.936 188 HH11 ARG 25 HH11 ARG 25 8.095 -31.761 11.968 189 HH12 ARG 25 HH12 ARG 25 9.365 -32.645 12.760 190 HH21 ARG 25 HH21 ARG 25 8.595 -31.453 15.967 191 HH22 ARG 25 HH22 ARG 25 9.658 -32.470 15.039 192 H ASP 26 H ASP 26 5.403 -30.070 9.585 193 HA ASP 26 HA ASP 26 5.610 -30.146 7.331 194 HB2 ASP 26 HB3 ASP 26 3.217 -30.970 7.688 195 HB3 ASP 26 HB2 ASP 26 2.700 -29.363 7.187 196 H GLN 27 H GLN 27 6.076 -27.642 8.712 197 HA GLN 27 HA GLN 27 5.801 -25.801 6.443 198 HB2 GLN 27 HB3 GLN 27 5.177 -25.210 9.338 199 HB3 GLN 27 HB2 GLN 27 5.490 -23.948 8.155 200 HG2 GLN 27 HG3 GLN 27 3.586 -24.836 6.812 201 HG3 GLN 27 HG2 GLN 27 3.235 -25.937 8.143 202 HE21 GLN 27 HE21 GLN 27 3.958 -24.041 10.199 203 HE22 GLN 27 HE22 GLN 27 2.697 -22.858 10.248 204 H VAL 28 H VAL 28 7.049 -23.649 7.602 205 HA VAL 28 HA VAL 28 9.061 -22.681 7.809 206 HB VAL 28 HB VAL 28 10.412 -23.212 9.667 207 HG11 VAL 28 HG11 VAL 28 7.561 -23.942 10.299 208 HG12 VAL 28 HG12 VAL 28 8.247 -22.318 10.230 209 HG13 VAL 28 HG13 VAL 28 8.780 -23.446 11.476 210 HG21 VAL 28 HG21 VAL 28 10.805 -25.581 9.297 211 HG22 VAL 28 HG22 VAL 28 9.143 -25.947 9.758 212 HG23 VAL 28 HG23 VAL 28 10.266 -25.291 10.951 213 H LYS 29 H LYS 29 8.796 -25.103 5.924 214 HA LYS 29 HA LYS 29 11.588 -25.817 5.611 215 HB2 LYS 29 HB3 LYS 29 10.715 -27.162 3.655 216 HB3 LYS 29 HB2 LYS 29 10.102 -27.625 5.236 217 HG2 LYS 29 HG3 LYS 29 8.025 -26.432 4.789 218 HG3 LYS 29 HG2 LYS 29 8.644 -25.932 3.214 219 HD2 LYS 29 HD3 LYS 29 8.733 -28.216 2.467 220 HD3 LYS 29 HD2 LYS 29 8.308 -28.804 4.073 221 HE2 LYS 29 HE3 LYS 29 6.381 -28.884 2.587 222 HE3 LYS 29 HE2 LYS 29 6.121 -27.723 3.890 223 HZ1 LYS 29 HZ1 LYS 29 5.406 -26.903 1.702 224 HZ2 LYS 29 HZ2 LYS 29 6.999 -27.012 1.139 225 HZ3 LYS 29 HZ3 LYS 29 6.612 -25.928 2.385 226 H ALA 30 H ALA 30 9.381 -23.492 4.421 227 HA ALA 30 HA ALA 30 11.456 -22.259 2.865 228 HB1 ALA 30 HB1 ALA 30 8.951 -23.111 1.420 229 HB2 ALA 30 HB2 ALA 30 10.522 -23.896 1.263 230 HB3 ALA 30 HB3 ALA 30 10.317 -22.224 0.746 231 H ILE 31 H ILE 31 11.123 -20.634 4.400 232 HA ILE 31 HA ILE 31 8.811 -18.919 3.803 233 HB ILE 31 HB ILE 31 10.105 -19.242 6.525 234 HG12 ILE 31 HG13 ILE 31 7.337 -20.036 5.577 235 HG13 ILE 31 HG12 ILE 31 8.657 -21.149 5.916 236 HG21 ILE 31 HG21 ILE 31 7.780 -17.531 5.648 237 HG22 ILE 31 HG22 ILE 31 9.379 -16.957 6.121 238 HG23 ILE 31 HG23 ILE 31 8.334 -17.735 7.311 239 HD11 ILE 31 HD11 ILE 31 7.063 -21.090 7.742 240 HD12 ILE 31 HD12 ILE 31 7.310 -19.353 7.917 241 HD13 ILE 31 HD13 ILE 31 8.631 -20.469 8.259 242 H ASN 32 H ASN 32 9.636 -17.287 2.666 243 HA ASN 32 HA ASN 32 12.437 -16.754 2.688 244 HB2 ASN 32 HB3 ASN 32 10.144 -15.411 1.261 245 HB3 ASN 32 HB2 ASN 32 11.824 -14.928 1.060 246 HD21 ASN 32 HD21 ASN 32 11.942 -15.457 -1.073 247 HD22 ASN 32 HD22 ASN 32 11.904 -17.085 -1.655 248 H PHE 33 H PHE 33 9.593 -15.063 3.957 249 HA PHE 33 HA PHE 33 11.445 -13.258 5.352 250 HB2 PHE 33 HB3 PHE 33 8.981 -12.389 3.838 251 HB3 PHE 33 HB2 PHE 33 9.916 -11.349 4.904 252 HD1 PHE 33 HD1 PHE 33 9.475 -12.476 1.586 253 HD2 PHE 33 HD2 PHE 33 12.428 -11.095 4.322 254 HE1 PHE 33 HE1 PHE 33 10.936 -11.865 -0.302 255 HE2 PHE 33 HE2 PHE 33 13.890 -10.484 2.446 256 HZ PHE 33 HZ PHE 33 13.149 -10.861 0.130 257 H LEU 34 H LEU 34 11.141 -13.592 7.425 258 HA LEU 34 HA LEU 34 8.537 -14.133 8.565 259 HB2 LEU 34 HB3 LEU 34 11.270 -13.636 9.732 260 HB3 LEU 34 HB2 LEU 34 9.846 -13.674 10.751 261 HG LEU 34 HG LEU 34 10.920 -15.804 10.875 262 HD11 LEU 34 HD11 LEU 34 8.482 -15.815 10.858 263 HD12 LEU 34 HD12 LEU 34 9.148 -17.291 10.160 264 HD13 LEU 34 HD13 LEU 34 8.495 -16.035 9.109 265 HD21 LEU 34 HD21 LEU 34 12.212 -15.726 8.815 266 HD22 LEU 34 HD22 LEU 34 10.738 -15.925 7.868 267 HD23 LEU 34 HD23 LEU 34 11.291 -17.228 8.920 268 HA PRO 35 HA PRO 35 7.382 -9.887 8.678 269 HB2 PRO 35 HB3 PRO 35 5.352 -10.007 10.465 270 HB3 PRO 35 HB2 PRO 35 5.221 -10.657 8.828 271 HG2 PRO 35 HG3 PRO 35 5.793 -12.099 11.391 272 HG3 PRO 35 HG2 PRO 35 4.699 -12.556 10.071 273 HD2 PRO 35 HD3 PRO 35 7.174 -13.619 10.356 274 HD3 PRO 35 HD2 PRO 35 6.416 -13.374 8.769 275 H VAL 36 H VAL 36 7.575 -8.020 9.899 276 HA VAL 36 HA VAL 36 9.261 -8.074 12.184 277 HB VAL 36 HB VAL 36 9.391 -6.137 10.782 278 HG11 VAL 36 HG11 VAL 36 6.469 -5.657 11.356 279 HG12 VAL 36 HG12 VAL 36 7.156 -6.180 9.820 280 HG13 VAL 36 HG13 VAL 36 7.528 -4.576 10.450 281 HG21 VAL 36 HG21 VAL 36 9.767 -5.716 13.144 282 HG22 VAL 36 HG22 VAL 36 8.051 -5.377 13.372 283 HG23 VAL 36 HG23 VAL 36 9.033 -4.309 12.369 284 H ASP 37 H ASP 37 8.319 -9.352 13.700 285 HA ASP 37 HA ASP 37 6.460 -8.431 15.547 286 HB2 ASP 37 HB3 ASP 37 4.833 -8.530 13.688 287 HB3 ASP 37 HB2 ASP 37 5.242 -10.221 13.417 288 H TYR 38 H TYR 38 7.689 -11.146 13.729 289 HA TYR 38 HA TYR 38 6.992 -13.115 15.669 290 HB2 TYR 38 HB3 TYR 38 7.868 -13.081 12.987 291 HB3 TYR 38 HB2 TYR 38 9.043 -14.032 13.890 292 HD1 TYR 38 HD1 TYR 38 8.529 -16.216 14.620 293 HD2 TYR 38 HD2 TYR 38 5.438 -13.715 13.109 294 HE1 TYR 38 HE1 TYR 38 6.989 -18.130 14.607 295 HE2 TYR 38 HE2 TYR 38 3.890 -15.623 13.099 296 HH TYR 38 HH TYR 38 3.974 -18.052 13.036 297 H GLU 39 H GLU 39 8.017 -13.682 17.426 298 HA GLU 39 HA GLU 39 10.888 -13.108 17.694 299 HB2 GLU 39 HB3 GLU 39 8.865 -13.783 19.844 300 HB3 GLU 39 HB2 GLU 39 10.557 -13.395 20.111 301 HG2 GLU 39 HG3 GLU 39 10.127 -11.146 19.150 302 HG3 GLU 39 HG2 GLU 39 8.414 -11.556 19.076 303 H ILE 40 H ILE 40 12.269 -14.793 17.658 304 HA ILE 40 HA ILE 40 11.093 -17.487 17.802 305 HB ILE 40 HB ILE 40 13.013 -18.287 16.507 306 HG12 ILE 40 HG13 ILE 40 13.772 -15.366 16.243 307 HG13 ILE 40 HG12 ILE 40 14.622 -16.535 17.247 308 HG21 ILE 40 HG21 ILE 40 10.964 -17.634 15.361 309 HG22 ILE 40 HG22 ILE 40 12.384 -17.310 14.364 310 HG23 ILE 40 HG23 ILE 40 11.571 -15.985 15.200 311 HD11 ILE 40 HD11 ILE 40 15.208 -17.825 15.268 312 HD12 ILE 40 HD12 ILE 40 15.773 -16.160 15.137 313 HD13 ILE 40 HD13 ILE 40 14.336 -16.677 14.254 314 H GLU 41 H GLU 41 11.949 -19.028 19.095 315 HA GLU 41 HA GLU 41 14.047 -18.175 20.970 316 HB2 GLU 41 HB3 GLU 41 11.978 -18.769 22.086 317 HB3 GLU 41 HB2 GLU 41 11.904 -20.296 21.216 318 HG2 GLU 41 HG3 GLU 41 13.879 -21.080 22.374 319 HG3 GLU 41 HG2 GLU 41 14.023 -19.534 23.209 320 H TYR 42 H TYR 42 15.791 -19.558 21.386 321 HA TYR 42 HA TYR 42 16.268 -21.588 19.318 322 HB2 TYR 42 HB3 TYR 42 18.234 -20.148 21.117 323 HB3 TYR 42 HB2 TYR 42 18.663 -21.365 19.921 324 HD1 TYR 42 HD1 TYR 42 18.576 -20.850 17.536 325 HD2 TYR 42 HD2 TYR 42 17.623 -17.903 20.452 326 HE1 TYR 42 HE1 TYR 42 18.786 -19.096 15.823 327 HE2 TYR 42 HE2 TYR 42 17.822 -16.142 18.748 328 HH TYR 42 HH TYR 42 18.015 -16.824 15.409 329 H VAL 43 H VAL 43 15.515 -23.497 20.083 330 HA VAL 43 HA VAL 43 15.979 -24.174 22.893 331 HB VAL 43 HB VAL 43 14.478 -26.086 22.517 332 HG11 VAL 43 HG11 VAL 43 13.367 -23.431 21.615 333 HG12 VAL 43 HG12 VAL 43 13.519 -23.999 23.278 334 HG13 VAL 43 HG13 VAL 43 12.406 -24.800 22.171 335 HG21 VAL 43 HG21 VAL 43 14.206 -24.989 19.721 336 HG22 VAL 43 HG22 VAL 43 13.222 -26.274 20.417 337 HG23 VAL 43 HG23 VAL 43 14.951 -26.522 20.175 338 H CYS 44 H CYS 44 16.495 -26.583 23.271 339 HA CYS 44 HA CYS 44 18.903 -27.164 21.720 340 HB2 CYS 44 HB3 CYS 44 18.956 -27.064 24.232 341 HB3 CYS 44 HB2 CYS 44 17.933 -28.495 24.259 342 H ARG 45 H ARG 45 19.237 -29.783 21.741 343 HA ARG 45 HA ARG 45 17.276 -30.628 19.811 344 HB2 ARG 45 HB3 ARG 45 19.872 -31.012 19.861 345 HB3 ARG 45 HB2 ARG 45 19.459 -32.408 20.842 346 HG2 ARG 45 HG3 ARG 45 18.372 -31.893 18.079 347 HG3 ARG 45 HG2 ARG 45 19.766 -32.910 18.437 348 HD2 ARG 45 HD3 ARG 45 18.316 -34.324 19.861 349 HD3 ARG 45 HD2 ARG 45 16.934 -33.344 19.377 350 HE ARG 45 HE ARG 45 18.376 -34.419 17.148 351 HH11 ARG 45 HH11 ARG 45 15.956 -35.162 19.580 352 HH12 ARG 45 HH12 ARG 45 15.170 -36.373 18.610 353 HH21 ARG 45 HH21 ARG 45 17.336 -35.998 15.866 354 HH22 ARG 45 HH22 ARG 45 15.939 -36.834 16.493 355 H GLY 46 H GLY 46 15.359 -30.957 20.949 356 HA2 GLY 46 HA3 GLY 46 14.070 -32.962 21.468 357 HA3 GLY 46 HA2 GLY 46 15.377 -33.443 22.537 358 H GLU 47 H GLU 47 14.425 -33.514 24.490 359 HA GLU 47 HA GLU 47 12.639 -31.366 25.315 360 HB2 GLU 47 HB3 GLU 47 13.543 -33.662 27.045 361 HB3 GLU 47 HB2 GLU 47 12.101 -32.677 27.216 362 HG2 GLU 47 HG3 GLU 47 11.352 -34.744 26.428 363 HG3 GLU 47 HG2 GLU 47 11.328 -33.682 25.021 364 H ARG 48 H ARG 48 15.681 -31.292 24.930 365 HA ARG 48 HA ARG 48 16.620 -30.559 27.580 366 HB2 ARG 48 HB3 ARG 48 18.053 -30.359 24.924 367 HB3 ARG 48 HB2 ARG 48 18.780 -30.233 26.516 368 HG2 ARG 48 HG3 ARG 48 17.472 -32.723 25.444 369 HG3 ARG 48 HG2 ARG 48 19.199 -32.379 25.344 370 HD2 ARG 48 HD3 ARG 48 18.877 -32.018 27.959 371 HD3 ARG 48 HD2 ARG 48 17.531 -33.126 27.683 372 HE ARG 48 HE ARG 48 20.346 -33.730 27.028 373 HH11 ARG 48 HH11 ARG 48 17.127 -34.796 27.936 374 HH12 ARG 48 HH12 ARG 48 17.629 -36.441 28.204 375 HH21 ARG 48 HH21 ARG 48 20.970 -35.887 27.338 376 HH22 ARG 48 HH22 ARG 48 19.799 -37.054 27.870 377 H GLU 49 H GLU 49 16.905 -28.482 28.259 378 HA GLU 49 HA GLU 49 16.101 -26.370 26.380 379 HB2 GLU 49 HB3 GLU 49 16.120 -26.439 29.394 380 HB3 GLU 49 HB2 GLU 49 15.844 -24.972 28.465 381 HG2 GLU 49 HG3 GLU 49 13.905 -26.095 27.391 382 HG3 GLU 49 HG2 GLU 49 14.143 -27.451 28.495 383 H VAL 50 H VAL 50 17.212 -24.273 26.678 384 HA VAL 50 HA VAL 50 20.049 -24.643 27.367 385 HB VAL 50 HB VAL 50 20.638 -23.017 25.625 386 HG11 VAL 50 HG11 VAL 50 20.153 -24.399 23.644 387 HG12 VAL 50 HG12 VAL 50 18.999 -25.328 24.601 388 HG13 VAL 50 HG13 VAL 50 20.712 -25.350 25.019 389 HG21 VAL 50 HG21 VAL 50 18.995 -22.289 23.971 390 HG22 VAL 50 HG22 VAL 50 18.564 -21.734 25.590 391 HG23 VAL 50 HG23 VAL 50 17.719 -23.105 24.873 392 H VAL 51 H VAL 51 20.896 -23.131 28.752 393 HA VAL 51 HA VAL 51 19.091 -20.990 29.571 394 HB VAL 51 HB VAL 51 20.062 -22.227 31.408 395 HG11 VAL 51 HG11 VAL 51 22.751 -21.413 30.326 396 HG12 VAL 51 HG12 VAL 51 22.087 -23.047 30.369 397 HG13 VAL 51 HG13 VAL 51 22.469 -22.208 31.874 398 HG21 VAL 51 HG21 VAL 51 21.089 -20.382 32.673 399 HG22 VAL 51 HG22 VAL 51 19.640 -19.883 31.799 400 HG23 VAL 51 HG23 VAL 51 21.235 -19.461 31.177 401 H GLY 52 H GLY 52 19.140 -19.531 28.029 402 HA2 GLY 52 HA3 GLY 52 21.539 -17.940 27.713 403 HA3 GLY 52 HA2 GLY 52 20.969 -18.735 26.249 404 HA PRO 53 HA PRO 53 18.459 -14.829 26.852 405 HB2 PRO 53 HB3 PRO 53 19.740 -13.104 25.259 406 HB3 PRO 53 HB2 PRO 53 20.264 -13.358 26.930 407 HG2 PRO 53 HG3 PRO 53 21.426 -14.434 24.394 408 HG3 PRO 53 HG2 PRO 53 22.257 -13.834 25.840 409 HD2 PRO 53 HD3 PRO 53 21.807 -16.499 25.236 410 HD3 PRO 53 HD2 PRO 53 22.151 -15.867 26.862 411 H LYS 54 H LYS 54 18.087 -17.143 25.337 412 HA LYS 54 HA LYS 54 18.254 -16.610 22.539 413 HB2 LYS 54 HB3 LYS 54 16.848 -18.878 22.568 414 HB3 LYS 54 HB2 LYS 54 18.588 -18.825 22.791 415 HG2 LYS 54 HG3 LYS 54 17.797 -20.286 24.438 416 HG3 LYS 54 HG2 LYS 54 18.122 -18.775 25.283 417 HD2 LYS 54 HD3 LYS 54 15.802 -18.244 25.390 418 HD3 LYS 54 HD2 LYS 54 15.385 -19.560 24.290 419 HE2 LYS 54 HE3 LYS 54 16.159 -21.182 25.961 420 HE3 LYS 54 HE2 LYS 54 16.553 -19.859 27.056 421 HZ1 LYS 54 HZ1 LYS 54 13.809 -20.277 26.001 422 HZ2 LYS 54 HZ2 LYS 54 14.297 -19.339 27.332 423 HZ3 LYS 54 HZ3 LYS 54 14.367 -21.027 27.419 424 H VAL 55 H VAL 55 16.967 -14.766 22.350 425 HA VAL 55 HA VAL 55 14.455 -15.556 21.246 426 HB VAL 55 HB VAL 55 13.655 -15.101 23.498 427 HG11 VAL 55 HG11 VAL 55 14.895 -12.368 23.206 428 HG12 VAL 55 HG12 VAL 55 15.462 -13.654 24.270 429 HG13 VAL 55 HG13 VAL 55 13.886 -12.912 24.548 430 HG21 VAL 55 HG21 VAL 55 12.030 -13.312 23.005 431 HG22 VAL 55 HG22 VAL 55 12.188 -14.467 21.682 432 HG23 VAL 55 HG23 VAL 55 12.963 -12.886 21.570 433 H ARG 56 H ARG 56 14.239 -14.500 19.390 434 HA ARG 56 HA ARG 56 15.527 -11.880 19.097 435 HB2 ARG 56 HB3 ARG 56 15.821 -14.188 17.161 436 HB3 ARG 56 HB2 ARG 56 16.357 -12.543 16.854 437 HG2 ARG 56 HG3 ARG 56 17.398 -14.409 18.976 438 HG3 ARG 56 HG2 ARG 56 18.230 -13.904 17.503 439 HD2 ARG 56 HD3 ARG 56 18.276 -11.611 18.283 440 HD3 ARG 56 HD2 ARG 56 17.362 -12.057 19.724 441 HE ARG 56 HE ARG 56 20.015 -13.222 19.202 442 HH11 ARG 56 HH11 ARG 56 17.831 -11.414 21.261 443 HH12 ARG 56 HH12 ARG 56 18.966 -11.306 22.572 444 HH21 ARG 56 HH21 ARG 56 21.494 -13.082 20.937 445 HH22 ARG 56 HH22 ARG 56 21.033 -12.237 22.392 446 H LYS 57 H LYS 57 14.269 -10.445 18.161 447 HA LYS 57 HA LYS 57 11.818 -11.413 16.868 448 HB2 LYS 57 HB3 LYS 57 11.500 -10.021 18.882 449 HB3 LYS 57 HB2 LYS 57 12.397 -8.718 18.117 450 HG2 LYS 57 HG3 LYS 57 10.698 -8.443 16.451 451 HG3 LYS 57 HG2 LYS 57 9.834 -9.869 17.032 452 HD2 LYS 57 HD3 LYS 57 8.772 -7.829 17.837 453 HD3 LYS 57 HD2 LYS 57 9.448 -8.755 19.179 454 HE2 LYS 57 HE3 LYS 57 11.443 -7.285 19.125 455 HE3 LYS 57 HE2 LYS 57 10.661 -6.321 17.873 456 HZ1 LYS 57 HZ1 LYS 57 8.868 -5.835 19.434 457 HZ2 LYS 57 HZ2 LYS 57 10.370 -5.327 20.043 458 HZ3 LYS 57 HZ3 LYS 57 9.649 -6.747 20.633 459 H CYS 58 H CYS 58 11.364 -10.850 14.813 460 HA CYS 58 HA CYS 58 13.480 -9.708 13.245 461 HB2 CYS 58 HB3 CYS 58 12.058 -11.549 12.392 462 HB3 CYS 58 HB2 CYS 58 10.673 -10.462 12.410 463 H LEU 59 H LEU 59 13.639 -7.698 12.444 464 HA LEU 59 HA LEU 59 11.607 -5.759 13.295 465 HB2 LEU 59 HB3 LEU 59 14.481 -5.338 12.458 466 HB3 LEU 59 HB2 LEU 59 13.374 -4.065 12.927 467 HG LEU 59 HG LEU 59 14.331 -6.289 14.729 468 HD11 LEU 59 HD11 LEU 59 15.070 -3.366 14.624 469 HD12 LEU 59 HD12 LEU 59 16.111 -4.724 14.197 470 HD13 LEU 59 HD13 LEU 59 15.583 -4.509 15.866 471 HD21 LEU 59 HD21 LEU 59 12.098 -5.567 15.319 472 HD22 LEU 59 HD22 LEU 59 12.600 -3.877 15.267 473 HD23 LEU 59 HD23 LEU 59 13.253 -4.954 16.505 474 H ALA 60 H ALA 60 11.797 -3.723 11.653 475 HA ALA 60 HA ALA 60 10.730 -4.712 9.172 476 HB1 ALA 60 HB1 ALA 60 9.746 -2.773 10.261 477 HB2 ALA 60 HB2 ALA 60 10.334 -2.355 8.653 478 HB3 ALA 60 HB3 ALA 60 11.260 -1.887 10.080 479 H ASN 61 H ASN 61 13.168 -5.680 9.218 480 HA ASN 61 HA ASN 61 14.345 -4.586 6.855 481 HB2 ASN 61 HB3 ASN 61 16.631 -4.302 7.809 482 HB3 ASN 61 HB2 ASN 61 15.482 -3.126 8.432 483 HD21 ASN 61 HD21 ASN 61 17.579 -5.740 9.171 484 HD22 ASN 61 HD22 ASN 61 17.342 -5.732 10.885 485 H GLY 62 H GLY 62 16.415 -6.000 6.342 486 HA2 GLY 62 HA3 GLY 62 15.344 -8.696 6.478 487 HA3 GLY 62 HA2 GLY 62 16.659 -8.143 5.458 488 H SER 63 H SER 63 16.439 -7.826 8.986 489 HA SER 63 HA SER 63 18.222 -10.051 9.424 490 HB2 SER 63 HB3 SER 63 19.218 -7.298 10.189 491 HB3 SER 63 HB2 SER 63 20.070 -8.835 10.359 492 HG SER 63 HG SER 63 19.450 -8.679 7.832 493 H TRP 64 H TRP 64 18.398 -10.618 11.625 494 HA TRP 64 HA TRP 64 16.195 -9.748 13.253 495 HB2 TRP 64 HB3 TRP 64 18.457 -11.659 13.891 496 HB3 TRP 64 HB2 TRP 64 16.981 -11.463 14.829 497 HD1 TRP 64 HD1 TRP 64 18.244 -12.919 11.502 498 HE1 TRP 64 HE1 TRP 64 16.479 -14.566 10.599 499 HE3 TRP 64 HE3 TRP 64 14.519 -12.070 14.906 500 HZ2 TRP 64 HZ2 TRP 64 13.858 -15.392 11.248 501 HZ3 TRP 64 HZ3 TRP 64 12.419 -13.333 14.694 502 HH2 TRP 64 HH2 TRP 64 12.098 -14.959 12.903 503 H THR 65 H THR 65 16.653 -9.247 15.636 504 HA THR 65 HA THR 65 17.943 -6.805 15.838 505 HB THR 65 HB THR 65 17.824 -7.233 18.350 506 HG1 THR 65 HG1 THR 65 17.199 -9.157 19.029 507 HG21 THR 65 HG21 THR 65 15.318 -7.617 16.706 508 HG22 THR 65 HG22 THR 65 16.059 -6.069 17.114 509 HG23 THR 65 HG23 THR 65 15.378 -7.082 18.387 510 H ASP 66 H ASP 66 19.035 -9.756 17.507 511 HA ASP 66 HA ASP 66 21.822 -8.948 16.971 512 HB2 ASP 66 HB3 ASP 66 21.169 -8.666 19.393 513 HB3 ASP 66 HB2 ASP 66 20.844 -10.390 19.451 514 H MET 67 H MET 67 22.195 -10.370 15.242 515 HA MET 67 HA MET 67 21.386 -13.146 15.729 516 HB2 MET 67 HB3 MET 67 20.574 -12.229 13.653 517 HB3 MET 67 HB2 MET 67 22.180 -11.688 13.205 518 HG2 MET 67 HG3 MET 67 22.915 -13.922 12.860 519 HG3 MET 67 HG2 MET 67 21.417 -14.579 13.521 520 HE1 MET 67 HE1 MET 67 22.799 -15.315 10.684 521 HE2 MET 67 HE2 MET 67 21.381 -15.423 9.643 522 HE3 MET 67 HE3 MET 67 21.341 -16.114 11.267 523 H ASP 68 H ASP 68 23.203 -13.053 17.331 524 HA ASP 68 HA ASP 68 24.815 -15.132 16.336 525 HB2 ASP 68 HB3 ASP 68 26.275 -13.204 15.645 526 HB3 ASP 68 HB2 ASP 68 26.408 -12.761 17.346 527 H THR 69 H THR 69 23.808 -16.322 17.991 528 HA THR 69 HA THR 69 24.530 -15.440 20.700 529 HB THR 69 HB THR 69 21.758 -16.456 20.143 530 HG1 THR 69 HG1 THR 69 22.831 -14.056 19.408 531 HG21 THR 69 HG21 THR 69 22.915 -14.707 22.311 532 HG22 THR 69 HG22 THR 69 22.541 -16.425 22.467 533 HG23 THR 69 HG23 THR 69 21.244 -15.257 22.206 534 HA PRO 70 HA PRO 70 25.412 -19.818 20.899 535 HB2 PRO 70 HB3 PRO 70 26.980 -19.718 23.070 536 HB3 PRO 70 HB2 PRO 70 27.532 -19.121 21.500 537 HG2 PRO 70 HG3 PRO 70 26.552 -17.600 23.875 538 HG3 PRO 70 HG2 PRO 70 27.857 -17.200 22.746 539 HD2 PRO 70 HD3 PRO 70 25.283 -16.156 22.656 540 HD3 PRO 70 HD2 PRO 70 26.429 -16.168 21.305 541 H SER 71 H SER 71 23.561 -20.861 21.476 542 HA SER 71 HA SER 71 22.518 -20.522 24.175 543 HB2 SER 71 HB3 SER 71 20.677 -22.044 23.255 544 HB3 SER 71 HB2 SER 71 20.818 -20.441 22.530 545 HG SER 71 HG SER 71 21.725 -22.918 21.485 546 H ARG 72 H ARG 72 23.572 -21.685 25.655 547 HA ARG 72 HA ARG 72 24.703 -24.278 24.962 548 HB2 ARG 72 HB3 ARG 72 25.713 -24.162 27.240 549 HB3 ARG 72 HB2 ARG 72 26.129 -22.791 26.220 550 HG2 ARG 72 HG3 ARG 72 24.443 -21.435 27.355 551 HG3 ARG 72 HG2 ARG 72 24.038 -22.806 28.385 552 HD2 ARG 72 HD3 ARG 72 25.511 -21.277 29.552 553 HD3 ARG 72 HD2 ARG 72 26.326 -22.812 29.261 554 HE ARG 72 HE ARG 72 27.623 -21.749 27.549 555 HH11 ARG 72 HH11 ARG 72 25.658 -19.560 29.456 556 HH12 ARG 72 HH12 ARG 72 26.648 -18.174 29.116 557 HH21 ARG 72 HH21 ARG 72 28.909 -19.943 27.085 558 HH22 ARG 72 HH22 ARG 72 28.507 -18.387 27.754 559 H CYS 73 H CYS 73 23.748 -26.153 25.371 560 HA CYS 73 HA CYS 73 21.187 -26.275 26.629 561 HB2 CYS 73 HB3 CYS 73 23.027 -28.546 25.839 562 HB3 CYS 73 HB2 CYS 73 21.306 -28.669 26.190 563 H VAL 74 H VAL 74 20.758 -26.456 28.717 564 HA VAL 74 HA VAL 74 22.663 -27.830 30.480 565 HB VAL 74 HB VAL 74 21.452 -25.115 31.079 566 HG11 VAL 74 HG11 VAL 74 22.696 -25.227 33.192 567 HG12 VAL 74 HG12 VAL 74 23.196 -26.873 32.806 568 HG13 VAL 74 HG13 VAL 74 21.491 -26.510 33.075 569 HG21 VAL 74 HG21 VAL 74 23.754 -24.318 31.151 570 HG22 VAL 74 HG22 VAL 74 23.385 -25.015 29.573 571 HG23 VAL 74 HG23 VAL 74 24.338 -25.930 30.740 572 H ARG 75 H ARG 75 21.692 -29.070 32.010 573 HA ARG 75 HA ARG 75 18.793 -28.803 32.333 574 HB2 ARG 75 HB3 ARG 75 18.675 -31.326 32.361 575 HB3 ARG 75 HB2 ARG 75 18.983 -30.598 30.793 576 HG2 ARG 75 HG3 ARG 75 20.959 -31.620 30.585 577 HG3 ARG 75 HG2 ARG 75 21.414 -31.282 32.259 578 HD2 ARG 75 HD3 ARG 75 19.599 -33.488 31.288 579 HD3 ARG 75 HD2 ARG 75 21.229 -33.673 31.937 580 HE ARG 75 HE ARG 75 19.697 -32.331 33.847 581 HH11 ARG 75 HH11 ARG 75 19.936 -35.522 32.377 582 HH12 ARG 75 HH12 ARG 75 19.173 -36.320 33.722 583 HH21 ARG 75 HH21 ARG 75 18.694 -33.384 35.585 584 HH22 ARG 75 HH22 ARG 75 18.471 -35.111 35.541 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 1.251 -3.600 -1.293 2 H2 GLY 1 HT2 GLY 1 0.928 -4.843 -2.399 3 H3 GLY 1 HT3 GLY 1 0.376 -3.273 -2.712 4 HA2 GLY 1 HA2 GLY 1 2.277 -3.678 -4.073 5 HA3 GLY 1 HA3 GLY 1 2.692 -2.501 -2.833 6 HA PRO 2 HA PRO 2 5.668 -6.068 -2.660 7 HB2 PRO 2 HB3 PRO 2 7.870 -4.522 -3.494 8 HB3 PRO 2 HB2 PRO 2 6.972 -5.689 -4.462 9 HG2 PRO 2 HG3 PRO 2 7.063 -2.905 -4.850 10 HG3 PRO 2 HG2 PRO 2 5.964 -4.049 -5.636 11 HD2 PRO 2 HD3 PRO 2 5.481 -2.227 -3.339 12 HD3 PRO 2 HD2 PRO 2 4.349 -2.829 -4.570 13 H THR 3 H THR 3 4.848 -4.020 -0.638 14 HA THR 3 HA THR 3 7.291 -3.227 0.667 15 HB THR 3 HB THR 3 5.739 -2.539 2.534 16 HG1 THR 3 HG1 THR 3 4.067 -4.066 1.969 17 HG21 THR 3 HG21 THR 3 6.434 -0.972 0.774 18 HG22 THR 3 HG22 THR 3 4.789 -0.650 1.322 19 HG23 THR 3 HG23 THR 3 5.060 -1.479 -0.211 20 H SER 4 H SER 4 8.471 -4.956 1.300 21 HA SER 4 HA SER 4 7.188 -6.791 3.207 22 HB2 SER 4 HB3 SER 4 9.286 -7.549 1.154 23 HB3 SER 4 HB2 SER 4 8.539 -8.630 2.330 24 HG SER 4 HG SER 4 6.482 -7.982 1.278 25 H GLU 5 H GLU 5 7.969 -5.832 5.022 26 HA GLU 5 HA GLU 5 10.881 -5.655 5.296 27 HB2 GLU 5 HB3 GLU 5 8.703 -4.671 7.154 28 HB3 GLU 5 HB2 GLU 5 10.432 -4.414 7.363 29 HG2 GLU 5 HG3 GLU 5 10.502 -3.094 5.324 30 HG3 GLU 5 HG2 GLU 5 8.781 -3.377 5.070 31 H GLY 6 H GLY 6 11.605 -7.669 5.700 32 HA2 GLY 6 HA3 GLY 6 10.758 -8.998 8.107 33 HA3 GLY 6 HA2 GLY 6 10.258 -9.823 6.639 34 H CYS 7 H CYS 7 11.867 -11.025 8.450 35 HA CYS 7 HA CYS 7 14.578 -10.915 7.333 36 HB2 CYS 7 HB3 CYS 7 13.605 -12.303 9.843 37 HB3 CYS 7 HB2 CYS 7 15.277 -12.018 9.374 38 H GLN 8 H GLN 8 15.584 -12.886 6.629 39 HA GLN 8 HA GLN 8 13.777 -14.814 5.545 40 HB2 GLN 8 HB3 GLN 8 15.768 -15.994 4.760 41 HB3 GLN 8 HB2 GLN 8 15.855 -14.285 4.375 42 HG2 GLN 8 HG3 GLN 8 17.478 -13.878 6.013 43 HG3 GLN 8 HG2 GLN 8 17.176 -15.420 6.811 44 HE21 GLN 8 HE21 GLN 8 17.136 -17.002 4.413 45 HE22 GLN 8 HE22 GLN 8 18.762 -17.089 3.836 46 H ILE 9 H ILE 9 14.603 -17.240 5.857 47 HA ILE 9 HA ILE 9 14.027 -17.808 8.643 48 HB ILE 9 HB ILE 9 12.765 -18.989 6.902 49 HG12 ILE 9 HG13 ILE 9 14.597 -20.807 8.480 50 HG13 ILE 9 HG12 ILE 9 13.086 -20.111 9.053 51 HG21 ILE 9 HG21 ILE 9 13.835 -20.661 5.475 52 HG22 ILE 9 HG22 ILE 9 15.412 -20.195 6.112 53 HG23 ILE 9 HG23 ILE 9 14.469 -19.044 5.166 54 HD11 ILE 9 HD11 ILE 9 13.366 -22.062 6.781 55 HD12 ILE 9 HD12 ILE 9 11.857 -21.387 7.391 56 HD13 ILE 9 HD13 ILE 9 12.824 -22.447 8.414 57 H ILE 10 H ILE 10 15.376 -18.922 10.029 58 HA ILE 10 HA ILE 10 18.201 -18.876 9.275 59 HB ILE 10 HB ILE 10 16.973 -19.218 12.017 60 HG12 ILE 10 HG13 ILE 10 18.165 -16.748 10.736 61 HG13 ILE 10 HG12 ILE 10 16.448 -17.018 11.002 62 HG21 ILE 10 HG21 ILE 10 19.229 -20.135 11.824 63 HG22 ILE 10 HG22 ILE 10 19.212 -18.696 12.843 64 HG23 ILE 10 HG23 ILE 10 19.805 -18.594 11.185 65 HD11 ILE 10 HD11 ILE 10 18.552 -16.790 13.139 66 HD12 ILE 10 HD12 ILE 10 16.831 -17.065 13.411 67 HD13 ILE 10 HD13 ILE 10 17.380 -15.551 12.690 68 H HIS 11 H HIS 11 19.447 -20.649 9.180 69 HA HIS 11 HA HIS 11 18.154 -23.247 9.379 70 HB2 HIS 11 HB3 HIS 11 19.873 -22.306 7.552 71 HB3 HIS 11 HB2 HIS 11 21.043 -22.958 8.693 72 HD1 HIS 11 HD1 HIS 11 21.512 -25.416 8.530 73 HD2 HIS 11 HD2 HIS 11 17.992 -24.306 6.603 74 HE1 HIS 11 HE1 HIS 11 20.716 -27.480 7.319 75 HE2 HIS 11 HE2 HIS 11 18.674 -26.737 6.029 76 HA PRO 12 HA PRO 12 19.571 -23.882 13.548 77 HB2 PRO 12 HB3 PRO 12 19.528 -26.752 12.793 78 HB3 PRO 12 HB2 PRO 12 18.709 -25.924 14.123 79 HG2 PRO 12 HG3 PRO 12 17.350 -26.741 11.978 80 HG3 PRO 12 HG2 PRO 12 16.964 -25.208 12.781 81 HD2 PRO 12 HD3 PRO 12 18.465 -25.697 10.240 82 HD3 PRO 12 HD2 PRO 12 17.308 -24.411 10.638 83 HA PRO 13 HA PRO 13 23.897 -24.440 12.380 84 HB2 PRO 13 HB3 PRO 13 24.536 -23.061 14.847 85 HB3 PRO 13 HB2 PRO 13 24.767 -22.515 13.185 86 HG2 PRO 13 HG3 PRO 13 22.959 -21.404 14.909 87 HG3 PRO 13 HG2 PRO 13 22.772 -21.394 13.147 88 HD2 PRO 13 HD3 PRO 13 21.480 -23.162 15.183 89 HD3 PRO 13 HD2 PRO 13 20.793 -22.448 13.708 90 H TRP 14 H TRP 14 23.082 -24.528 15.849 91 HA TRP 14 HA TRP 14 24.988 -26.695 16.230 92 HB2 TRP 14 HB3 TRP 14 24.586 -24.521 17.723 93 HB3 TRP 14 HB2 TRP 14 23.399 -25.572 18.488 94 HD1 TRP 14 HD1 TRP 14 24.352 -26.784 20.529 95 HE1 TRP 14 HE1 TRP 14 26.668 -27.644 21.262 96 HE3 TRP 14 HE3 TRP 14 27.051 -25.469 16.390 97 HZ2 TRP 14 HZ2 TRP 14 29.287 -27.756 20.210 98 HZ3 TRP 14 HZ3 TRP 14 29.453 -25.990 16.333 99 HH2 TRP 14 HH2 TRP 14 30.550 -27.111 18.205 100 H GLU 15 H GLU 15 24.060 -28.237 18.162 101 HA GLU 15 HA GLU 15 22.113 -29.833 16.840 102 HB2 GLU 15 HB3 GLU 15 22.381 -31.361 18.725 103 HB3 GLU 15 HB2 GLU 15 23.941 -30.810 18.133 104 HG2 GLU 15 HG3 GLU 15 24.013 -29.168 19.979 105 HG3 GLU 15 HG2 GLU 15 22.504 -29.845 20.594 106 H GLY 16 H GLY 16 21.400 -27.083 18.117 107 HA2 GLY 16 HA3 GLY 16 19.106 -27.937 19.724 108 HA3 GLY 16 HA2 GLY 16 19.672 -26.284 19.536 109 H GLY 17 H GLY 17 17.677 -25.461 18.928 110 HA2 GLY 17 HA3 GLY 17 17.081 -25.700 16.129 111 HA3 GLY 17 HA2 GLY 17 15.852 -26.445 17.144 112 H ILE 18 H ILE 18 14.597 -24.676 15.963 113 HA ILE 18 HA ILE 18 14.644 -22.280 17.655 114 HB ILE 18 HB ILE 18 14.398 -22.399 14.659 115 HG12 ILE 18 HG13 ILE 18 16.101 -20.826 16.591 116 HG13 ILE 18 HG12 ILE 18 16.636 -22.160 15.576 117 HG21 ILE 18 HG21 ILE 18 13.660 -20.064 16.425 118 HG22 ILE 18 HG22 ILE 18 12.533 -21.041 15.486 119 HG23 ILE 18 HG23 ILE 18 13.735 -20.047 14.663 120 HD11 ILE 18 HD11 ILE 18 16.205 -20.812 13.580 121 HD12 ILE 18 HD12 ILE 18 17.361 -20.037 14.665 122 HD13 ILE 18 HD13 ILE 18 15.692 -19.472 14.606 123 H ARG 19 H ARG 19 12.759 -21.619 18.422 124 HA ARG 19 HA ARG 19 10.394 -23.218 17.720 125 HB2 ARG 19 HB3 ARG 19 11.502 -22.952 20.132 126 HB3 ARG 19 HB2 ARG 19 10.487 -21.516 20.161 127 HG2 ARG 19 HG3 ARG 19 9.260 -23.293 21.174 128 HG3 ARG 19 HG2 ARG 19 8.531 -22.957 19.601 129 HD2 ARG 19 HD3 ARG 19 9.933 -24.822 18.672 130 HD3 ARG 19 HD2 ARG 19 10.375 -25.223 20.329 131 HE ARG 19 HE ARG 19 7.550 -25.196 19.489 132 HH11 ARG 19 HH11 ARG 19 10.287 -26.834 20.937 133 HH12 ARG 19 HH12 ARG 19 9.407 -28.295 21.257 134 HH21 ARG 19 HH21 ARG 19 6.386 -27.099 19.922 135 HH22 ARG 19 HH22 ARG 19 7.187 -28.454 20.664 136 H TYR 20 H TYR 20 8.599 -22.231 16.972 137 HA TYR 20 HA TYR 20 8.751 -19.339 16.540 138 HB2 TYR 20 HB3 TYR 20 7.076 -21.486 15.224 139 HB3 TYR 20 HB2 TYR 20 6.914 -19.768 14.875 140 HD1 TYR 20 HD1 TYR 20 9.123 -22.702 14.571 141 HD2 TYR 20 HD2 TYR 20 8.511 -18.635 13.486 142 HE1 TYR 20 HE1 TYR 20 10.905 -22.888 12.887 143 HE2 TYR 20 HE2 TYR 20 10.293 -18.811 11.803 144 HH TYR 20 HH TYR 20 12.272 -20.183 11.370 145 H ARG 21 H ARG 21 6.115 -18.658 16.248 146 HA ARG 21 HA ARG 21 5.260 -18.653 19.004 147 HB2 ARG 21 HB3 ARG 21 4.467 -17.217 16.538 148 HB3 ARG 21 HB2 ARG 21 3.232 -17.406 17.774 149 HG2 ARG 21 HG3 ARG 21 4.912 -16.431 19.400 150 HG3 ARG 21 HG2 ARG 21 5.867 -15.988 17.982 151 HD2 ARG 21 HD3 ARG 21 4.091 -14.645 17.120 152 HD3 ARG 21 HD2 ARG 21 2.980 -15.226 18.356 153 HE ARG 21 HE ARG 21 5.348 -13.614 19.041 154 HH11 ARG 21 HH11 ARG 21 1.959 -14.363 19.354 155 HH12 ARG 21 HH12 ARG 21 1.599 -12.976 20.339 156 HH21 ARG 21 HH21 ARG 21 4.915 -11.793 20.357 157 HH22 ARG 21 HH22 ARG 21 3.285 -11.499 20.905 158 H GLY 22 H GLY 22 3.996 -19.910 15.947 159 HA2 GLY 22 HA3 GLY 22 2.590 -22.002 17.315 160 HA3 GLY 22 HA2 GLY 22 1.508 -20.765 16.691 161 H LEU 23 H LEU 23 4.329 -22.621 15.573 162 HA LEU 23 HA LEU 23 2.869 -23.064 13.061 163 HB2 LEU 23 HB3 LEU 23 5.837 -22.669 13.437 164 HB3 LEU 23 HB2 LEU 23 5.083 -23.161 11.934 165 HG LEU 23 HG LEU 23 4.696 -20.518 13.341 166 HD11 LEU 23 HD11 LEU 23 5.801 -19.596 11.360 167 HD12 LEU 23 HD12 LEU 23 6.049 -21.229 10.744 168 HD13 LEU 23 HD13 LEU 23 6.847 -20.717 12.230 169 HD21 LEU 23 HD21 LEU 23 2.631 -21.232 12.271 170 HD22 LEU 23 HD22 LEU 23 3.500 -21.537 10.768 171 HD23 LEU 23 HD23 LEU 23 3.361 -19.892 11.387 172 H THR 24 H THR 24 2.284 -25.085 12.896 173 HA THR 24 HA THR 24 3.623 -27.220 14.281 174 HB THR 24 HB THR 24 1.160 -27.214 13.930 175 HG1 THR 24 HG1 THR 24 2.344 -29.215 14.212 176 HG21 THR 24 HG21 THR 24 1.072 -26.252 11.701 177 HG22 THR 24 HG22 THR 24 0.254 -27.814 11.725 178 HG23 THR 24 HG23 THR 24 1.871 -27.676 11.033 179 H ARG 25 H ARG 25 3.866 -29.317 12.682 180 HA ARG 25 HA ARG 25 6.224 -28.741 11.206 181 HB2 ARG 25 HB3 ARG 25 4.550 -31.250 11.320 182 HB3 ARG 25 HB2 ARG 25 6.139 -31.140 10.583 183 HG2 ARG 25 HG3 ARG 25 7.106 -30.554 12.754 184 HG3 ARG 25 HG2 ARG 25 5.508 -30.689 13.492 185 HD2 ARG 25 HD3 ARG 25 5.394 -33.036 12.834 186 HD3 ARG 25 HD2 ARG 25 6.978 -32.906 12.073 187 HE ARG 25 HE ARG 25 7.216 -32.123 14.753 188 HH11 ARG 25 HH11 ARG 25 6.546 -34.980 12.842 189 HH12 ARG 25 HH12 ARG 25 7.181 -36.082 14.029 190 HH21 ARG 25 HH21 ARG 25 8.089 -33.561 16.303 191 HH22 ARG 25 HH22 ARG 25 8.074 -35.272 15.995 192 H ASP 26 H ASP 26 6.181 -30.264 8.977 193 HA ASP 26 HA ASP 26 5.872 -30.116 6.744 194 HB2 ASP 26 HB3 ASP 26 3.550 -30.741 7.042 195 HB3 ASP 26 HB2 ASP 26 3.122 -29.085 7.462 196 H GLN 27 H GLN 27 4.716 -27.277 8.484 197 HA GLN 27 HA GLN 27 5.412 -25.423 6.447 198 HB2 GLN 27 HB3 GLN 27 4.852 -25.115 9.391 199 HB3 GLN 27 HB2 GLN 27 5.171 -23.753 8.326 200 HG2 GLN 27 HG3 GLN 27 3.224 -24.188 7.043 201 HG3 GLN 27 HG2 GLN 27 2.964 -25.734 7.845 202 HE21 GLN 27 HE21 GLN 27 3.545 -24.759 10.489 203 HE22 GLN 27 HE22 GLN 27 2.197 -23.779 10.963 204 H VAL 28 H VAL 28 6.887 -23.507 7.317 205 HA VAL 28 HA VAL 28 8.986 -22.725 7.440 206 HB VAL 28 HB VAL 28 10.308 -23.173 9.302 207 HG11 VAL 28 HG11 VAL 28 7.485 -23.842 10.102 208 HG12 VAL 28 HG12 VAL 28 8.152 -22.227 9.871 209 HG13 VAL 28 HG13 VAL 28 8.754 -23.252 11.176 210 HG21 VAL 28 HG21 VAL 28 10.659 -25.565 9.037 211 HG22 VAL 28 HG22 VAL 28 9.013 -25.884 9.584 212 HG23 VAL 28 HG23 VAL 28 10.188 -25.182 10.694 213 H LYS 29 H LYS 29 8.378 -25.415 5.901 214 HA LYS 29 HA LYS 29 11.068 -26.328 5.388 215 HB2 LYS 29 HB3 LYS 29 10.067 -27.797 3.742 216 HB3 LYS 29 HB2 LYS 29 9.121 -27.857 5.220 217 HG2 LYS 29 HG3 LYS 29 7.486 -26.316 4.206 218 HG3 LYS 29 HG2 LYS 29 8.419 -26.347 2.708 219 HD2 LYS 29 HD3 LYS 29 8.044 -28.725 2.478 220 HD3 LYS 29 HD2 LYS 29 7.227 -28.779 4.040 221 HE2 LYS 29 HE3 LYS 29 5.528 -27.193 3.108 222 HE3 LYS 29 HE2 LYS 29 6.296 -27.392 1.534 223 HZ1 LYS 29 HZ1 LYS 29 5.894 -29.831 1.797 224 HZ2 LYS 29 HZ2 LYS 29 4.492 -28.893 1.621 225 HZ3 LYS 29 HZ3 LYS 29 4.936 -29.472 3.153 226 H ALA 30 H ALA 30 9.033 -23.848 4.342 227 HA ALA 30 HA ALA 30 11.008 -22.790 2.573 228 HB1 ALA 30 HB1 ALA 30 9.932 -24.354 1.035 229 HB2 ALA 30 HB2 ALA 30 9.615 -22.683 0.569 230 HB3 ALA 30 HB3 ALA 30 8.364 -23.624 1.380 231 H ILE 31 H ILE 31 10.982 -21.010 3.842 232 HA ILE 31 HA ILE 31 8.590 -19.313 3.639 233 HB ILE 31 HB ILE 31 10.287 -19.658 6.125 234 HG12 ILE 31 HG13 ILE 31 7.356 -20.194 5.590 235 HG13 ILE 31 HG12 ILE 31 8.600 -21.411 5.852 236 HG21 ILE 31 HG21 ILE 31 9.728 -17.307 5.771 237 HG22 ILE 31 HG22 ILE 31 8.851 -17.964 7.151 238 HG23 ILE 31 HG23 ILE 31 8.021 -17.728 5.612 239 HD11 ILE 31 HD11 ILE 31 7.227 -21.091 7.831 240 HD12 ILE 31 HD12 ILE 31 7.666 -19.384 7.871 241 HD13 ILE 31 HD13 ILE 31 8.898 -20.618 8.138 242 H ASN 32 H ASN 32 9.026 -17.302 2.947 243 HA ASN 32 HA ASN 32 11.793 -16.764 2.250 244 HB2 ASN 32 HB3 ASN 32 9.228 -15.377 1.452 245 HB3 ASN 32 HB2 ASN 32 10.829 -14.906 0.893 246 HD21 ASN 32 HD21 ASN 32 11.928 -16.228 -0.555 247 HD22 ASN 32 HD22 ASN 32 11.138 -17.487 -1.435 248 H PHE 33 H PHE 33 9.115 -15.078 3.920 249 HA PHE 33 HA PHE 33 11.158 -13.474 5.291 250 HB2 PHE 33 HB3 PHE 33 8.664 -12.377 3.987 251 HB3 PHE 33 HB2 PHE 33 9.737 -11.455 5.031 252 HD1 PHE 33 HD1 PHE 33 9.067 -12.537 1.703 253 HD2 PHE 33 HD2 PHE 33 12.149 -11.170 4.295 254 HE1 PHE 33 HE1 PHE 33 10.431 -11.926 -0.253 255 HE2 PHE 33 HE2 PHE 33 13.524 -10.559 2.348 256 HZ PHE 33 HZ PHE 33 12.664 -10.936 0.069 257 H LEU 34 H LEU 34 10.895 -13.413 7.400 258 HA LEU 34 HA LEU 34 8.259 -13.904 8.592 259 HB2 LEU 34 HB3 LEU 34 11.033 -13.681 9.776 260 HB3 LEU 34 HB2 LEU 34 9.587 -13.752 10.760 261 HG LEU 34 HG LEU 34 10.518 -15.927 10.761 262 HD11 LEU 34 HD11 LEU 34 8.109 -15.888 10.548 263 HD12 LEU 34 HD12 LEU 34 8.783 -17.284 9.705 264 HD13 LEU 34 HD13 LEU 34 8.244 -15.874 8.791 265 HD21 LEU 34 HD21 LEU 34 12.000 -15.731 8.845 266 HD22 LEU 34 HD22 LEU 34 10.618 -15.784 7.752 267 HD23 LEU 34 HD23 LEU 34 11.021 -17.195 8.731 268 HA PRO 35 HA PRO 35 7.656 -9.523 8.297 269 HB2 PRO 35 HB3 PRO 35 5.579 -9.395 10.133 270 HB3 PRO 35 HB2 PRO 35 5.403 -9.772 8.418 271 HG2 PRO 35 HG3 PRO 35 5.535 -11.615 10.763 272 HG3 PRO 35 HG2 PRO 35 4.523 -11.716 9.309 273 HD2 PRO 35 HD3 PRO 35 6.696 -13.252 9.601 274 HD3 PRO 35 HD2 PRO 35 6.255 -12.576 8.018 275 H VAL 36 H VAL 36 8.213 -7.683 9.367 276 HA VAL 36 HA VAL 36 9.798 -7.832 11.690 277 HB VAL 36 HB VAL 36 10.219 -6.071 10.121 278 HG11 VAL 36 HG11 VAL 36 8.000 -5.780 9.188 279 HG12 VAL 36 HG12 VAL 36 8.650 -4.227 9.712 280 HG13 VAL 36 HG13 VAL 36 7.440 -5.053 10.693 281 HG21 VAL 36 HG21 VAL 36 10.743 -5.541 12.438 282 HG22 VAL 36 HG22 VAL 36 9.122 -4.885 12.669 283 HG23 VAL 36 HG23 VAL 36 10.244 -4.093 11.563 284 H ASP 37 H ASP 37 8.575 -8.886 13.197 285 HA ASP 37 HA ASP 37 7.310 -7.542 15.208 286 HB2 ASP 37 HB3 ASP 37 5.472 -6.941 13.753 287 HB3 ASP 37 HB2 ASP 37 5.317 -8.599 13.179 288 H TYR 38 H TYR 38 7.481 -10.394 13.228 289 HA TYR 38 HA TYR 38 6.485 -12.234 15.130 290 HB2 TYR 38 HB3 TYR 38 6.790 -12.514 12.571 291 HB3 TYR 38 HB2 TYR 38 8.440 -12.978 12.974 292 HD1 TYR 38 HD1 TYR 38 8.882 -15.061 14.198 293 HD2 TYR 38 HD2 TYR 38 4.925 -13.944 13.102 294 HE1 TYR 38 HE1 TYR 38 8.106 -17.345 14.669 295 HE2 TYR 38 HE2 TYR 38 4.144 -16.225 13.570 296 HH TYR 38 HH TYR 38 5.116 -18.510 13.665 297 H GLU 39 H GLU 39 7.514 -13.548 16.556 298 HA GLU 39 HA GLU 39 10.335 -12.937 17.137 299 HB2 GLU 39 HB3 GLU 39 8.167 -13.460 19.177 300 HB3 GLU 39 HB2 GLU 39 9.829 -12.985 19.498 301 HG2 GLU 39 HG3 GLU 39 9.468 -10.802 18.901 302 HG3 GLU 39 HG2 GLU 39 8.116 -11.202 17.842 303 H ILE 40 H ILE 40 11.603 -14.667 17.742 304 HA ILE 40 HA ILE 40 10.282 -17.293 17.956 305 HB ILE 40 HB ILE 40 12.158 -18.336 16.732 306 HG12 ILE 40 HG13 ILE 40 12.918 -15.506 15.993 307 HG13 ILE 40 HG12 ILE 40 13.787 -16.490 17.162 308 HG21 ILE 40 HG21 ILE 40 10.091 -17.852 15.553 309 HG22 ILE 40 HG22 ILE 40 11.474 -17.633 14.482 310 HG23 ILE 40 HG23 ILE 40 10.667 -16.227 15.174 311 HD11 ILE 40 HD11 ILE 40 14.341 -18.091 15.418 312 HD12 ILE 40 HD12 ILE 40 14.896 -16.469 15.005 313 HD13 ILE 40 HD13 ILE 40 13.448 -17.126 14.242 314 H GLU 41 H GLU 41 11.861 -18.971 18.840 315 HA GLU 41 HA GLU 41 13.613 -17.737 20.858 316 HB2 GLU 41 HB3 GLU 41 11.483 -18.406 21.888 317 HB3 GLU 41 HB2 GLU 41 11.712 -20.046 21.297 318 HG2 GLU 41 HG3 GLU 41 13.666 -20.315 22.685 319 HG3 GLU 41 HG2 GLU 41 13.549 -18.640 23.219 320 H TYR 42 H TYR 42 15.529 -18.712 21.213 321 HA TYR 42 HA TYR 42 16.359 -20.854 19.455 322 HB2 TYR 42 HB3 TYR 42 17.773 -19.082 21.424 323 HB3 TYR 42 HB2 TYR 42 18.555 -20.541 20.833 324 HD1 TYR 42 HD1 TYR 42 20.353 -19.098 19.939 325 HD2 TYR 42 HD2 TYR 42 16.348 -18.789 18.535 326 HE1 TYR 42 HE1 TYR 42 21.146 -17.870 17.962 327 HE2 TYR 42 HE2 TYR 42 17.133 -17.567 16.555 328 HH TYR 42 HH TYR 42 20.401 -17.379 15.669 329 H VAL 43 H VAL 43 15.615 -22.806 20.032 330 HA VAL 43 HA VAL 43 15.807 -23.577 22.864 331 HB VAL 43 HB VAL 43 14.152 -25.321 22.384 332 HG11 VAL 43 HG11 VAL 43 12.208 -23.863 22.003 333 HG12 VAL 43 HG12 VAL 43 13.295 -22.567 21.500 334 HG13 VAL 43 HG13 VAL 43 13.347 -23.171 23.158 335 HG21 VAL 43 HG21 VAL 43 14.042 -24.133 19.611 336 HG22 VAL 43 HG22 VAL 43 12.976 -25.390 20.243 337 HG23 VAL 43 HG23 VAL 43 14.696 -25.717 20.031 338 H CYS 44 H CYS 44 16.176 -26.002 23.152 339 HA CYS 44 HA CYS 44 18.201 -26.942 21.227 340 HB2 CYS 44 HB3 CYS 44 18.889 -26.522 23.668 341 HB3 CYS 44 HB2 CYS 44 17.892 -27.915 24.067 342 H ARG 45 H ARG 45 18.141 -29.005 20.521 343 HA ARG 45 HA ARG 45 15.453 -29.885 20.100 344 HB2 ARG 45 HB3 ARG 45 17.019 -29.799 18.256 345 HB3 ARG 45 HB2 ARG 45 18.116 -30.891 19.092 346 HG2 ARG 45 HG3 ARG 45 16.425 -32.618 19.005 347 HG3 ARG 45 HG2 ARG 45 15.365 -31.549 18.092 348 HD2 ARG 45 HD3 ARG 45 17.104 -31.379 16.343 349 HD3 ARG 45 HD2 ARG 45 18.088 -32.535 17.241 350 HE ARG 45 HE ARG 45 15.487 -33.574 16.695 351 HH11 ARG 45 HH11 ARG 45 18.606 -32.935 15.209 352 HH12 ARG 45 HH12 ARG 45 18.448 -34.216 14.034 353 HH21 ARG 45 HH21 ARG 45 15.262 -35.220 15.134 354 HH22 ARG 45 HH22 ARG 45 16.529 -35.501 13.975 355 H GLY 46 H GLY 46 14.452 -31.618 20.950 356 HA2 GLY 46 HA3 GLY 46 14.397 -33.796 21.916 357 HA3 GLY 46 HA2 GLY 46 16.030 -33.534 22.518 358 H GLU 47 H GLU 47 15.446 -34.112 24.622 359 HA GLU 47 HA GLU 47 13.556 -32.353 26.000 360 HB2 GLU 47 HB3 GLU 47 14.006 -33.840 27.979 361 HB3 GLU 47 HB2 GLU 47 13.277 -34.648 26.602 362 HG2 GLU 47 HG3 GLU 47 16.233 -34.705 27.120 363 HG3 GLU 47 HG2 GLU 47 15.122 -35.881 27.819 364 H ARG 48 H ARG 48 16.351 -31.766 24.935 365 HA ARG 48 HA ARG 48 17.746 -30.936 27.350 366 HB2 ARG 48 HB3 ARG 48 18.534 -30.258 24.517 367 HB3 ARG 48 HB2 ARG 48 19.562 -30.363 25.936 368 HG2 ARG 48 HG3 ARG 48 18.224 -32.701 24.590 369 HG3 ARG 48 HG2 ARG 48 19.903 -32.217 24.363 370 HD2 ARG 48 HD3 ARG 48 18.654 -33.074 26.971 371 HD3 ARG 48 HD2 ARG 48 19.676 -34.078 25.948 372 HE ARG 48 HE ARG 48 20.526 -32.089 27.818 373 HH11 ARG 48 HH11 ARG 48 21.397 -33.623 24.783 374 HH12 ARG 48 HH12 ARG 48 23.098 -33.331 24.974 375 HH21 ARG 48 HH21 ARG 48 22.745 -31.757 28.103 376 HH22 ARG 48 HH22 ARG 48 23.876 -32.296 26.893 377 H GLU 49 H GLU 49 17.233 -29.027 28.264 378 HA GLU 49 HA GLU 49 15.935 -26.997 26.624 379 HB2 GLU 49 HB3 GLU 49 16.290 -27.144 29.622 380 HB3 GLU 49 HB2 GLU 49 15.413 -25.882 28.764 381 HG2 GLU 49 HG3 GLU 49 13.893 -27.638 27.870 382 HG3 GLU 49 HG2 GLU 49 14.712 -28.801 28.912 383 H VAL 50 H VAL 50 16.588 -24.662 27.308 384 HA VAL 50 HA VAL 50 19.520 -24.530 27.452 385 HB VAL 50 HB VAL 50 19.366 -22.576 25.827 386 HG11 VAL 50 HG11 VAL 50 18.745 -25.354 24.844 387 HG12 VAL 50 HG12 VAL 50 20.343 -24.668 25.146 388 HG13 VAL 50 HG13 VAL 50 19.344 -24.033 23.839 389 HG21 VAL 50 HG21 VAL 50 16.955 -22.238 25.929 390 HG22 VAL 50 HG22 VAL 50 16.695 -23.839 25.232 391 HG23 VAL 50 HG23 VAL 50 17.477 -22.579 24.278 392 H VAL 51 H VAL 51 20.165 -23.258 29.075 393 HA VAL 51 HA VAL 51 18.467 -21.008 29.842 394 HB VAL 51 HB VAL 51 19.304 -22.236 31.734 395 HG11 VAL 51 HG11 VAL 51 22.067 -21.802 30.615 396 HG12 VAL 51 HG12 VAL 51 21.211 -23.337 30.748 397 HG13 VAL 51 HG13 VAL 51 21.709 -22.476 32.205 398 HG21 VAL 51 HG21 VAL 51 19.178 -19.801 31.968 399 HG22 VAL 51 HG22 VAL 51 20.867 -19.670 31.472 400 HG23 VAL 51 HG23 VAL 51 20.450 -20.489 32.978 401 H GLY 52 H GLY 52 18.675 -19.517 28.289 402 HA2 GLY 52 HA3 GLY 52 21.269 -18.289 27.855 403 HA3 GLY 52 HA2 GLY 52 20.572 -19.086 26.453 404 HA PRO 53 HA PRO 53 18.766 -14.757 26.728 405 HB2 PRO 53 HB3 PRO 53 20.415 -13.923 24.532 406 HB3 PRO 53 HB2 PRO 53 20.388 -13.280 26.172 407 HG2 PRO 53 HG3 PRO 53 22.479 -14.704 25.028 408 HG3 PRO 53 HG2 PRO 53 22.240 -14.435 26.764 409 HD2 PRO 53 HD3 PRO 53 21.703 -16.847 25.121 410 HD3 PRO 53 HD2 PRO 53 22.150 -16.719 26.833 411 H LYS 54 H LYS 54 17.634 -16.954 25.753 412 HA LYS 54 HA LYS 54 17.597 -17.160 22.913 413 HB2 LYS 54 HB3 LYS 54 15.678 -18.749 23.360 414 HB3 LYS 54 HB2 LYS 54 17.212 -19.158 24.112 415 HG2 LYS 54 HG3 LYS 54 16.437 -18.313 26.245 416 HG3 LYS 54 HG2 LYS 54 14.919 -17.787 25.512 417 HD2 LYS 54 HD3 LYS 54 14.458 -20.154 24.917 418 HD3 LYS 54 HD2 LYS 54 15.915 -20.621 25.796 419 HE2 LYS 54 HE3 LYS 54 13.965 -20.947 27.193 420 HE3 LYS 54 HE2 LYS 54 14.965 -19.654 27.846 421 HZ1 LYS 54 HZ1 LYS 54 12.517 -19.249 26.198 422 HZ2 LYS 54 HZ2 LYS 54 13.458 -18.036 26.910 423 HZ3 LYS 54 HZ3 LYS 54 12.596 -19.111 27.890 424 H VAL 55 H VAL 55 17.010 -15.129 22.143 425 HA VAL 55 HA VAL 55 14.174 -14.864 21.779 426 HB VAL 55 HB VAL 55 14.395 -13.621 23.870 427 HG11 VAL 55 HG11 VAL 55 16.745 -13.015 23.753 428 HG12 VAL 55 HG12 VAL 55 15.750 -11.583 24.015 429 HG13 VAL 55 HG13 VAL 55 16.412 -11.915 22.417 430 HG21 VAL 55 HG21 VAL 55 12.766 -12.817 22.263 431 HG22 VAL 55 HG22 VAL 55 13.990 -11.811 21.492 432 HG23 VAL 55 HG23 VAL 55 13.473 -11.462 23.141 433 H ARG 56 H ARG 56 13.761 -14.147 19.799 434 HA ARG 56 HA ARG 56 15.714 -12.428 18.446 435 HB2 ARG 56 HB3 ARG 56 14.519 -14.965 17.327 436 HB3 ARG 56 HB2 ARG 56 15.284 -13.737 16.332 437 HG2 ARG 56 HG3 ARG 56 16.622 -15.296 18.529 438 HG3 ARG 56 HG2 ARG 56 16.778 -15.602 16.796 439 HD2 ARG 56 HD3 ARG 56 17.682 -13.324 16.516 440 HD3 ARG 56 HD2 ARG 56 17.608 -13.106 18.265 441 HE ARG 56 HE ARG 56 19.349 -15.030 16.868 442 HH11 ARG 56 HH11 ARG 56 18.512 -13.168 19.707 443 HH12 ARG 56 HH12 ARG 56 20.076 -13.336 20.447 444 HH21 ARG 56 HH21 ARG 56 21.417 -15.266 17.836 445 HH22 ARG 56 HH22 ARG 56 21.729 -14.523 19.380 446 H LYS 57 H LYS 57 14.736 -10.708 17.616 447 HA LYS 57 HA LYS 57 11.942 -10.990 16.735 448 HB2 LYS 57 HB3 LYS 57 12.198 -9.634 18.843 449 HB3 LYS 57 HB2 LYS 57 13.162 -8.488 17.922 450 HG2 LYS 57 HG3 LYS 57 11.300 -7.940 16.529 451 HG3 LYS 57 HG2 LYS 57 10.323 -9.223 17.246 452 HD2 LYS 57 HD3 LYS 57 11.377 -6.781 18.676 453 HD3 LYS 57 HD2 LYS 57 9.711 -7.044 18.157 454 HE2 LYS 57 HE3 LYS 57 9.636 -9.057 19.617 455 HE3 LYS 57 HE2 LYS 57 11.243 -8.639 20.208 456 HZ1 LYS 57 HZ1 LYS 57 8.800 -6.975 20.473 457 HZ2 LYS 57 HZ2 LYS 57 10.347 -6.533 21.011 458 HZ3 LYS 57 HZ3 LYS 57 9.545 -7.851 21.718 459 H CYS 58 H CYS 58 11.483 -10.140 14.735 460 HA CYS 58 HA CYS 58 13.795 -9.678 13.077 461 HB2 CYS 58 HB3 CYS 58 11.993 -11.118 12.273 462 HB3 CYS 58 HB2 CYS 58 10.859 -9.774 12.363 463 H LEU 59 H LEU 59 14.270 -7.867 11.889 464 HA LEU 59 HA LEU 59 13.125 -5.380 12.938 465 HB2 LEU 59 HB3 LEU 59 15.727 -5.967 11.531 466 HB3 LEU 59 HB2 LEU 59 15.180 -4.347 11.920 467 HG LEU 59 HG LEU 59 15.731 -6.513 13.950 468 HD11 LEU 59 HD11 LEU 59 17.354 -4.089 13.184 469 HD12 LEU 59 HD12 LEU 59 17.779 -5.768 12.854 470 HD13 LEU 59 HD13 LEU 59 17.707 -5.187 14.517 471 HD21 LEU 59 HD21 LEU 59 14.027 -4.905 14.653 472 HD22 LEU 59 HD22 LEU 59 15.130 -3.579 14.287 473 HD23 LEU 59 HD23 LEU 59 15.517 -4.714 15.580 474 H ALA 60 H ALA 60 13.531 -3.532 11.142 475 HA ALA 60 HA ALA 60 11.616 -4.118 9.096 476 HB1 ALA 60 HB1 ALA 60 11.901 -1.795 8.437 477 HB2 ALA 60 HB2 ALA 60 13.326 -1.659 9.469 478 HB3 ALA 60 HB3 ALA 60 11.737 -1.918 10.190 479 H ASN 61 H ASN 61 15.016 -4.202 9.368 480 HA ASN 61 HA ASN 61 15.356 -4.500 6.471 481 HB2 ASN 61 HB3 ASN 61 17.781 -4.372 6.936 482 HB3 ASN 61 HB2 ASN 61 16.928 -2.957 7.540 483 HD21 ASN 61 HD21 ASN 61 18.828 -5.703 8.348 484 HD22 ASN 61 HD22 ASN 61 18.993 -5.364 10.037 485 H GLY 62 H GLY 62 17.023 -6.303 5.915 486 HA2 GLY 62 HA3 GLY 62 15.749 -8.728 6.787 487 HA3 GLY 62 HA2 GLY 62 17.028 -8.591 5.590 488 H SER 63 H SER 63 16.659 -8.033 9.088 489 HA SER 63 HA SER 63 18.598 -10.070 9.719 490 HB2 SER 63 HB3 SER 63 19.237 -7.174 10.354 491 HB3 SER 63 HB2 SER 63 20.149 -8.572 10.922 492 HG SER 63 HG SER 63 19.878 -8.694 8.255 493 H TRP 64 H TRP 64 18.412 -10.746 11.841 494 HA TRP 64 HA TRP 64 16.083 -9.810 13.259 495 HB2 TRP 64 HB3 TRP 64 18.095 -11.981 13.914 496 HB3 TRP 64 HB2 TRP 64 16.668 -11.630 14.883 497 HD1 TRP 64 HD1 TRP 64 17.631 -12.961 11.387 498 HE1 TRP 64 HE1 TRP 64 15.690 -14.403 10.504 499 HE3 TRP 64 HE3 TRP 64 14.227 -12.117 15.112 500 HZ2 TRP 64 HZ2 TRP 64 13.071 -15.086 11.281 501 HZ3 TRP 64 HZ3 TRP 64 12.026 -13.208 14.963 502 HH2 TRP 64 HH2 TRP 64 11.464 -14.661 13.085 503 H THR 65 H THR 65 16.247 -9.319 15.626 504 HA THR 65 HA THR 65 17.642 -6.975 15.973 505 HB THR 65 HB THR 65 17.190 -7.395 18.481 506 HG1 THR 65 HG1 THR 65 15.753 -9.089 18.887 507 HG21 THR 65 HG21 THR 65 14.823 -6.885 18.172 508 HG22 THR 65 HG22 THR 65 14.919 -7.415 16.494 509 HG23 THR 65 HG23 THR 65 15.809 -5.987 17.018 510 H ASP 66 H ASP 66 18.643 -10.213 17.009 511 HA ASP 66 HA ASP 66 21.326 -9.105 17.475 512 HB2 ASP 66 HB3 ASP 66 20.146 -9.571 19.673 513 HB3 ASP 66 HB2 ASP 66 20.090 -11.262 19.201 514 H MET 67 H MET 67 22.969 -10.324 16.598 515 HA MET 67 HA MET 67 22.459 -13.175 16.271 516 HB2 MET 67 HB3 MET 67 23.290 -11.336 14.043 517 HB3 MET 67 HB2 MET 67 23.731 -13.034 14.024 518 HG2 MET 67 HG3 MET 67 21.362 -13.643 14.110 519 HG3 MET 67 HG2 MET 67 20.933 -11.933 14.096 520 HE1 MET 67 HE1 MET 67 20.012 -14.325 12.008 521 HE2 MET 67 HE2 MET 67 19.966 -13.377 10.521 522 HE3 MET 67 HE3 MET 67 19.336 -12.695 12.020 523 H ASP 68 H ASP 68 23.867 -12.878 18.250 524 HA ASP 68 HA ASP 68 26.046 -14.435 17.337 525 HB2 ASP 68 HB3 ASP 68 27.120 -12.138 17.307 526 HB3 ASP 68 HB2 ASP 68 26.885 -12.093 19.055 527 H THR 69 H THR 69 25.008 -16.042 18.495 528 HA THR 69 HA THR 69 25.214 -15.891 21.376 529 HB THR 69 HB THR 69 22.462 -16.393 20.300 530 HG1 THR 69 HG1 THR 69 23.726 -13.895 20.748 531 HG21 THR 69 HG21 THR 69 22.900 -16.996 22.621 532 HG22 THR 69 HG22 THR 69 21.794 -15.623 22.531 533 HG23 THR 69 HG23 THR 69 23.488 -15.362 22.941 534 HA PRO 70 HA PRO 70 25.532 -20.254 20.027 535 HB2 PRO 70 HB3 PRO 70 27.629 -20.400 22.033 536 HB3 PRO 70 HB2 PRO 70 27.741 -20.695 20.296 537 HG2 PRO 70 HG3 PRO 70 28.897 -18.556 21.534 538 HG3 PRO 70 HG2 PRO 70 28.377 -18.546 19.839 539 HD2 PRO 70 HD3 PRO 70 27.019 -17.399 22.245 540 HD3 PRO 70 HD2 PRO 70 27.147 -16.743 20.599 541 H SER 71 H SER 71 23.518 -20.586 21.043 542 HA SER 71 HA SER 71 23.148 -20.336 23.841 543 HB2 SER 71 HB3 SER 71 21.319 -20.140 22.163 544 HB3 SER 71 HB2 SER 71 21.447 -21.871 21.859 545 HG SER 71 HG SER 71 20.343 -22.232 23.604 546 H ARG 72 H ARG 72 23.919 -21.613 25.330 547 HA ARG 72 HA ARG 72 24.909 -24.250 24.751 548 HB2 ARG 72 HB3 ARG 72 25.433 -24.253 27.219 549 HB3 ARG 72 HB2 ARG 72 26.174 -22.943 26.309 550 HG2 ARG 72 HG3 ARG 72 24.559 -21.375 27.128 551 HG3 ARG 72 HG2 ARG 72 23.624 -22.663 27.887 552 HD2 ARG 72 HD3 ARG 72 24.932 -21.458 29.539 553 HD3 ARG 72 HD2 ARG 72 25.487 -23.122 29.399 554 HE ARG 72 HE ARG 72 27.381 -22.261 28.103 555 HH11 ARG 72 HH11 ARG 72 25.507 -19.901 29.890 556 HH12 ARG 72 HH12 ARG 72 26.876 -18.874 30.205 557 HH21 ARG 72 HH21 ARG 72 29.184 -20.871 28.507 558 HH22 ARG 72 HH22 ARG 72 28.932 -19.409 29.418 559 H CYS 73 H CYS 73 23.861 -26.148 25.054 560 HA CYS 73 HA CYS 73 21.125 -26.061 25.976 561 HB2 CYS 73 HB3 CYS 73 22.837 -28.399 25.102 562 HB3 CYS 73 HB2 CYS 73 21.117 -28.488 25.461 563 H VAL 74 H VAL 74 21.047 -25.641 28.082 564 HA VAL 74 HA VAL 74 22.018 -27.718 29.906 565 HB VAL 74 HB VAL 74 22.187 -24.745 30.492 566 HG11 VAL 74 HG11 VAL 74 21.644 -26.043 32.468 567 HG12 VAL 74 HG12 VAL 74 23.303 -25.450 32.567 568 HG13 VAL 74 HG13 VAL 74 22.992 -27.134 32.145 569 HG21 VAL 74 HG21 VAL 74 23.954 -25.414 28.952 570 HG22 VAL 74 HG22 VAL 74 24.403 -26.740 30.022 571 HG23 VAL 74 HG23 VAL 74 24.623 -25.071 30.548 572 H ARG 75 H ARG 75 20.307 -28.521 30.908 573 HA ARG 75 HA ARG 75 17.771 -27.185 30.714 574 HB2 ARG 75 HB3 ARG 75 17.045 -29.283 32.089 575 HB3 ARG 75 HB2 ARG 75 17.482 -29.442 30.398 576 HG2 ARG 75 HG3 ARG 75 18.714 -31.158 31.151 577 HG3 ARG 75 HG2 ARG 75 19.878 -29.894 31.539 578 HD2 ARG 75 HD3 ARG 75 17.798 -30.850 33.491 579 HD3 ARG 75 HD2 ARG 75 19.387 -31.597 33.354 580 HE ARG 75 HE ARG 75 19.403 -28.726 33.774 581 HH11 ARG 75 HH11 ARG 75 19.516 -31.909 35.251 582 HH12 ARG 75 HH12 ARG 75 20.179 -31.321 36.750 583 HH21 ARG 75 HH21 ARG 75 20.290 -27.967 35.724 584 HH22 ARG 75 HH22 ARG 75 20.620 -29.081 37.014 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 3.862 -0.402 -1.992 2 H2 GLY 1 HT2 GLY 1 4.206 1.086 -2.724 3 H3 GLY 1 HT3 GLY 1 5.423 0.249 -1.892 4 HA2 GLY 1 HA2 GLY 1 4.088 -0.667 -4.381 5 HA3 GLY 1 HA3 GLY 1 5.710 0.007 -4.275 6 HA PRO 2 HA PRO 2 6.389 -4.523 -3.939 7 HB2 PRO 2 HB3 PRO 2 9.001 -3.840 -5.082 8 HB3 PRO 2 HB2 PRO 2 7.778 -4.958 -5.689 9 HG2 PRO 2 HG3 PRO 2 8.320 -2.620 -6.915 10 HG3 PRO 2 HG2 PRO 2 6.692 -3.322 -6.895 11 HD2 PRO 2 HD3 PRO 2 7.824 -1.114 -5.215 12 HD3 PRO 2 HD2 PRO 2 6.228 -1.234 -5.988 13 H THR 3 H THR 3 6.528 -4.387 -1.681 14 HA THR 3 HA THR 3 9.228 -4.277 -0.628 15 HB THR 3 HB THR 3 7.054 -2.531 0.556 16 HG1 THR 3 HG1 THR 3 8.946 -2.058 -1.406 17 HG21 THR 3 HG21 THR 3 8.696 -3.372 2.185 18 HG22 THR 3 HG22 THR 3 8.846 -1.631 1.949 19 HG23 THR 3 HG23 THR 3 10.002 -2.724 1.189 20 H SER 4 H SER 4 9.480 -5.641 1.093 21 HA SER 4 HA SER 4 7.110 -6.594 2.500 22 HB2 SER 4 HB3 SER 4 9.131 -8.472 1.232 23 HB3 SER 4 HB2 SER 4 7.759 -8.952 2.231 24 HG SER 4 HG SER 4 6.725 -7.458 0.379 25 H GLU 5 H GLU 5 7.691 -5.749 4.423 26 HA GLU 5 HA GLU 5 10.399 -5.757 5.374 27 HB2 GLU 5 HB3 GLU 5 7.807 -5.129 6.798 28 HB3 GLU 5 HB2 GLU 5 9.414 -4.818 7.439 29 HG2 GLU 5 HG3 GLU 5 9.838 -3.135 5.880 30 HG3 GLU 5 HG2 GLU 5 8.519 -3.653 4.830 31 H GLY 6 H GLY 6 11.209 -7.757 5.699 32 HA2 GLY 6 HA3 GLY 6 10.187 -9.237 7.958 33 HA3 GLY 6 HA2 GLY 6 10.021 -10.071 6.420 34 H CYS 7 H CYS 7 11.569 -10.797 8.736 35 HA CYS 7 HA CYS 7 14.341 -10.474 7.957 36 HB2 CYS 7 HB3 CYS 7 13.114 -12.179 10.138 37 HB3 CYS 7 HB2 CYS 7 14.821 -11.785 9.961 38 H GLN 8 H GLN 8 15.723 -12.367 7.607 39 HA GLN 8 HA GLN 8 14.407 -14.269 5.850 40 HB2 GLN 8 HB3 GLN 8 16.646 -14.903 5.149 41 HB3 GLN 8 HB2 GLN 8 16.456 -13.159 5.076 42 HG2 GLN 8 HG3 GLN 8 17.828 -12.801 6.907 43 HG3 GLN 8 HG2 GLN 8 17.664 -14.460 7.478 44 HE21 GLN 8 HE21 GLN 8 18.137 -15.720 4.956 45 HE22 GLN 8 HE22 GLN 8 19.809 -15.504 4.583 46 H ILE 9 H ILE 9 15.794 -16.494 5.921 47 HA ILE 9 HA ILE 9 14.947 -17.701 8.425 48 HB ILE 9 HB ILE 9 16.036 -18.952 5.891 49 HG12 ILE 9 HG13 ILE 9 13.202 -18.742 6.922 50 HG13 ILE 9 HG12 ILE 9 13.870 -17.881 5.539 51 HG21 ILE 9 HG21 ILE 9 15.219 -21.072 6.777 52 HG22 ILE 9 HG22 ILE 9 14.747 -20.266 8.275 53 HG23 ILE 9 HG23 ILE 9 16.450 -20.363 7.825 54 HD11 ILE 9 HD11 ILE 9 13.529 -20.862 5.769 55 HD12 ILE 9 HD12 ILE 9 14.229 -20.013 4.392 56 HD13 ILE 9 HD13 ILE 9 12.534 -19.764 4.812 57 H ILE 10 H ILE 10 16.285 -18.596 9.921 58 HA ILE 10 HA ILE 10 19.161 -18.160 9.563 59 HB ILE 10 HB ILE 10 17.631 -18.806 12.095 60 HG12 ILE 10 HG13 ILE 10 18.804 -16.172 11.170 61 HG13 ILE 10 HG12 ILE 10 17.090 -16.572 11.170 62 HG21 ILE 10 HG21 ILE 10 20.507 -17.995 11.671 63 HG22 ILE 10 HG22 ILE 10 19.927 -19.574 12.204 64 HG23 ILE 10 HG23 ILE 10 19.716 -18.162 13.240 65 HD11 ILE 10 HD11 ILE 10 17.632 -15.201 13.077 66 HD12 ILE 10 HD12 ILE 10 18.871 -16.349 13.584 67 HD13 ILE 10 HD13 ILE 10 17.171 -16.817 13.612 68 H HIS 11 H HIS 11 20.529 -19.793 9.379 69 HA HIS 11 HA HIS 11 19.509 -22.447 9.025 70 HB2 HIS 11 HB3 HIS 11 21.524 -21.169 7.864 71 HB3 HIS 11 HB2 HIS 11 22.439 -21.867 9.197 72 HD1 HIS 11 HD1 HIS 11 23.140 -24.272 8.957 73 HD2 HIS 11 HD2 HIS 11 20.266 -23.125 6.173 74 HE1 HIS 11 HE1 HIS 11 22.946 -26.197 7.349 75 HE2 HIS 11 HE2 HIS 11 21.289 -25.446 5.610 76 HA PRO 12 HA PRO 12 19.907 -23.656 13.317 77 HB2 PRO 12 HB3 PRO 12 19.896 -26.384 12.811 78 HB3 PRO 12 HB2 PRO 12 18.456 -25.383 13.023 79 HG2 PRO 12 HG3 PRO 12 19.754 -26.337 10.511 80 HG3 PRO 12 HG2 PRO 12 18.031 -26.155 10.891 81 HD2 PRO 12 HD3 PRO 12 19.346 -24.380 9.350 82 HD3 PRO 12 HD2 PRO 12 18.047 -23.884 10.454 83 HA PRO 13 HA PRO 13 24.348 -24.165 12.959 84 HB2 PRO 13 HB3 PRO 13 24.967 -23.322 15.446 85 HB3 PRO 13 HB2 PRO 13 24.524 -22.214 14.144 86 HG2 PRO 13 HG3 PRO 13 22.867 -23.233 16.411 87 HG3 PRO 13 HG2 PRO 13 22.933 -21.606 15.711 88 HD2 PRO 13 HD3 PRO 13 20.970 -23.441 15.143 89 HD3 PRO 13 HD2 PRO 13 21.456 -22.135 14.044 90 H TRP 14 H TRP 14 23.845 -24.713 16.372 91 HA TRP 14 HA TRP 14 24.888 -27.429 16.041 92 HB2 TRP 14 HB3 TRP 14 26.001 -25.609 17.534 93 HB3 TRP 14 HB2 TRP 14 24.706 -25.973 18.669 94 HD1 TRP 14 HD1 TRP 14 25.148 -27.922 20.291 95 HE1 TRP 14 HE1 TRP 14 26.879 -29.825 20.447 96 HE3 TRP 14 HE3 TRP 14 27.530 -27.217 15.815 97 HZ2 TRP 14 HZ2 TRP 14 28.976 -30.881 18.873 98 HZ3 TRP 14 HZ3 TRP 14 29.387 -28.717 15.217 99 HH2 TRP 14 HH2 TRP 14 30.091 -30.509 16.718 100 H GLU 15 H GLU 15 24.114 -28.784 18.133 101 HA GLU 15 HA GLU 15 21.648 -29.804 17.812 102 HB2 GLU 15 HB3 GLU 15 22.951 -29.369 20.502 103 HB3 GLU 15 HB2 GLU 15 21.725 -30.570 20.129 104 HG2 GLU 15 HG3 GLU 15 24.494 -30.479 18.957 105 HG3 GLU 15 HG2 GLU 15 23.964 -31.530 20.269 106 H GLY 16 H GLY 16 19.884 -28.519 17.451 107 HA2 GLY 16 HA3 GLY 16 18.371 -27.654 19.605 108 HA3 GLY 16 HA2 GLY 16 19.248 -26.246 19.026 109 H GLY 17 H GLY 17 16.983 -25.534 18.735 110 HA2 GLY 17 HA3 GLY 17 16.294 -25.788 15.938 111 HA3 GLY 17 HA2 GLY 17 15.076 -26.423 17.042 112 H ILE 18 H ILE 18 13.822 -24.622 15.920 113 HA ILE 18 HA ILE 18 14.169 -22.176 17.489 114 HB ILE 18 HB ILE 18 14.057 -22.334 14.500 115 HG12 ILE 18 HG13 ILE 18 15.708 -20.826 16.524 116 HG13 ILE 18 HG12 ILE 18 16.232 -22.201 15.556 117 HG21 ILE 18 HG21 ILE 18 13.273 -19.945 16.169 118 HG22 ILE 18 HG22 ILE 18 12.230 -20.846 15.066 119 HG23 ILE 18 HG23 ILE 18 13.586 -19.911 14.434 120 HD11 ILE 18 HD11 ILE 18 16.037 -20.863 13.526 121 HD12 ILE 18 HD12 ILE 18 17.138 -20.124 14.689 122 HD13 ILE 18 HD13 ILE 18 15.508 -19.481 14.487 123 H ARG 19 H ARG 19 12.396 -21.276 18.220 124 HA ARG 19 HA ARG 19 9.842 -22.562 17.591 125 HB2 ARG 19 HB3 ARG 19 10.729 -22.322 19.956 126 HB3 ARG 19 HB2 ARG 19 10.439 -20.597 19.797 127 HG2 ARG 19 HG3 ARG 19 8.059 -21.097 19.273 128 HG3 ARG 19 HG2 ARG 19 8.383 -22.784 19.658 129 HD2 ARG 19 HD3 ARG 19 8.689 -20.446 21.536 130 HD3 ARG 19 HD2 ARG 19 7.371 -21.614 21.546 131 HE ARG 19 HE ARG 19 10.011 -21.949 22.638 132 HH11 ARG 19 HH11 ARG 19 7.220 -23.651 21.328 133 HH12 ARG 19 HH12 ARG 19 7.571 -25.123 22.190 134 HH21 ARG 19 HH21 ARG 19 10.438 -23.860 23.763 135 HH22 ARG 19 HH22 ARG 19 9.395 -25.236 23.577 136 H TYR 20 H TYR 20 8.149 -21.454 16.722 137 HA TYR 20 HA TYR 20 8.620 -18.629 16.034 138 HB2 TYR 20 HB3 TYR 20 7.000 -20.758 14.633 139 HB3 TYR 20 HB2 TYR 20 6.896 -19.048 14.227 140 HD1 TYR 20 HD1 TYR 20 8.978 -22.059 14.060 141 HD2 TYR 20 HD2 TYR 20 8.739 -17.914 13.134 142 HE1 TYR 20 HE1 TYR 20 10.910 -22.290 12.556 143 HE2 TYR 20 HE2 TYR 20 10.664 -18.137 11.622 144 HH TYR 20 HH TYR 20 12.599 -19.634 11.315 145 H ARG 21 H ARG 21 6.041 -17.868 15.382 146 HA ARG 21 HA ARG 21 4.908 -17.313 17.898 147 HB2 ARG 21 HB3 ARG 21 3.883 -17.040 15.084 148 HB3 ARG 21 HB2 ARG 21 2.857 -16.661 16.459 149 HG2 ARG 21 HG3 ARG 21 5.514 -15.368 15.877 150 HG3 ARG 21 HG2 ARG 21 3.935 -14.681 15.486 151 HD2 ARG 21 HD3 ARG 21 3.400 -14.923 17.962 152 HD3 ARG 21 HD2 ARG 21 5.123 -15.216 18.197 153 HE ARG 21 HE ARG 21 4.325 -12.769 16.791 154 HH11 ARG 21 HH11 ARG 21 5.592 -14.288 19.688 155 HH12 ARG 21 HH12 ARG 21 6.090 -12.786 20.411 156 HH21 ARG 21 HH21 ARG 21 4.943 -10.788 17.771 157 HH22 ARG 21 HH22 ARG 21 5.722 -10.820 19.329 158 H GLY 22 H GLY 22 3.638 -19.370 15.276 159 HA2 GLY 22 HA3 GLY 22 2.828 -21.384 17.179 160 HA3 GLY 22 HA2 GLY 22 1.483 -20.507 16.462 161 H LEU 23 H LEU 23 4.467 -22.197 15.501 162 HA LEU 23 HA LEU 23 2.993 -23.201 13.156 163 HB2 LEU 23 HB3 LEU 23 5.928 -22.559 13.419 164 HB3 LEU 23 HB2 LEU 23 5.231 -23.406 12.052 165 HG LEU 23 HG LEU 23 4.570 -20.578 12.883 166 HD11 LEU 23 HD11 LEU 23 5.721 -19.968 10.791 167 HD12 LEU 23 HD12 LEU 23 6.214 -21.651 10.598 168 HD13 LEU 23 HD13 LEU 23 6.798 -20.713 11.973 169 HD21 LEU 23 HD21 LEU 23 3.337 -20.468 10.777 170 HD22 LEU 23 HD22 LEU 23 2.666 -21.704 11.844 171 HD23 LEU 23 HD23 LEU 23 3.682 -22.170 10.478 172 H THR 24 H THR 24 2.697 -25.285 13.069 173 HA THR 24 HA THR 24 4.036 -27.082 14.888 174 HB THR 24 HB THR 24 1.614 -27.302 14.446 175 HG1 THR 24 HG1 THR 24 2.073 -29.284 15.000 176 HG21 THR 24 HG21 THR 24 2.465 -28.127 11.669 177 HG22 THR 24 HG22 THR 24 1.596 -26.651 12.088 178 HG23 THR 24 HG23 THR 24 0.830 -28.222 12.319 179 H ARG 25 H ARG 25 4.371 -29.379 13.619 180 HA ARG 25 HA ARG 25 6.880 -29.119 12.372 181 HB2 ARG 25 HB3 ARG 25 6.787 -31.504 12.105 182 HB3 ARG 25 HB2 ARG 25 6.035 -31.107 13.646 183 HG2 ARG 25 HG3 ARG 25 3.844 -31.398 12.735 184 HG3 ARG 25 HG2 ARG 25 4.491 -31.572 11.105 185 HD2 ARG 25 HD3 ARG 25 5.741 -33.601 11.999 186 HD3 ARG 25 HD2 ARG 25 4.696 -33.481 13.415 187 HE ARG 25 HE ARG 25 3.171 -33.454 11.015 188 HH11 ARG 25 HH11 ARG 25 4.882 -35.585 13.205 189 HH12 ARG 25 HH12 ARG 25 4.006 -37.004 12.703 190 HH21 ARG 25 HH21 ARG 25 2.017 -35.296 10.367 191 HH22 ARG 25 HH22 ARG 25 2.365 -36.842 11.084 192 H ASP 26 H ASP 26 7.094 -30.726 10.286 193 HA ASP 26 HA ASP 26 6.995 -30.914 8.043 194 HB2 ASP 26 HB3 ASP 26 4.719 -31.693 8.310 195 HB3 ASP 26 HB2 ASP 26 4.126 -30.037 8.389 196 H GLN 27 H GLN 27 5.443 -27.940 9.128 197 HA GLN 27 HA GLN 27 5.990 -26.439 6.793 198 HB2 GLN 27 HB3 GLN 27 5.381 -25.566 9.618 199 HB3 GLN 27 HB2 GLN 27 5.367 -24.503 8.217 200 HG2 GLN 27 HG3 GLN 27 3.524 -25.654 7.259 201 HG3 GLN 27 HG2 GLN 27 3.636 -26.948 8.449 202 HE21 GLN 27 HE21 GLN 27 4.058 -25.182 10.699 203 HE22 GLN 27 HE22 GLN 27 2.545 -24.400 11.000 204 H VAL 28 H VAL 28 7.087 -24.098 7.591 205 HA VAL 28 HA VAL 28 9.041 -22.995 7.609 206 HB VAL 28 HB VAL 28 10.448 -23.128 9.474 207 HG11 VAL 28 HG11 VAL 28 8.915 -23.301 11.377 208 HG12 VAL 28 HG12 VAL 28 7.726 -24.075 10.331 209 HG13 VAL 28 HG13 VAL 28 8.220 -22.410 10.023 210 HG21 VAL 28 HG21 VAL 28 9.523 -25.956 9.963 211 HG22 VAL 28 HG22 VAL 28 10.575 -25.025 11.029 212 HG23 VAL 28 HG23 VAL 28 11.121 -25.455 9.407 213 H LYS 29 H LYS 29 8.799 -25.671 6.126 214 HA LYS 29 HA LYS 29 11.553 -26.397 5.705 215 HB2 LYS 29 HB3 LYS 29 10.587 -27.795 3.840 216 HB3 LYS 29 HB2 LYS 29 9.960 -28.151 5.443 217 HG2 LYS 29 HG3 LYS 29 7.996 -26.691 4.895 218 HG3 LYS 29 HG2 LYS 29 8.603 -26.624 3.241 219 HD2 LYS 29 HD3 LYS 29 8.314 -28.955 2.939 220 HD3 LYS 29 HD2 LYS 29 8.057 -29.218 4.665 221 HE2 LYS 29 HE3 LYS 29 5.992 -27.835 4.496 222 HE3 LYS 29 HE2 LYS 29 6.225 -27.775 2.751 223 HZ1 LYS 29 HZ1 LYS 29 4.664 -29.490 3.364 224 HZ2 LYS 29 HZ2 LYS 29 5.805 -30.231 4.371 225 HZ3 LYS 29 HZ3 LYS 29 6.052 -30.191 2.692 226 H ALA 30 H ALA 30 9.468 -23.986 4.629 227 HA ALA 30 HA ALA 30 11.497 -22.860 2.946 228 HB1 ALA 30 HB1 ALA 30 8.870 -23.653 1.692 229 HB2 ALA 30 HB2 ALA 30 10.445 -24.371 1.349 230 HB3 ALA 30 HB3 ALA 30 10.133 -22.687 0.929 231 H ILE 31 H ILE 31 11.500 -20.817 3.552 232 HA ILE 31 HA ILE 31 8.967 -19.362 3.806 233 HB ILE 31 HB ILE 31 11.207 -19.063 5.828 234 HG12 ILE 31 HG13 ILE 31 8.531 -20.427 6.207 235 HG13 ILE 31 HG12 ILE 31 10.076 -21.258 6.060 236 HG21 ILE 31 HG21 ILE 31 9.890 -17.051 5.485 237 HG22 ILE 31 HG22 ILE 31 9.557 -17.743 7.074 238 HG23 ILE 31 HG23 ILE 31 8.401 -17.958 5.758 239 HD11 ILE 31 HD11 ILE 31 9.383 -21.110 8.373 240 HD12 ILE 31 HD12 ILE 31 9.287 -19.353 8.251 241 HD13 ILE 31 HD13 ILE 31 10.846 -20.163 8.105 242 H ASN 32 H ASN 32 9.211 -17.077 3.416 243 HA ASN 32 HA ASN 32 11.684 -16.447 1.961 244 HB2 ASN 32 HB3 ASN 32 8.907 -15.266 1.768 245 HB3 ASN 32 HB2 ASN 32 10.309 -14.606 0.931 246 HD21 ASN 32 HD21 ASN 32 7.792 -15.837 -0.034 247 HD22 ASN 32 HD22 ASN 32 8.298 -17.101 -1.107 248 H PHE 33 H PHE 33 9.242 -14.634 3.838 249 HA PHE 33 HA PHE 33 11.417 -13.380 5.350 250 HB2 PHE 33 HB3 PHE 33 9.256 -11.835 3.896 251 HB3 PHE 33 HB2 PHE 33 10.371 -11.140 5.064 252 HD1 PHE 33 HD1 PHE 33 9.847 -12.043 1.639 253 HD2 PHE 33 HD2 PHE 33 12.838 -11.173 4.540 254 HE1 PHE 33 HE1 PHE 33 11.464 -11.598 -0.165 255 HE2 PHE 33 HE2 PHE 33 14.458 -10.723 2.745 256 HZ PHE 33 HZ PHE 33 13.770 -10.937 0.386 257 H LEU 34 H LEU 34 10.971 -13.330 7.444 258 HA LEU 34 HA LEU 34 8.265 -13.880 8.375 259 HB2 LEU 34 HB3 LEU 34 10.887 -13.551 9.848 260 HB3 LEU 34 HB2 LEU 34 9.356 -13.809 10.655 261 HG LEU 34 HG LEU 34 10.456 -15.893 10.626 262 HD11 LEU 34 HD11 LEU 34 8.434 -15.868 8.399 263 HD12 LEU 34 HD12 LEU 34 8.100 -16.042 10.124 264 HD13 LEU 34 HD13 LEU 34 8.989 -17.300 9.265 265 HD21 LEU 34 HD21 LEU 34 10.900 -15.518 7.667 266 HD22 LEU 34 HD22 LEU 34 11.314 -16.960 8.597 267 HD23 LEU 34 HD23 LEU 34 12.132 -15.432 8.927 268 HA PRO 35 HA PRO 35 7.405 -9.503 8.457 269 HB2 PRO 35 HB3 PRO 35 5.211 -9.697 10.134 270 HB3 PRO 35 HB2 PRO 35 5.171 -9.887 8.380 271 HG2 PRO 35 HG3 PRO 35 5.267 -11.981 10.509 272 HG3 PRO 35 HG2 PRO 35 4.353 -11.966 8.991 273 HD2 PRO 35 HD3 PRO 35 6.590 -13.407 9.247 274 HD3 PRO 35 HD2 PRO 35 6.209 -12.569 7.725 275 H VAL 36 H VAL 36 7.585 -7.761 9.833 276 HA VAL 36 HA VAL 36 9.180 -8.053 12.122 277 HB VAL 36 HB VAL 36 9.320 -6.011 10.896 278 HG11 VAL 36 HG11 VAL 36 6.422 -5.546 11.568 279 HG12 VAL 36 HG12 VAL 36 7.089 -5.896 9.972 280 HG13 VAL 36 HG13 VAL 36 7.488 -4.380 10.783 281 HG21 VAL 36 HG21 VAL 36 9.794 -5.777 13.249 282 HG22 VAL 36 HG22 VAL 36 8.085 -5.511 13.598 283 HG23 VAL 36 HG23 VAL 36 8.990 -4.321 12.664 284 H ASP 37 H ASP 37 8.380 -9.308 13.637 285 HA ASP 37 HA ASP 37 6.740 -8.430 15.669 286 HB2 ASP 37 HB3 ASP 37 4.756 -8.550 14.385 287 HB3 ASP 37 HB2 ASP 37 5.271 -10.024 13.569 288 H TYR 38 H TYR 38 7.619 -11.198 13.712 289 HA TYR 38 HA TYR 38 7.314 -13.250 15.494 290 HB2 TYR 38 HB3 TYR 38 8.970 -12.806 13.098 291 HB3 TYR 38 HB2 TYR 38 9.516 -14.096 14.165 292 HD1 TYR 38 HD1 TYR 38 8.098 -16.039 14.593 293 HD2 TYR 38 HD2 TYR 38 6.933 -13.033 11.816 294 HE1 TYR 38 HE1 TYR 38 6.430 -17.571 13.652 295 HE2 TYR 38 HE2 TYR 38 5.257 -14.561 10.860 296 HH TYR 38 HH TYR 38 4.899 -17.029 10.695 297 H GLU 39 H GLU 39 8.089 -13.679 17.374 298 HA GLU 39 HA GLU 39 10.847 -12.908 18.036 299 HB2 GLU 39 HB3 GLU 39 8.583 -13.571 19.939 300 HB3 GLU 39 HB2 GLU 39 10.191 -13.014 20.382 301 HG2 GLU 39 HG3 GLU 39 9.782 -10.869 19.406 302 HG3 GLU 39 HG2 GLU 39 8.239 -11.413 18.751 303 H ILE 40 H ILE 40 12.013 -14.658 17.427 304 HA ILE 40 HA ILE 40 10.889 -17.312 17.822 305 HB ILE 40 HB ILE 40 12.858 -18.136 16.572 306 HG12 ILE 40 HG13 ILE 40 13.504 -15.200 16.227 307 HG13 ILE 40 HG12 ILE 40 14.426 -16.335 17.205 308 HG21 ILE 40 HG21 ILE 40 11.261 -15.956 15.242 309 HG22 ILE 40 HG22 ILE 40 10.813 -17.654 15.396 310 HG23 ILE 40 HG23 ILE 40 12.190 -17.195 14.397 311 HD11 ILE 40 HD11 ILE 40 15.487 -15.927 15.054 312 HD12 ILE 40 HD12 ILE 40 14.040 -16.504 14.226 313 HD13 ILE 40 HD13 ILE 40 14.990 -17.612 15.215 314 H GLU 41 H GLU 41 11.770 -18.892 19.061 315 HA GLU 41 HA GLU 41 13.728 -18.001 21.063 316 HB2 GLU 41 HB3 GLU 41 11.578 -18.544 22.039 317 HB3 GLU 41 HB2 GLU 41 11.555 -20.096 21.217 318 HG2 GLU 41 HG3 GLU 41 13.475 -20.826 22.538 319 HG3 GLU 41 HG2 GLU 41 13.495 -19.269 23.363 320 H TYR 42 H TYR 42 15.587 -19.110 21.320 321 HA TYR 42 HA TYR 42 16.191 -21.271 19.487 322 HB2 TYR 42 HB3 TYR 42 17.870 -19.859 21.567 323 HB3 TYR 42 HB2 TYR 42 18.460 -21.180 20.566 324 HD1 TYR 42 HD1 TYR 42 18.626 -20.866 18.096 325 HD2 TYR 42 HD2 TYR 42 17.748 -17.648 20.729 326 HE1 TYR 42 HE1 TYR 42 19.261 -19.264 16.340 327 HE2 TYR 42 HE2 TYR 42 18.373 -16.041 18.979 328 HH TYR 42 HH TYR 42 18.911 -16.986 15.718 329 H VAL 43 H VAL 43 15.211 -23.105 20.082 330 HA VAL 43 HA VAL 43 15.416 -23.965 22.879 331 HB VAL 43 HB VAL 43 13.750 -25.665 22.329 332 HG11 VAL 43 HG11 VAL 43 12.955 -22.906 21.415 333 HG12 VAL 43 HG12 VAL 43 12.944 -23.507 23.073 334 HG13 VAL 43 HG13 VAL 43 11.838 -24.189 21.880 335 HG21 VAL 43 HG21 VAL 43 13.802 -24.493 19.549 336 HG22 VAL 43 HG22 VAL 43 12.637 -25.681 20.134 337 HG23 VAL 43 HG23 VAL 43 14.346 -26.106 20.017 338 H CYS 44 H CYS 44 15.975 -26.257 23.267 339 HA CYS 44 HA CYS 44 18.022 -27.173 21.412 340 HB2 CYS 44 HB3 CYS 44 18.129 -27.168 24.046 341 HB3 CYS 44 HB2 CYS 44 17.230 -28.672 23.886 342 H ARG 45 H ARG 45 17.904 -29.291 20.436 343 HA ARG 45 HA ARG 45 15.412 -29.633 19.200 344 HB2 ARG 45 HB3 ARG 45 17.819 -30.306 18.427 345 HB3 ARG 45 HB2 ARG 45 17.457 -31.829 19.226 346 HG2 ARG 45 HG3 ARG 45 15.701 -30.637 17.097 347 HG3 ARG 45 HG2 ARG 45 17.028 -31.740 16.744 348 HD2 ARG 45 HD3 ARG 45 15.979 -33.479 18.054 349 HD3 ARG 45 HD2 ARG 45 14.705 -32.372 18.564 350 HE ARG 45 HE ARG 45 14.291 -32.264 15.991 351 HH11 ARG 45 HH11 ARG 45 15.187 -35.102 17.855 352 HH12 ARG 45 HH12 ARG 45 14.404 -36.211 16.768 353 HH21 ARG 45 HH21 ARG 45 13.232 -33.716 14.595 354 HH22 ARG 45 HH22 ARG 45 13.273 -35.422 14.928 355 H GLY 46 H GLY 46 13.657 -30.269 20.236 356 HA2 GLY 46 HA3 GLY 46 12.314 -32.120 20.917 357 HA3 GLY 46 HA2 GLY 46 13.745 -32.865 21.614 358 H GLU 47 H GLU 47 13.208 -33.121 23.680 359 HA GLU 47 HA GLU 47 12.049 -30.857 25.142 360 HB2 GLU 47 HB3 GLU 47 11.564 -32.544 26.915 361 HB3 GLU 47 HB2 GLU 47 10.779 -32.893 25.384 362 HG2 GLU 47 HG3 GLU 47 13.346 -34.193 26.260 363 HG3 GLU 47 HG2 GLU 47 11.752 -34.867 26.591 364 H ARG 48 H ARG 48 14.795 -30.861 24.357 365 HA ARG 48 HA ARG 48 16.312 -31.432 26.777 366 HB2 ARG 48 HB3 ARG 48 17.278 -30.172 24.203 367 HB3 ARG 48 HB2 ARG 48 18.270 -30.842 25.488 368 HG2 ARG 48 HG3 ARG 48 16.407 -32.402 23.713 369 HG3 ARG 48 HG2 ARG 48 18.163 -32.338 23.574 370 HD2 ARG 48 HD3 ARG 48 16.603 -33.406 25.925 371 HD3 ARG 48 HD2 ARG 48 17.429 -34.374 24.707 372 HE ARG 48 HE ARG 48 19.383 -32.745 25.724 373 HH11 ARG 48 HH11 ARG 48 17.127 -35.068 27.060 374 HH12 ARG 48 HH12 ARG 48 18.165 -35.528 28.378 375 HH21 ARG 48 HH21 ARG 48 20.772 -33.346 27.448 376 HH22 ARG 48 HH22 ARG 48 20.242 -34.534 28.607 377 H GLU 49 H GLU 49 17.382 -29.836 27.995 378 HA GLU 49 HA GLU 49 15.898 -27.339 28.037 379 HB2 GLU 49 HB3 GLU 49 17.805 -28.560 30.029 380 HB3 GLU 49 HB2 GLU 49 16.956 -27.037 30.263 381 HG2 GLU 49 HG3 GLU 49 14.813 -28.242 30.093 382 HG3 GLU 49 HG2 GLU 49 15.707 -29.758 29.951 383 H VAL 50 H VAL 50 16.819 -25.314 28.126 384 HA VAL 50 HA VAL 50 19.679 -25.047 27.545 385 HB VAL 50 HB VAL 50 19.136 -23.205 25.911 386 HG11 VAL 50 HG11 VAL 50 19.927 -25.370 25.152 387 HG12 VAL 50 HG12 VAL 50 18.759 -24.691 24.019 388 HG13 VAL 50 HG13 VAL 50 18.273 -25.978 25.125 389 HG21 VAL 50 HG21 VAL 50 16.934 -23.267 24.815 390 HG22 VAL 50 HG22 VAL 50 16.827 -22.811 26.515 391 HG23 VAL 50 HG23 VAL 50 16.388 -24.443 26.013 392 H VAL 51 H VAL 51 20.584 -23.103 28.299 393 HA VAL 51 HA VAL 51 18.725 -21.128 29.385 394 HB VAL 51 HB VAL 51 19.412 -22.240 31.372 395 HG11 VAL 51 HG11 VAL 51 21.321 -23.465 30.548 396 HG12 VAL 51 HG12 VAL 51 21.763 -22.561 31.997 397 HG13 VAL 51 HG13 VAL 51 22.249 -21.970 30.408 398 HG21 VAL 51 HG21 VAL 51 20.648 -20.497 32.580 399 HG22 VAL 51 HG22 VAL 51 19.375 -19.825 31.562 400 HG23 VAL 51 HG23 VAL 51 21.058 -19.736 31.043 401 H GLY 52 H GLY 52 18.986 -19.697 27.855 402 HA2 GLY 52 HA3 GLY 52 21.526 -18.318 27.608 403 HA3 GLY 52 HA2 GLY 52 20.928 -19.092 26.143 404 HA PRO 53 HA PRO 53 18.766 -14.947 26.689 405 HB2 PRO 53 HB3 PRO 53 20.075 -13.466 24.853 406 HB3 PRO 53 HB2 PRO 53 20.633 -13.594 26.524 407 HG2 PRO 53 HG3 PRO 53 21.652 -14.953 24.074 408 HG3 PRO 53 HG2 PRO 53 22.551 -14.316 25.463 409 HD2 PRO 53 HD3 PRO 53 21.914 -16.982 25.063 410 HD3 PRO 53 HD2 PRO 53 22.315 -16.257 26.635 411 H LYS 54 H LYS 54 17.687 -17.041 25.569 412 HA LYS 54 HA LYS 54 17.698 -17.045 22.705 413 HB2 LYS 54 HB3 LYS 54 15.931 -18.828 23.006 414 HB3 LYS 54 HB2 LYS 54 17.492 -19.165 23.736 415 HG2 LYS 54 HG3 LYS 54 16.632 -18.587 25.925 416 HG3 LYS 54 HG2 LYS 54 15.076 -18.140 25.221 417 HD2 LYS 54 HD3 LYS 54 14.742 -20.435 24.474 418 HD3 LYS 54 HD2 LYS 54 16.316 -20.892 25.121 419 HE2 LYS 54 HE3 LYS 54 14.579 -21.577 26.648 420 HE3 LYS 54 HE2 LYS 54 15.527 -20.284 27.378 421 HZ1 LYS 54 HZ1 LYS 54 13.085 -20.073 27.667 422 HZ2 LYS 54 HZ2 LYS 54 12.936 -19.837 25.993 423 HZ3 LYS 54 HZ3 LYS 54 13.810 -18.725 26.935 424 H VAL 55 H VAL 55 16.973 -14.953 22.227 425 HA VAL 55 HA VAL 55 14.180 -14.992 21.634 426 HB VAL 55 HB VAL 55 14.009 -14.024 23.863 427 HG11 VAL 55 HG11 VAL 55 15.048 -11.856 24.402 428 HG12 VAL 55 HG12 VAL 55 15.936 -11.923 22.881 429 HG13 VAL 55 HG13 VAL 55 16.238 -13.130 24.129 430 HG21 VAL 55 HG21 VAL 55 12.910 -11.877 23.278 431 HG22 VAL 55 HG22 VAL 55 12.441 -13.213 22.227 432 HG23 VAL 55 HG23 VAL 55 13.596 -12.007 21.657 433 H ARG 56 H ARG 56 13.961 -14.186 19.653 434 HA ARG 56 HA ARG 56 15.789 -12.036 18.813 435 HB2 ARG 56 HB3 ARG 56 14.830 -14.327 17.090 436 HB3 ARG 56 HB2 ARG 56 15.779 -12.961 16.531 437 HG2 ARG 56 HG3 ARG 56 16.683 -15.010 18.532 438 HG3 ARG 56 HG2 ARG 56 17.121 -14.972 16.825 439 HD2 ARG 56 HD3 ARG 56 18.011 -12.623 17.293 440 HD3 ARG 56 HD2 ARG 56 17.883 -13.049 19.000 441 HE ARG 56 HE ARG 56 19.367 -14.858 17.260 442 HH11 ARG 56 HH11 ARG 56 19.423 -12.438 19.795 443 HH12 ARG 56 HH12 ARG 56 21.103 -12.677 20.149 444 HH21 ARG 56 HH21 ARG 56 21.561 -15.166 17.729 445 HH22 ARG 56 HH22 ARG 56 22.313 -14.238 18.994 446 H LYS 57 H LYS 57 14.714 -10.283 18.227 447 HA LYS 57 HA LYS 57 11.877 -10.572 17.521 448 HB2 LYS 57 HB3 LYS 57 12.416 -9.135 19.472 449 HB3 LYS 57 HB2 LYS 57 13.382 -8.108 18.425 450 HG2 LYS 57 HG3 LYS 57 11.418 -7.466 17.173 451 HG3 LYS 57 HG2 LYS 57 10.423 -8.579 18.115 452 HD2 LYS 57 HD3 LYS 57 11.945 -6.230 19.239 453 HD3 LYS 57 HD2 LYS 57 10.218 -6.245 18.880 454 HE2 LYS 57 HE3 LYS 57 11.502 -8.230 20.741 455 HE3 LYS 57 HE2 LYS 57 10.895 -6.668 21.295 456 HZ1 LYS 57 HZ1 LYS 57 9.371 -8.736 21.403 457 HZ2 LYS 57 HZ2 LYS 57 9.135 -8.454 19.745 458 HZ3 LYS 57 HZ3 LYS 57 8.732 -7.258 20.874 459 H CYS 58 H CYS 58 11.342 -10.324 15.468 460 HA CYS 58 HA CYS 58 13.299 -9.561 13.527 461 HB2 CYS 58 HB3 CYS 58 11.574 -11.274 13.072 462 HB3 CYS 58 HB2 CYS 58 10.333 -10.029 13.169 463 H LEU 59 H LEU 59 13.400 -7.748 12.276 464 HA LEU 59 HA LEU 59 11.617 -5.515 12.965 465 HB2 LEU 59 HB3 LEU 59 14.619 -5.384 12.618 466 HB3 LEU 59 HB2 LEU 59 13.570 -3.992 12.806 467 HG LEU 59 HG LEU 59 13.970 -6.149 14.881 468 HD11 LEU 59 HD11 LEU 59 15.037 -3.334 14.746 469 HD12 LEU 59 HD12 LEU 59 15.978 -4.817 14.582 470 HD13 LEU 59 HD13 LEU 59 15.197 -4.432 16.117 471 HD21 LEU 59 HD21 LEU 59 11.753 -5.090 14.957 472 HD22 LEU 59 HD22 LEU 59 12.524 -3.506 15.053 473 HD23 LEU 59 HD23 LEU 59 12.735 -4.671 16.361 474 H ALA 60 H ALA 60 12.279 -3.634 11.221 475 HA ALA 60 HA ALA 60 11.448 -4.806 8.723 476 HB1 ALA 60 HB1 ALA 60 11.260 -2.517 7.928 477 HB2 ALA 60 HB2 ALA 60 12.079 -1.930 9.376 478 HB3 ALA 60 HB3 ALA 60 10.496 -2.696 9.507 479 H ASN 61 H ASN 61 13.690 -5.997 8.982 480 HA ASN 61 HA ASN 61 15.181 -5.104 6.706 481 HB2 ASN 61 HB3 ASN 61 17.397 -5.083 7.801 482 HB3 ASN 61 HB2 ASN 61 16.360 -3.799 8.408 483 HD21 ASN 61 HD21 ASN 61 18.109 -6.652 9.163 484 HD22 ASN 61 HD22 ASN 61 17.791 -6.664 10.864 485 H GLY 62 H GLY 62 16.923 -6.801 6.182 486 HA2 GLY 62 HA3 GLY 62 15.571 -9.348 6.411 487 HA3 GLY 62 HA2 GLY 62 16.995 -9.002 5.442 488 H SER 63 H SER 63 16.546 -8.534 8.922 489 HA SER 63 HA SER 63 18.099 -10.826 9.640 490 HB2 SER 63 HB3 SER 63 19.891 -9.279 8.843 491 HB3 SER 63 HB2 SER 63 19.362 -8.097 10.039 492 HG SER 63 HG SER 63 21.155 -9.423 10.719 493 H TRP 64 H TRP 64 18.467 -10.822 12.053 494 HA TRP 64 HA TRP 64 16.059 -9.692 13.271 495 HB2 TRP 64 HB3 TRP 64 17.877 -11.923 14.218 496 HB3 TRP 64 HB2 TRP 64 16.400 -11.403 15.024 497 HD1 TRP 64 HD1 TRP 64 17.490 -12.940 11.636 498 HE1 TRP 64 HE1 TRP 64 15.567 -14.405 10.752 499 HE3 TRP 64 HE3 TRP 64 14.015 -11.973 15.258 500 HZ2 TRP 64 HZ2 TRP 64 12.932 -15.066 11.501 501 HZ3 TRP 64 HZ3 TRP 64 11.819 -13.066 15.101 502 HH2 TRP 64 HH2 TRP 64 11.288 -14.581 13.262 503 H THR 65 H THR 65 16.531 -9.458 15.840 504 HA THR 65 HA THR 65 17.863 -7.046 16.102 505 HB THR 65 HB THR 65 17.835 -7.775 18.645 506 HG1 THR 65 HG1 THR 65 16.631 -9.531 19.062 507 HG21 THR 65 HG21 THR 65 15.450 -7.145 18.741 508 HG22 THR 65 HG22 THR 65 15.349 -7.321 16.988 509 HG23 THR 65 HG23 THR 65 16.380 -6.074 17.693 510 H ASP 66 H ASP 66 19.154 -10.261 16.297 511 HA ASP 66 HA ASP 66 21.844 -9.242 16.370 512 HB2 ASP 66 HB3 ASP 66 21.210 -9.338 18.812 513 HB3 ASP 66 HB2 ASP 66 20.922 -11.058 18.620 514 H MET 67 H MET 67 23.096 -10.653 15.113 515 HA MET 67 HA MET 67 22.368 -13.498 15.392 516 HB2 MET 67 HB3 MET 67 23.366 -12.118 12.895 517 HB3 MET 67 HB2 MET 67 23.321 -13.859 13.093 518 HG2 MET 67 HG3 MET 67 20.867 -13.717 13.353 519 HG3 MET 67 HG2 MET 67 20.969 -11.986 13.025 520 HE1 MET 67 HE1 MET 67 19.133 -13.961 11.296 521 HE2 MET 67 HE2 MET 67 19.477 -13.378 9.666 522 HE3 MET 67 HE3 MET 67 19.265 -12.227 10.988 523 H ASP 68 H ASP 68 24.036 -12.994 17.211 524 HA ASP 68 HA ASP 68 25.938 -14.913 16.384 525 HB2 ASP 68 HB3 ASP 68 27.115 -12.732 15.741 526 HB3 ASP 68 HB2 ASP 68 27.210 -12.396 17.466 527 H THR 69 H THR 69 24.876 -16.113 17.973 528 HA THR 69 HA THR 69 25.724 -15.525 20.693 529 HB THR 69 HB THR 69 22.774 -15.912 20.205 530 HG1 THR 69 HG1 THR 69 24.281 -13.496 20.315 531 HG21 THR 69 HG21 THR 69 24.351 -14.837 22.540 532 HG22 THR 69 HG22 THR 69 23.571 -16.416 22.450 533 HG23 THR 69 HG23 THR 69 22.594 -14.947 22.457 534 HA PRO 70 HA PRO 70 25.800 -20.016 20.111 535 HB2 PRO 70 HB3 PRO 70 27.448 -19.948 22.536 536 HB3 PRO 70 HB2 PRO 70 27.858 -20.535 20.921 537 HG2 PRO 70 HG3 PRO 70 28.933 -18.284 21.945 538 HG3 PRO 70 HG2 PRO 70 28.595 -18.468 20.214 539 HD2 PRO 70 HD3 PRO 70 27.012 -17.022 22.313 540 HD3 PRO 70 HD2 PRO 70 27.400 -16.522 20.651 541 H SER 71 H SER 71 23.634 -20.357 20.702 542 HA SER 71 HA SER 71 22.837 -20.279 23.463 543 HB2 SER 71 HB3 SER 71 21.417 -21.514 21.092 544 HB3 SER 71 HB2 SER 71 20.704 -21.154 22.664 545 HG SER 71 HG SER 71 21.970 -19.048 21.374 546 H ARG 72 H ARG 72 23.536 -21.714 24.852 547 HA ARG 72 HA ARG 72 24.505 -24.288 23.883 548 HB2 ARG 72 HB3 ARG 72 25.626 -24.339 26.160 549 HB3 ARG 72 HB2 ARG 72 26.177 -23.099 25.046 550 HG2 ARG 72 HG3 ARG 72 24.558 -21.534 26.229 551 HG3 ARG 72 HG2 ARG 72 24.437 -22.785 27.466 552 HD2 ARG 72 HD3 ARG 72 26.822 -22.675 27.865 553 HD3 ARG 72 HD2 ARG 72 27.012 -21.507 26.559 554 HE ARG 72 HE ARG 72 25.292 -20.829 28.844 555 HH11 ARG 72 HH11 ARG 72 28.283 -20.344 27.087 556 HH12 ARG 72 HH12 ARG 72 28.605 -18.792 27.801 557 HH21 ARG 72 HH21 ARG 72 25.716 -18.789 29.809 558 HH22 ARG 72 HH22 ARG 72 27.159 -17.923 29.369 559 H CYS 73 H CYS 73 23.564 -26.148 24.343 560 HA CYS 73 HA CYS 73 21.238 -26.250 26.053 561 HB2 CYS 73 HB3 CYS 73 22.678 -28.462 24.568 562 HB3 CYS 73 HB2 CYS 73 21.136 -28.628 25.398 563 H VAL 74 H VAL 74 21.378 -26.551 28.180 564 HA VAL 74 HA VAL 74 23.204 -28.480 29.274 565 HB VAL 74 HB VAL 74 24.699 -26.558 29.155 566 HG11 VAL 74 HG11 VAL 74 22.636 -25.114 30.808 567 HG12 VAL 74 HG12 VAL 74 23.090 -24.757 29.142 568 HG13 VAL 74 HG13 VAL 74 24.255 -24.516 30.444 569 HG21 VAL 74 HG21 VAL 74 23.791 -27.169 31.964 570 HG22 VAL 74 HG22 VAL 74 25.312 -26.387 31.540 571 HG23 VAL 74 HG23 VAL 74 25.002 -28.045 31.027 572 H ARG 75 H ARG 75 22.462 -29.324 31.132 573 HA ARG 75 HA ARG 75 20.326 -27.990 32.588 574 HB2 ARG 75 HB3 ARG 75 18.939 -30.069 32.532 575 HB3 ARG 75 HB2 ARG 75 19.074 -29.268 30.974 576 HG2 ARG 75 HG3 ARG 75 20.770 -30.893 30.288 577 HG3 ARG 75 HG2 ARG 75 20.630 -31.693 31.853 578 HD2 ARG 75 HD3 ARG 75 18.422 -31.386 29.825 579 HD3 ARG 75 HD2 ARG 75 19.351 -32.853 30.118 580 HE ARG 75 HE ARG 75 18.168 -31.989 32.526 581 HH11 ARG 75 HH11 ARG 75 17.331 -33.424 29.452 582 HH12 ARG 75 HH12 ARG 75 15.908 -34.220 30.051 583 HH21 ARG 75 HH21 ARG 75 16.290 -33.015 33.334 584 HH22 ARG 75 HH22 ARG 75 15.309 -33.973 32.260 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 3.537 1.816 -2.305 2 H2 GLY 1 HT2 GLY 1 4.982 1.347 -1.560 3 H3 GLY 1 HT3 GLY 1 3.588 0.396 -1.380 4 HA2 GLY 1 HA2 GLY 1 3.604 -0.029 -3.789 5 HA3 GLY 1 HA3 GLY 1 5.129 0.840 -3.875 6 HA PRO 2 HA PRO 2 6.310 -3.511 -3.331 7 HB2 PRO 2 HB3 PRO 2 8.687 -3.350 -4.606 8 HB3 PRO 2 HB2 PRO 2 7.153 -3.482 -5.471 9 HG2 PRO 2 HG3 PRO 2 8.838 -1.069 -4.956 10 HG3 PRO 2 HG2 PRO 2 7.949 -1.525 -6.420 11 HD2 PRO 2 HD3 PRO 2 7.052 0.307 -4.587 12 HD3 PRO 2 HD2 PRO 2 5.984 -0.641 -5.639 13 H THR 3 H THR 3 6.435 -2.626 -1.019 14 HA THR 3 HA THR 3 9.232 -2.390 -0.162 15 HB THR 3 HB THR 3 8.246 -1.813 2.076 16 HG1 THR 3 HG1 THR 3 6.107 -2.811 1.297 17 HG21 THR 3 HG21 THR 3 8.991 -0.073 0.519 18 HG22 THR 3 HG22 THR 3 7.592 0.458 1.453 19 HG23 THR 3 HG23 THR 3 7.391 -0.051 -0.224 20 H SER 4 H SER 4 10.191 -4.224 0.402 21 HA SER 4 HA SER 4 8.532 -6.399 1.492 22 HB2 SER 4 HB3 SER 4 11.244 -6.584 0.148 23 HB3 SER 4 HB2 SER 4 10.264 -7.942 0.703 24 HG SER 4 HG SER 4 10.206 -6.936 -1.661 25 H GLU 5 H GLU 5 8.586 -6.019 3.642 26 HA GLU 5 HA GLU 5 11.221 -5.652 4.907 27 HB2 GLU 5 HB3 GLU 5 8.542 -4.973 6.127 28 HB3 GLU 5 HB2 GLU 5 10.134 -4.463 6.670 29 HG2 GLU 5 HG3 GLU 5 8.876 -3.609 4.073 30 HG3 GLU 5 HG2 GLU 5 8.795 -2.684 5.569 31 H GLY 6 H GLY 6 11.808 -7.746 5.335 32 HA2 GLY 6 HA3 GLY 6 10.374 -9.087 7.439 33 HA3 GLY 6 HA2 GLY 6 10.287 -9.925 5.898 34 H CYS 7 H CYS 7 11.516 -10.776 8.394 35 HA CYS 7 HA CYS 7 14.362 -10.825 7.779 36 HB2 CYS 7 HB3 CYS 7 12.833 -12.192 10.005 37 HB3 CYS 7 HB2 CYS 7 14.583 -12.048 9.881 38 H GLN 8 H GLN 8 15.505 -12.744 7.260 39 HA GLN 8 HA GLN 8 13.901 -14.669 5.798 40 HB2 GLN 8 HB3 GLN 8 16.018 -15.539 4.970 41 HB3 GLN 8 HB2 GLN 8 15.978 -13.788 4.800 42 HG2 GLN 8 HG3 GLN 8 17.483 -13.469 6.558 43 HG3 GLN 8 HG2 GLN 8 17.254 -15.108 7.167 44 HE21 GLN 8 HE21 GLN 8 18.273 -16.825 6.130 45 HE22 GLN 8 HE22 GLN 8 19.604 -16.578 5.050 46 H ILE 9 H ILE 9 14.924 -17.023 5.940 47 HA ILE 9 HA ILE 9 14.570 -17.892 8.687 48 HB ILE 9 HB ILE 9 14.867 -19.427 6.103 49 HG12 ILE 9 HG13 ILE 9 12.539 -19.046 7.993 50 HG13 ILE 9 HG12 ILE 9 12.709 -18.331 6.393 51 HG21 ILE 9 HG21 ILE 9 15.897 -20.732 7.859 52 HG22 ILE 9 HG22 ILE 9 14.356 -21.452 7.396 53 HG23 ILE 9 HG23 ILE 9 14.479 -20.517 8.886 54 HD11 ILE 9 HD11 ILE 9 11.194 -20.295 6.489 55 HD12 ILE 9 HD12 ILE 9 12.589 -21.291 6.899 56 HD13 ILE 9 HD13 ILE 9 12.524 -20.462 5.344 57 H ILE 10 H ILE 10 16.145 -18.509 9.999 58 HA ILE 10 HA ILE 10 18.886 -18.144 9.272 59 HB ILE 10 HB ILE 10 17.678 -19.324 11.787 60 HG12 ILE 10 HG13 ILE 10 18.665 -16.523 11.200 61 HG13 ILE 10 HG12 ILE 10 16.977 -17.002 11.332 62 HG21 ILE 10 HG21 ILE 10 20.470 -18.301 11.282 63 HG22 ILE 10 HG22 ILE 10 20.010 -19.989 11.504 64 HG23 ILE 10 HG23 ILE 10 19.835 -18.845 12.835 65 HD11 ILE 10 HD11 ILE 10 17.767 -15.896 13.348 66 HD12 ILE 10 HD12 ILE 10 19.014 -17.130 13.542 67 HD13 ILE 10 HD13 ILE 10 17.311 -17.568 13.668 68 H HIS 11 H HIS 11 20.405 -19.631 8.805 69 HA HIS 11 HA HIS 11 19.562 -22.136 7.777 70 HB2 HIS 11 HB3 HIS 11 21.592 -20.551 7.164 71 HB3 HIS 11 HB2 HIS 11 22.438 -21.543 8.347 72 HD1 HIS 11 HD1 HIS 11 23.532 -23.557 7.400 73 HD2 HIS 11 HD2 HIS 11 20.305 -22.292 5.095 74 HE1 HIS 11 HE1 HIS 11 23.495 -25.073 5.390 75 HE2 HIS 11 HE2 HIS 11 21.512 -24.325 4.028 76 HA PRO 12 HA PRO 12 19.337 -24.818 11.253 77 HB2 PRO 12 HB3 PRO 12 21.128 -26.535 9.576 78 HB3 PRO 12 HB2 PRO 12 19.675 -26.975 10.482 79 HG2 PRO 12 HG3 PRO 12 19.575 -26.599 7.845 80 HG3 PRO 12 HG2 PRO 12 18.248 -26.078 8.898 81 HD2 PRO 12 HD3 PRO 12 20.270 -24.461 7.467 82 HD3 PRO 12 HD2 PRO 12 18.637 -24.019 7.998 83 HA PRO 13 HA PRO 13 23.310 -23.941 13.171 84 HB2 PRO 13 HB3 PRO 13 22.400 -23.661 15.659 85 HB3 PRO 13 HB2 PRO 13 22.045 -22.450 14.420 86 HG2 PRO 13 HG3 PRO 13 20.297 -24.603 15.521 87 HG3 PRO 13 HG2 PRO 13 19.881 -22.942 15.068 88 HD2 PRO 13 HD3 PRO 13 19.469 -25.207 13.490 89 HD3 PRO 13 HD2 PRO 13 19.475 -23.530 12.914 90 H TRP 14 H TRP 14 23.430 -24.823 15.931 91 HA TRP 14 HA TRP 14 24.471 -27.451 15.493 92 HB2 TRP 14 HB3 TRP 14 25.219 -25.475 17.113 93 HB3 TRP 14 HB2 TRP 14 24.151 -26.306 18.237 94 HD1 TRP 14 HD1 TRP 14 25.084 -28.449 19.408 95 HE1 TRP 14 HE1 TRP 14 27.328 -29.716 19.309 96 HE3 TRP 14 HE3 TRP 14 27.166 -26.096 15.373 97 HZ2 TRP 14 HZ2 TRP 14 29.662 -29.710 17.727 98 HZ3 TRP 14 HZ3 TRP 14 29.408 -26.788 14.629 99 HH2 TRP 14 HH2 TRP 14 30.629 -28.556 15.782 100 H GLU 15 H GLU 15 23.982 -29.053 17.468 101 HA GLU 15 HA GLU 15 21.569 -30.275 17.182 102 HB2 GLU 15 HB3 GLU 15 23.452 -30.160 19.520 103 HB3 GLU 15 HB2 GLU 15 21.982 -31.122 19.592 104 HG2 GLU 15 HG3 GLU 15 23.868 -31.466 17.309 105 HG3 GLU 15 HG2 GLU 15 24.227 -32.206 18.868 106 H GLY 16 H GLY 16 19.708 -29.147 17.200 107 HA2 GLY 16 HA3 GLY 16 18.274 -28.666 19.496 108 HA3 GLY 16 HA2 GLY 16 19.074 -27.142 19.134 109 H GLY 17 H GLY 17 16.946 -26.231 18.814 110 HA2 GLY 17 HA3 GLY 17 16.198 -26.409 16.021 111 HA3 GLY 17 HA2 GLY 17 14.957 -26.970 17.134 112 H ILE 18 H ILE 18 13.848 -25.105 15.973 113 HA ILE 18 HA ILE 18 14.312 -22.676 17.543 114 HB ILE 18 HB ILE 18 13.956 -22.852 14.567 115 HG12 ILE 18 HG13 ILE 18 15.837 -21.404 16.429 116 HG13 ILE 18 HG12 ILE 18 16.219 -22.809 15.439 117 HG21 ILE 18 HG21 ILE 18 13.547 -20.441 14.502 118 HG22 ILE 18 HG22 ILE 18 13.473 -20.401 16.263 119 HG23 ILE 18 HG23 ILE 18 12.249 -21.283 15.350 120 HD11 ILE 18 HD11 ILE 18 17.141 -20.797 14.455 121 HD12 ILE 18 HD12 ILE 18 15.538 -20.061 14.414 122 HD13 ILE 18 HD13 ILE 18 15.886 -21.473 13.416 123 H ARG 19 H ARG 19 12.661 -21.804 18.426 124 HA ARG 19 HA ARG 19 10.044 -23.062 18.106 125 HB2 ARG 19 HB3 ARG 19 11.231 -22.842 20.322 126 HB3 ARG 19 HB2 ARG 19 11.016 -21.108 20.190 127 HG2 ARG 19 HG3 ARG 19 9.335 -22.016 21.645 128 HG3 ARG 19 HG2 ARG 19 8.580 -21.405 20.175 129 HD2 ARG 19 HD3 ARG 19 9.346 -24.277 20.299 130 HD3 ARG 19 HD2 ARG 19 7.929 -23.745 21.198 131 HE ARG 19 HE ARG 19 7.715 -22.752 18.602 132 HH11 ARG 19 HH11 ARG 19 7.740 -25.847 20.253 133 HH12 ARG 19 HH12 ARG 19 6.686 -26.605 19.093 134 HH21 ARG 19 HH21 ARG 19 6.321 -23.763 17.077 135 HH22 ARG 19 HH22 ARG 19 5.858 -25.424 17.320 136 H TYR 20 H TYR 20 8.953 -22.065 16.471 137 HA TYR 20 HA TYR 20 9.098 -19.216 16.072 138 HB2 TYR 20 HB3 TYR 20 7.323 -21.323 14.814 139 HB3 TYR 20 HB2 TYR 20 7.390 -19.640 14.307 140 HD1 TYR 20 HD1 TYR 20 9.151 -22.855 14.310 141 HD2 TYR 20 HD2 TYR 20 9.297 -18.790 13.062 142 HE1 TYR 20 HE1 TYR 20 10.986 -23.398 12.763 143 HE2 TYR 20 HE2 TYR 20 11.130 -19.323 11.515 144 HH TYR 20 HH TYR 20 12.882 -21.030 11.252 145 H ARG 21 H ARG 21 6.539 -18.419 15.535 146 HA ARG 21 HA ARG 21 5.513 -18.104 18.214 147 HB2 ARG 21 HB3 ARG 21 5.523 -16.192 16.681 148 HB3 ARG 21 HB2 ARG 21 4.462 -17.054 15.577 149 HG2 ARG 21 HG3 ARG 21 2.745 -17.108 17.384 150 HG3 ARG 21 HG2 ARG 21 3.801 -16.071 18.343 151 HD2 ARG 21 HD3 ARG 21 2.706 -15.399 15.615 152 HD3 ARG 21 HD2 ARG 21 2.053 -14.812 17.142 153 HE ARG 21 HE ARG 21 4.657 -14.043 17.217 154 HH11 ARG 21 HH11 ARG 21 2.046 -13.591 14.931 155 HH12 ARG 21 HH12 ARG 21 2.629 -12.061 14.364 156 HH21 ARG 21 HH21 ARG 21 5.423 -11.984 16.475 157 HH22 ARG 21 HH22 ARG 21 4.529 -11.142 15.244 158 H GLY 22 H GLY 22 3.903 -19.069 15.165 159 HA2 GLY 22 HA3 GLY 22 2.401 -21.059 16.735 160 HA3 GLY 22 HA2 GLY 22 1.538 -19.921 15.712 161 H LEU 23 H LEU 23 4.603 -21.532 15.003 162 HA LEU 23 HA LEU 23 3.323 -22.628 12.601 163 HB2 LEU 23 HB3 LEU 23 6.199 -21.995 13.227 164 HB3 LEU 23 HB2 LEU 23 5.719 -22.928 11.820 165 HG LEU 23 HG LEU 23 4.839 -20.097 12.390 166 HD11 LEU 23 HD11 LEU 23 6.894 -21.132 10.446 167 HD12 LEU 23 HD12 LEU 23 7.224 -20.200 11.907 168 HD13 LEU 23 HD13 LEU 23 6.335 -19.465 10.572 169 HD21 LEU 23 HD21 LEU 23 3.225 -21.365 11.076 170 HD22 LEU 23 HD22 LEU 23 4.499 -21.839 9.953 171 HD23 LEU 23 HD23 LEU 23 4.024 -20.145 10.086 172 H THR 24 H THR 24 2.819 -24.676 12.601 173 HA THR 24 HA THR 24 4.208 -26.553 14.360 174 HB THR 24 HB THR 24 1.708 -26.539 14.302 175 HG1 THR 24 HG1 THR 24 1.933 -28.555 14.864 176 HG21 THR 24 HG21 THR 24 0.571 -27.575 12.375 177 HG22 THR 24 HG22 THR 24 2.100 -27.594 11.497 178 HG23 THR 24 HG23 THR 24 1.359 -26.058 11.946 179 H ARG 25 H ARG 25 4.169 -28.906 13.059 180 HA ARG 25 HA ARG 25 6.412 -28.659 11.335 181 HB2 ARG 25 HB3 ARG 25 4.635 -31.064 11.759 182 HB3 ARG 25 HB2 ARG 25 6.250 -31.079 11.072 183 HG2 ARG 25 HG3 ARG 25 7.130 -30.277 13.237 184 HG3 ARG 25 HG2 ARG 25 5.502 -30.414 13.910 185 HD2 ARG 25 HD3 ARG 25 5.515 -32.818 13.209 186 HD3 ARG 25 HD2 ARG 25 7.212 -32.626 12.778 187 HE ARG 25 HE ARG 25 6.489 -31.928 15.512 188 HH11 ARG 25 HH11 ARG 25 7.819 -34.294 13.292 189 HH12 ARG 25 HH12 ARG 25 8.529 -35.264 14.549 190 HH21 ARG 25 HH21 ARG 25 7.423 -33.230 17.173 191 HH22 ARG 25 HH22 ARG 25 8.307 -34.664 16.735 192 H ASP 26 H ASP 26 6.190 -30.361 9.297 193 HA ASP 26 HA ASP 26 5.663 -30.486 7.091 194 HB2 ASP 26 HB3 ASP 26 3.534 -31.379 8.066 195 HB3 ASP 26 HB2 ASP 26 2.861 -29.757 7.990 196 H GLN 27 H GLN 27 6.305 -27.909 8.468 197 HA GLN 27 HA GLN 27 5.697 -26.116 6.241 198 HB2 GLN 27 HB3 GLN 27 5.179 -25.571 9.162 199 HB3 GLN 27 HB2 GLN 27 5.388 -24.276 7.993 200 HG2 GLN 27 HG3 GLN 27 3.465 -25.023 6.750 201 HG3 GLN 27 HG2 GLN 27 3.292 -26.426 7.804 202 HE21 GLN 27 HE21 GLN 27 3.866 -25.033 10.241 203 HE22 GLN 27 HE22 GLN 27 2.496 -24.026 10.585 204 H VAL 28 H VAL 28 6.904 -23.857 7.264 205 HA VAL 28 HA VAL 28 8.903 -22.814 7.268 206 HB VAL 28 HB VAL 28 10.359 -23.204 9.116 207 HG11 VAL 28 HG11 VAL 28 8.762 -23.207 10.982 208 HG12 VAL 28 HG12 VAL 28 7.502 -23.761 9.879 209 HG13 VAL 28 HG13 VAL 28 8.247 -22.180 9.644 210 HG21 VAL 28 HG21 VAL 28 10.674 -25.608 8.991 211 HG22 VAL 28 HG22 VAL 28 9.008 -25.875 9.503 212 HG23 VAL 28 HG23 VAL 28 10.164 -25.143 10.617 213 H LYS 29 H LYS 29 8.627 -25.104 5.433 214 HA LYS 29 HA LYS 29 11.326 -26.138 5.237 215 HB2 LYS 29 HB3 LYS 29 10.376 -27.347 3.223 216 HB3 LYS 29 HB2 LYS 29 9.670 -27.756 4.779 217 HG2 LYS 29 HG3 LYS 29 7.854 -26.064 4.214 218 HG3 LYS 29 HG2 LYS 29 8.494 -26.109 2.569 219 HD2 LYS 29 HD3 LYS 29 8.097 -28.489 2.438 220 HD3 LYS 29 HD2 LYS 29 7.578 -28.526 4.124 221 HE2 LYS 29 HE3 LYS 29 5.617 -28.555 2.796 222 HE3 LYS 29 HE2 LYS 29 5.741 -26.942 3.489 223 HZ1 LYS 29 HZ1 LYS 29 6.659 -26.153 1.390 224 HZ2 LYS 29 HZ2 LYS 29 5.128 -26.852 1.165 225 HZ3 LYS 29 HZ3 LYS 29 6.521 -27.711 0.732 226 H ALA 30 H ALA 30 9.393 -23.640 3.897 227 HA ALA 30 HA ALA 30 11.665 -22.440 2.672 228 HB1 ALA 30 HB1 ALA 30 10.896 -22.405 0.378 229 HB2 ALA 30 HB2 ALA 30 9.479 -23.360 0.810 230 HB3 ALA 30 HB3 ALA 30 11.089 -24.074 0.917 231 H ILE 31 H ILE 31 11.258 -20.591 3.722 232 HA ILE 31 HA ILE 31 8.776 -19.166 3.034 233 HB ILE 31 HB ILE 31 10.204 -19.050 5.704 234 HG12 ILE 31 HG13 ILE 31 7.474 -20.154 5.007 235 HG13 ILE 31 HG12 ILE 31 8.895 -21.124 5.374 236 HG21 ILE 31 HG21 ILE 31 9.281 -16.890 5.089 237 HG22 ILE 31 HG22 ILE 31 8.353 -17.602 6.410 238 HG23 ILE 31 HG23 ILE 31 7.714 -17.634 4.767 239 HD11 ILE 31 HD11 ILE 31 7.409 -20.996 7.282 240 HD12 ILE 31 HD12 ILE 31 7.505 -19.234 7.259 241 HD13 ILE 31 HD13 ILE 31 8.940 -20.190 7.633 242 H ASN 32 H ASN 32 9.056 -17.039 2.437 243 HA ASN 32 HA ASN 32 11.743 -16.334 1.662 244 HB2 ASN 32 HB3 ASN 32 9.107 -14.898 1.286 245 HB3 ASN 32 HB2 ASN 32 10.644 -14.336 0.639 246 HD21 ASN 32 HD21 ASN 32 8.192 -15.112 -0.737 247 HD22 ASN 32 HD22 ASN 32 8.642 -16.375 -1.836 248 H PHE 33 H PHE 33 9.197 -14.735 3.569 249 HA PHE 33 HA PHE 33 11.283 -13.490 5.204 250 HB2 PHE 33 HB3 PHE 33 9.026 -11.958 3.889 251 HB3 PHE 33 HB2 PHE 33 10.139 -11.300 5.081 252 HD1 PHE 33 HD1 PHE 33 9.506 -11.799 1.639 253 HD2 PHE 33 HD2 PHE 33 12.648 -11.356 4.473 254 HE1 PHE 33 HE1 PHE 33 11.042 -11.151 -0.170 255 HE2 PHE 33 HE2 PHE 33 14.189 -10.704 2.669 256 HZ PHE 33 HZ PHE 33 13.386 -10.602 0.342 257 H LEU 34 H LEU 34 10.789 -13.343 7.296 258 HA LEU 34 HA LEU 34 8.182 -14.230 8.222 259 HB2 LEU 34 HB3 LEU 34 10.762 -13.530 9.621 260 HB3 LEU 34 HB2 LEU 34 9.278 -13.791 10.512 261 HG LEU 34 HG LEU 34 10.587 -15.787 10.612 262 HD11 LEU 34 HD11 LEU 34 8.340 -16.168 8.643 263 HD12 LEU 34 HD12 LEU 34 8.182 -16.093 10.398 264 HD13 LEU 34 HD13 LEU 34 9.069 -17.420 9.650 265 HD21 LEU 34 HD21 LEU 34 11.250 -17.040 8.613 266 HD22 LEU 34 HD22 LEU 34 12.016 -15.452 8.684 267 HD23 LEU 34 HD23 LEU 34 10.652 -15.723 7.601 268 HA PRO 35 HA PRO 35 6.469 -10.180 8.572 269 HB2 PRO 35 HB3 PRO 35 4.898 -10.555 10.801 270 HB3 PRO 35 HB2 PRO 35 4.451 -11.044 9.164 271 HG2 PRO 35 HG3 PRO 35 5.591 -12.685 11.388 272 HG3 PRO 35 HG2 PRO 35 4.333 -13.108 10.211 273 HD2 PRO 35 HD3 PRO 35 6.860 -13.992 9.970 274 HD3 PRO 35 HD2 PRO 35 5.870 -13.587 8.554 275 H VAL 36 H VAL 36 6.354 -8.325 9.969 276 HA VAL 36 HA VAL 36 8.730 -7.965 11.468 277 HB VAL 36 HB VAL 36 7.706 -6.137 10.189 278 HG11 VAL 36 HG11 VAL 36 5.546 -6.134 12.287 279 HG12 VAL 36 HG12 VAL 36 5.356 -6.667 10.617 280 HG13 VAL 36 HG13 VAL 36 5.731 -4.979 10.965 281 HG21 VAL 36 HG21 VAL 36 7.910 -5.583 13.145 282 HG22 VAL 36 HG22 VAL 36 7.939 -4.360 11.873 283 HG23 VAL 36 HG23 VAL 36 9.228 -5.559 11.974 284 H ASP 37 H ASP 37 9.056 -7.698 13.635 285 HA ASP 37 HA ASP 37 8.826 -8.000 15.860 286 HB2 ASP 37 HB3 ASP 37 6.888 -6.428 15.609 287 HB3 ASP 37 HB2 ASP 37 5.831 -7.827 15.446 288 H TYR 38 H TYR 38 8.484 -10.211 13.761 289 HA TYR 38 HA TYR 38 7.182 -12.278 15.281 290 HB2 TYR 38 HB3 TYR 38 7.595 -12.203 12.707 291 HB3 TYR 38 HB2 TYR 38 9.195 -12.817 13.112 292 HD1 TYR 38 HD1 TYR 38 9.504 -15.101 13.800 293 HD2 TYR 38 HD2 TYR 38 5.592 -13.544 13.213 294 HE1 TYR 38 HE1 TYR 38 8.582 -17.380 13.919 295 HE2 TYR 38 HE2 TYR 38 4.661 -15.813 13.327 296 HH TYR 38 HH TYR 38 5.300 -18.090 13.087 297 H GLU 39 H GLU 39 8.091 -13.614 16.755 298 HA GLU 39 HA GLU 39 10.941 -13.190 17.334 299 HB2 GLU 39 HB3 GLU 39 8.734 -13.565 19.371 300 HB3 GLU 39 HB2 GLU 39 10.434 -13.275 19.712 301 HG2 GLU 39 HG3 GLU 39 10.286 -11.070 18.710 302 HG3 GLU 39 HG2 GLU 39 8.596 -11.354 18.305 303 H ILE 40 H ILE 40 12.128 -14.947 17.845 304 HA ILE 40 HA ILE 40 10.767 -17.551 17.911 305 HB ILE 40 HB ILE 40 12.708 -18.462 16.582 306 HG12 ILE 40 HG13 ILE 40 13.173 -15.519 16.084 307 HG13 ILE 40 HG12 ILE 40 14.252 -16.603 16.949 308 HG21 ILE 40 HG21 ILE 40 10.956 -16.428 15.206 309 HG22 ILE 40 HG22 ILE 40 10.518 -18.098 15.568 310 HG23 ILE 40 HG23 ILE 40 11.811 -17.755 14.419 311 HD11 ILE 40 HD11 ILE 40 14.689 -17.824 14.915 312 HD12 ILE 40 HD12 ILE 40 15.006 -16.102 14.685 313 HD13 ILE 40 HD13 ILE 40 13.530 -16.821 14.042 314 H GLU 41 H GLU 41 11.834 -19.185 19.055 315 HA GLU 41 HA GLU 41 13.916 -18.203 20.897 316 HB2 GLU 41 HB3 GLU 41 11.736 -18.669 21.968 317 HB3 GLU 41 HB2 GLU 41 11.812 -20.326 21.381 318 HG2 GLU 41 HG3 GLU 41 13.837 -20.687 22.705 319 HG3 GLU 41 HG2 GLU 41 13.719 -19.037 23.318 320 H TYR 42 H TYR 42 15.563 -19.675 21.518 321 HA TYR 42 HA TYR 42 16.101 -21.768 19.540 322 HB2 TYR 42 HB3 TYR 42 17.893 -20.300 21.474 323 HB3 TYR 42 HB2 TYR 42 18.425 -21.703 20.557 324 HD1 TYR 42 HD1 TYR 42 18.919 -21.542 18.223 325 HD2 TYR 42 HD2 TYR 42 17.381 -18.186 20.331 326 HE1 TYR 42 HE1 TYR 42 19.528 -20.087 16.337 327 HE2 TYR 42 HE2 TYR 42 17.982 -16.728 18.453 328 HH TYR 42 HH TYR 42 18.930 -17.941 15.402 329 H VAL 43 H VAL 43 15.132 -23.604 20.224 330 HA VAL 43 HA VAL 43 15.456 -24.411 23.013 331 HB VAL 43 HB VAL 43 13.927 -26.268 22.477 332 HG11 VAL 43 HG11 VAL 43 12.930 -23.546 21.648 333 HG12 VAL 43 HG12 VAL 43 12.995 -24.187 23.290 334 HG13 VAL 43 HG13 VAL 43 11.907 -24.909 22.105 335 HG21 VAL 43 HG21 VAL 43 14.517 -26.589 20.130 336 HG22 VAL 43 HG22 VAL 43 13.798 -25.030 19.728 337 HG23 VAL 43 HG23 VAL 43 12.780 -26.346 20.314 338 H CYS 44 H CYS 44 16.274 -26.542 23.525 339 HA CYS 44 HA CYS 44 18.527 -27.222 21.803 340 HB2 CYS 44 HB3 CYS 44 18.719 -26.855 24.333 341 HB3 CYS 44 HB2 CYS 44 17.904 -28.404 24.513 342 H ARG 45 H ARG 45 18.979 -29.825 22.059 343 HA ARG 45 HA ARG 45 16.762 -30.955 20.605 344 HB2 ARG 45 HB3 ARG 45 19.593 -31.566 20.897 345 HB3 ARG 45 HB2 ARG 45 18.583 -33.007 20.938 346 HG2 ARG 45 HG3 ARG 45 18.659 -30.921 18.768 347 HG3 ARG 45 HG2 ARG 45 19.262 -32.579 18.673 348 HD2 ARG 45 HD3 ARG 45 16.977 -33.413 19.043 349 HD3 ARG 45 HD2 ARG 45 16.389 -31.755 19.083 350 HE ARG 45 HE ARG 45 17.779 -32.654 16.681 351 HH11 ARG 45 HH11 ARG 45 14.782 -31.776 18.288 352 HH12 ARG 45 HH12 ARG 45 13.873 -31.701 16.810 353 HH21 ARG 45 HH21 ARG 45 16.579 -32.535 14.733 354 HH22 ARG 45 HH22 ARG 45 14.878 -32.139 14.798 355 H GLY 46 H GLY 46 15.802 -33.012 21.097 356 HA2 GLY 46 HA3 GLY 46 14.723 -34.462 22.524 357 HA3 GLY 46 HA2 GLY 46 15.900 -34.043 23.766 358 H GLU 47 H GLU 47 14.550 -33.656 25.460 359 HA GLU 47 HA GLU 47 12.644 -31.437 25.096 360 HB2 GLU 47 HB3 GLU 47 11.561 -32.231 27.165 361 HB3 GLU 47 HB2 GLU 47 11.569 -33.464 25.912 362 HG2 GLU 47 HG3 GLU 47 13.492 -34.531 27.003 363 HG3 GLU 47 HG2 GLU 47 13.423 -33.317 28.280 364 H ARG 48 H ARG 48 15.605 -31.485 25.515 365 HA ARG 48 HA ARG 48 15.936 -30.370 28.180 366 HB2 ARG 48 HB3 ARG 48 18.061 -30.614 26.052 367 HB3 ARG 48 HB2 ARG 48 18.277 -30.513 27.795 368 HG2 ARG 48 HG3 ARG 48 17.067 -32.834 26.302 369 HG3 ARG 48 HG2 ARG 48 18.699 -32.765 26.961 370 HD2 ARG 48 HD3 ARG 48 16.255 -32.412 28.679 371 HD3 ARG 48 HD2 ARG 48 16.943 -33.997 28.333 372 HE ARG 48 HE ARG 48 18.616 -31.899 29.542 373 HH11 ARG 48 HH11 ARG 48 16.960 -34.969 29.814 374 HH12 ARG 48 HH12 ARG 48 17.908 -35.511 31.166 375 HH21 ARG 48 HH21 ARG 48 19.878 -32.604 31.312 376 HH22 ARG 48 HH22 ARG 48 19.589 -34.174 32.005 377 H GLU 49 H GLU 49 16.890 -28.254 28.492 378 HA GLU 49 HA GLU 49 16.035 -26.399 26.372 379 HB2 GLU 49 HB3 GLU 49 15.716 -26.014 29.355 380 HB3 GLU 49 HB2 GLU 49 15.157 -24.921 28.092 381 HG2 GLU 49 HG3 GLU 49 13.564 -26.532 27.317 382 HG3 GLU 49 HG2 GLU 49 14.202 -27.757 28.410 383 H VAL 50 H VAL 50 16.905 -24.112 26.842 384 HA VAL 50 HA VAL 50 19.745 -24.371 27.586 385 HB VAL 50 HB VAL 50 20.300 -22.702 25.913 386 HG11 VAL 50 HG11 VAL 50 18.609 -24.915 24.766 387 HG12 VAL 50 HG12 VAL 50 20.323 -25.006 25.178 388 HG13 VAL 50 HG13 VAL 50 19.784 -23.957 23.865 389 HG21 VAL 50 HG21 VAL 50 18.240 -21.388 25.992 390 HG22 VAL 50 HG22 VAL 50 17.371 -22.697 25.191 391 HG23 VAL 50 HG23 VAL 50 18.652 -21.837 24.336 392 H VAL 51 H VAL 51 20.709 -22.633 28.689 393 HA VAL 51 HA VAL 51 18.851 -20.512 29.517 394 HB VAL 51 HB VAL 51 19.578 -21.733 31.471 395 HG11 VAL 51 HG11 VAL 51 21.631 -22.710 30.619 396 HG12 VAL 51 HG12 VAL 51 21.926 -21.871 32.141 397 HG13 VAL 51 HG13 VAL 51 22.402 -21.124 30.616 398 HG21 VAL 51 HG21 VAL 51 20.605 -19.913 32.766 399 HG22 VAL 51 HG22 VAL 51 19.287 -19.346 31.741 400 HG23 VAL 51 HG23 VAL 51 20.961 -19.064 31.261 401 H GLY 52 H GLY 52 19.132 -19.063 27.992 402 HA2 GLY 52 HA3 GLY 52 21.675 -17.689 27.811 403 HA3 GLY 52 HA2 GLY 52 21.131 -18.469 26.329 404 HA PRO 53 HA PRO 53 18.913 -14.333 26.578 405 HB2 PRO 53 HB3 PRO 53 20.335 -13.033 24.654 406 HB3 PRO 53 HB2 PRO 53 20.711 -12.901 26.376 407 HG2 PRO 53 HG3 PRO 53 22.038 -14.530 24.261 408 HG3 PRO 53 HG2 PRO 53 22.757 -13.668 25.632 409 HD2 PRO 53 HD3 PRO 53 22.310 -16.377 25.569 410 HD3 PRO 53 HD2 PRO 53 22.413 -15.419 27.059 411 H LYS 54 H LYS 54 17.920 -16.504 25.650 412 HA LYS 54 HA LYS 54 18.061 -16.898 22.826 413 HB2 LYS 54 HB3 LYS 54 16.117 -18.487 23.287 414 HB3 LYS 54 HB2 LYS 54 17.646 -18.846 24.076 415 HG2 LYS 54 HG3 LYS 54 16.864 -18.119 26.169 416 HG3 LYS 54 HG2 LYS 54 15.465 -17.313 25.459 417 HD2 LYS 54 HD3 LYS 54 14.599 -19.527 24.769 418 HD3 LYS 54 HD2 LYS 54 15.963 -20.284 25.596 419 HE2 LYS 54 HE3 LYS 54 15.201 -19.607 27.709 420 HE3 LYS 54 HE2 LYS 54 14.102 -18.410 27.024 421 HZ1 LYS 54 HZ1 LYS 54 12.984 -20.440 27.861 422 HZ2 LYS 54 HZ2 LYS 54 13.786 -21.346 26.671 423 HZ3 LYS 54 HZ3 LYS 54 12.689 -20.134 26.218 424 H VAL 55 H VAL 55 17.463 -14.948 21.901 425 HA VAL 55 HA VAL 55 14.636 -14.709 21.462 426 HB VAL 55 HB VAL 55 14.850 -13.353 23.496 427 HG11 VAL 55 HG11 VAL 55 16.179 -11.292 23.503 428 HG12 VAL 55 HG12 VAL 55 16.834 -11.717 21.922 429 HG13 VAL 55 HG13 VAL 55 17.191 -12.727 23.323 430 HG21 VAL 55 HG21 VAL 55 13.891 -11.260 22.639 431 HG22 VAL 55 HG22 VAL 55 13.206 -12.677 21.840 432 HG23 VAL 55 HG23 VAL 55 14.416 -11.697 21.013 433 H ARG 56 H ARG 56 14.290 -14.133 19.432 434 HA ARG 56 HA ARG 56 16.330 -12.508 18.073 435 HB2 ARG 56 HB3 ARG 56 14.719 -14.785 16.917 436 HB3 ARG 56 HB2 ARG 56 15.665 -13.661 15.953 437 HG2 ARG 56 HG3 ARG 56 16.714 -15.555 18.038 438 HG3 ARG 56 HG2 ARG 56 16.891 -15.704 16.288 439 HD2 ARG 56 HD3 ARG 56 18.184 -13.652 16.225 440 HD3 ARG 56 HD2 ARG 56 17.967 -13.441 17.961 441 HE ARG 56 HE ARG 56 19.396 -15.767 16.842 442 HH11 ARG 56 HH11 ARG 56 19.096 -13.165 19.149 443 HH12 ARG 56 HH12 ARG 56 20.664 -13.413 19.855 444 HH21 ARG 56 HH21 ARG 56 21.446 -16.151 17.796 445 HH22 ARG 56 HH22 ARG 56 22.004 -15.115 19.078 446 H LYS 57 H LYS 57 15.553 -10.608 17.655 447 HA LYS 57 HA LYS 57 12.652 -10.274 17.491 448 HB2 LYS 57 HB3 LYS 57 14.062 -9.038 19.221 449 HB3 LYS 57 HB2 LYS 57 14.746 -8.130 17.884 450 HG2 LYS 57 HG3 LYS 57 13.031 -6.821 18.904 451 HG3 LYS 57 HG2 LYS 57 12.462 -7.346 17.318 452 HD2 LYS 57 HD3 LYS 57 10.969 -8.879 18.223 453 HD3 LYS 57 HD2 LYS 57 11.815 -8.936 19.772 454 HE2 LYS 57 HE3 LYS 57 11.069 -6.687 20.288 455 HE3 LYS 57 HE2 LYS 57 10.300 -6.556 18.706 456 HZ1 LYS 57 HZ1 LYS 57 8.940 -7.219 20.826 457 HZ2 LYS 57 HZ2 LYS 57 9.504 -8.776 20.454 458 HZ3 LYS 57 HZ3 LYS 57 8.589 -7.903 19.316 459 H CYS 58 H CYS 58 11.856 -10.112 15.508 460 HA CYS 58 HA CYS 58 13.543 -9.259 13.311 461 HB2 CYS 58 HB3 CYS 58 11.986 -11.185 13.056 462 HB3 CYS 58 HB2 CYS 58 10.632 -10.084 13.279 463 H LEU 59 H LEU 59 13.652 -7.255 12.621 464 HA LEU 59 HA LEU 59 11.551 -5.349 13.391 465 HB2 LEU 59 HB3 LEU 59 14.329 -4.768 12.358 466 HB3 LEU 59 HB2 LEU 59 13.170 -3.593 12.946 467 HG LEU 59 HG LEU 59 14.669 -5.651 14.565 468 HD11 LEU 59 HD11 LEU 59 15.940 -3.668 13.992 469 HD12 LEU 59 HD12 LEU 59 15.545 -3.672 15.711 470 HD13 LEU 59 HD13 LEU 59 14.644 -2.638 14.600 471 HD21 LEU 59 HD21 LEU 59 12.369 -5.493 15.388 472 HD22 LEU 59 HD22 LEU 59 12.531 -3.740 15.502 473 HD23 LEU 59 HD23 LEU 59 13.517 -4.785 16.524 474 H ALA 60 H ALA 60 11.560 -3.460 11.608 475 HA ALA 60 HA ALA 60 10.478 -4.433 9.237 476 HB1 ALA 60 HB1 ALA 60 10.746 -2.160 8.361 477 HB2 ALA 60 HB2 ALA 60 11.813 -1.771 9.712 478 HB3 ALA 60 HB3 ALA 60 10.117 -2.155 10.008 479 H ASN 61 H ASN 61 13.804 -3.699 10.083 480 HA ASN 61 HA ASN 61 14.799 -4.347 7.450 481 HB2 ASN 61 HB3 ASN 61 17.049 -4.248 8.566 482 HB3 ASN 61 HB2 ASN 61 16.106 -2.771 8.720 483 HD21 ASN 61 HD21 ASN 61 17.565 -5.412 10.375 484 HD22 ASN 61 HD22 ASN 61 17.229 -4.867 11.979 485 H GLY 62 H GLY 62 15.538 -6.294 6.769 486 HA2 GLY 62 HA3 GLY 62 14.440 -8.540 8.182 487 HA3 GLY 62 HA2 GLY 62 15.199 -8.567 6.600 488 H SER 63 H SER 63 16.173 -7.958 9.971 489 HA SER 63 HA SER 63 17.830 -10.315 9.955 490 HB2 SER 63 HB3 SER 63 19.129 -7.600 10.340 491 HB3 SER 63 HB2 SER 63 19.910 -9.157 10.638 492 HG SER 63 HG SER 63 18.786 -9.026 8.161 493 H TRP 64 H TRP 64 18.181 -11.078 12.000 494 HA TRP 64 HA TRP 64 16.493 -9.985 14.050 495 HB2 TRP 64 HB3 TRP 64 18.452 -12.271 14.328 496 HB3 TRP 64 HB2 TRP 64 16.994 -11.981 15.271 497 HD1 TRP 64 HD1 TRP 64 18.180 -13.436 11.960 498 HE1 TRP 64 HE1 TRP 64 16.231 -14.692 10.838 499 HE3 TRP 64 HE3 TRP 64 14.383 -12.014 15.078 500 HZ2 TRP 64 HZ2 TRP 64 13.457 -15.037 11.218 501 HZ3 TRP 64 HZ3 TRP 64 12.113 -12.853 14.628 502 HH2 TRP 64 HH2 TRP 64 11.663 -14.331 12.740 503 H THR 65 H THR 65 17.115 -8.657 15.672 504 HA THR 65 HA THR 65 19.616 -7.337 15.302 505 HB THR 65 HB THR 65 18.768 -5.906 17.226 506 HG1 THR 65 HG1 THR 65 16.811 -6.330 18.024 507 HG21 THR 65 HG21 THR 65 17.083 -4.837 15.780 508 HG22 THR 65 HG22 THR 65 17.114 -6.252 14.728 509 HG23 THR 65 HG23 THR 65 18.557 -5.252 14.902 510 H ASP 66 H ASP 66 19.919 -10.046 16.402 511 HA ASP 66 HA ASP 66 21.869 -9.362 18.401 512 HB2 ASP 66 HB3 ASP 66 19.765 -9.574 19.767 513 HB3 ASP 66 HB2 ASP 66 19.637 -11.243 19.233 514 H MET 67 H MET 67 21.445 -10.801 15.698 515 HA MET 67 HA MET 67 21.571 -13.595 16.382 516 HB2 MET 67 HB3 MET 67 20.289 -12.989 14.472 517 HB3 MET 67 HB2 MET 67 21.631 -12.106 13.763 518 HG2 MET 67 HG3 MET 67 22.794 -14.125 13.284 519 HG3 MET 67 HG2 MET 67 21.619 -15.084 14.188 520 HE1 MET 67 HE1 MET 67 21.149 -16.049 10.364 521 HE2 MET 67 HE2 MET 67 21.534 -16.675 11.967 522 HE3 MET 67 HE3 MET 67 22.652 -15.578 11.156 523 H ASP 68 H ASP 68 23.576 -13.230 17.653 524 HA ASP 68 HA ASP 68 25.301 -15.038 16.350 525 HB2 ASP 68 HB3 ASP 68 26.450 -13.026 15.523 526 HB3 ASP 68 HB2 ASP 68 26.552 -12.393 17.164 527 H THR 69 H THR 69 24.688 -16.393 18.042 528 HA THR 69 HA THR 69 25.680 -15.702 20.685 529 HB THR 69 HB THR 69 22.768 -16.384 20.551 530 HG1 THR 69 HG1 THR 69 22.934 -13.749 20.780 531 HG21 THR 69 HG21 THR 69 24.410 -14.688 22.434 532 HG22 THR 69 HG22 THR 69 23.879 -16.345 22.726 533 HG23 THR 69 HG23 THR 69 22.691 -15.045 22.607 534 HA PRO 70 HA PRO 70 25.825 -20.217 20.507 535 HB2 PRO 70 HB3 PRO 70 27.598 -20.076 22.779 536 HB3 PRO 70 HB2 PRO 70 27.983 -20.526 21.117 537 HG2 PRO 70 HG3 PRO 70 28.888 -18.241 22.325 538 HG3 PRO 70 HG2 PRO 70 28.683 -18.424 20.575 539 HD2 PRO 70 HD3 PRO 70 26.891 -17.084 22.562 540 HD3 PRO 70 HD2 PRO 70 27.323 -16.583 20.912 541 H SER 71 H SER 71 23.793 -20.728 21.267 542 HA SER 71 HA SER 71 23.011 -20.168 23.972 543 HB2 SER 71 HB3 SER 71 21.055 -21.754 23.165 544 HB3 SER 71 HB2 SER 71 21.180 -20.095 22.580 545 HG SER 71 HG SER 71 21.626 -22.496 21.251 546 H ARG 72 H ARG 72 23.593 -21.318 25.653 547 HA ARG 72 HA ARG 72 24.736 -23.962 25.306 548 HB2 ARG 72 HB3 ARG 72 25.399 -23.696 27.690 549 HB3 ARG 72 HB2 ARG 72 25.989 -22.403 26.657 550 HG2 ARG 72 HG3 ARG 72 24.059 -21.010 27.427 551 HG3 ARG 72 HG2 ARG 72 23.678 -22.287 28.583 552 HD2 ARG 72 HD3 ARG 72 24.974 -20.528 29.646 553 HD3 ARG 72 HD2 ARG 72 25.895 -22.030 29.588 554 HE ARG 72 HE ARG 72 26.616 -20.639 27.324 555 HH11 ARG 72 HH11 ARG 72 26.699 -20.012 30.779 556 HH12 ARG 72 HH12 ARG 72 28.139 -19.034 30.682 557 HH21 ARG 72 HH21 ARG 72 28.478 -19.362 27.205 558 HH22 ARG 72 HH22 ARG 72 29.173 -18.699 28.655 559 H CYS 73 H CYS 73 23.755 -25.811 25.809 560 HA CYS 73 HA CYS 73 21.041 -25.736 26.823 561 HB2 CYS 73 HB3 CYS 73 22.756 -28.120 26.074 562 HB3 CYS 73 HB2 CYS 73 21.026 -28.151 26.396 563 H VAL 74 H VAL 74 20.843 -25.423 28.945 564 HA VAL 74 HA VAL 74 22.436 -27.119 30.741 565 HB VAL 74 HB VAL 74 21.691 -24.243 31.306 566 HG11 VAL 74 HG11 VAL 74 23.064 -24.489 33.307 567 HG12 VAL 74 HG12 VAL 74 23.356 -26.182 32.908 568 HG13 VAL 74 HG13 VAL 74 21.727 -25.638 33.312 569 HG21 VAL 74 HG21 VAL 74 23.462 -24.355 29.648 570 HG22 VAL 74 HG22 VAL 74 24.380 -25.452 30.679 571 HG23 VAL 74 HG23 VAL 74 24.101 -23.789 31.192 572 H ARG 75 H ARG 75 20.699 -28.528 30.758 573 HA ARG 75 HA ARG 75 18.805 -28.159 32.804 574 HB2 ARG 75 HB3 ARG 75 17.607 -26.761 31.208 575 HB3 ARG 75 HB2 ARG 75 17.738 -27.997 29.968 576 HG2 ARG 75 HG3 ARG 75 16.314 -28.611 32.525 577 HG3 ARG 75 HG2 ARG 75 15.505 -27.677 31.263 578 HD2 ARG 75 HD3 ARG 75 15.734 -29.446 29.692 579 HD3 ARG 75 HD2 ARG 75 16.833 -30.331 30.747 580 HE ARG 75 HE ARG 75 13.925 -30.103 31.042 581 HH11 ARG 75 HH11 ARG 75 16.979 -31.372 32.211 582 HH12 ARG 75 HH12 ARG 75 16.250 -32.720 33.036 583 HH21 ARG 75 HH21 ARG 75 12.958 -31.872 32.120 584 HH22 ARG 75 HH22 ARG 75 13.961 -32.984 33.018 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 11.129 0.149 -5.647 2 H2 GLY 1 HT2 GLY 1 10.196 0.232 -4.234 3 H3 GLY 1 HT3 GLY 1 9.456 -0.099 -5.721 4 HA2 GLY 1 HA2 GLY 1 10.537 -2.206 -5.884 5 HA3 GLY 1 HA3 GLY 1 11.463 -1.852 -4.431 6 HA PRO 2 HA PRO 2 7.071 -3.611 -3.461 7 HB2 PRO 2 HB3 PRO 2 7.963 -6.331 -4.086 8 HB3 PRO 2 HB2 PRO 2 6.482 -5.500 -4.571 9 HG2 PRO 2 HG3 PRO 2 8.447 -6.074 -6.326 10 HG3 PRO 2 HG2 PRO 2 7.437 -4.623 -6.471 11 HD2 PRO 2 HD3 PRO 2 10.223 -4.895 -5.393 12 HD3 PRO 2 HD2 PRO 2 9.540 -3.635 -6.445 13 H THR 3 H THR 3 7.807 -3.062 -1.409 14 HA THR 3 HA THR 3 9.849 -4.711 -0.165 15 HB THR 3 HB THR 3 9.575 -3.011 1.725 16 HG1 THR 3 HG1 THR 3 7.462 -2.285 0.884 17 HG21 THR 3 HG21 THR 3 10.424 -2.068 -1.018 18 HG22 THR 3 HG22 THR 3 11.432 -2.922 0.151 19 HG23 THR 3 HG23 THR 3 10.859 -1.292 0.505 20 H SER 4 H SER 4 8.890 -6.632 0.373 21 HA SER 4 HA SER 4 6.718 -6.565 2.322 22 HB2 SER 4 HB3 SER 4 8.209 -8.921 1.122 23 HB3 SER 4 HB2 SER 4 6.792 -9.023 2.168 24 HG SER 4 HG SER 4 5.559 -8.612 0.524 25 H GLU 5 H GLU 5 7.342 -6.100 4.341 26 HA GLU 5 HA GLU 5 10.126 -6.296 5.040 27 HB2 GLU 5 HB3 GLU 5 7.795 -5.412 6.744 28 HB3 GLU 5 HB2 GLU 5 9.499 -5.156 7.094 29 HG2 GLU 5 HG3 GLU 5 9.682 -3.794 5.047 30 HG3 GLU 5 HG2 GLU 5 7.948 -3.991 4.797 31 H GLY 6 H GLY 6 10.795 -8.306 5.345 32 HA2 GLY 6 HA3 GLY 6 9.942 -9.654 7.746 33 HA3 GLY 6 HA2 GLY 6 9.581 -10.524 6.259 34 H CYS 7 H CYS 7 11.431 -11.119 8.491 35 HA CYS 7 HA CYS 7 14.042 -10.981 7.199 36 HB2 CYS 7 HB3 CYS 7 13.265 -12.136 9.887 37 HB3 CYS 7 HB2 CYS 7 14.905 -11.866 9.309 38 H GLN 8 H GLN 8 15.169 -12.785 6.490 39 HA GLN 8 HA GLN 8 13.567 -15.034 5.726 40 HB2 GLN 8 HB3 GLN 8 15.561 -15.864 4.629 41 HB3 GLN 8 HB2 GLN 8 15.342 -14.162 4.265 42 HG2 GLN 8 HG3 GLN 8 17.132 -13.513 5.584 43 HG3 GLN 8 HG2 GLN 8 17.129 -15.015 6.504 44 HE21 GLN 8 HE21 GLN 8 16.956 -16.746 4.199 45 HE22 GLN 8 HE22 GLN 8 18.498 -16.690 3.416 46 H ILE 9 H ILE 9 14.993 -17.254 5.935 47 HA ILE 9 HA ILE 9 14.727 -17.836 8.768 48 HB ILE 9 HB ILE 9 15.123 -19.625 6.367 49 HG12 ILE 9 HG13 ILE 9 12.733 -19.123 8.154 50 HG13 ILE 9 HG12 ILE 9 12.917 -18.570 6.494 51 HG21 ILE 9 HG21 ILE 9 14.659 -21.504 7.880 52 HG22 ILE 9 HG22 ILE 9 14.697 -20.393 9.250 53 HG23 ILE 9 HG23 ILE 9 16.154 -20.665 8.293 54 HD11 ILE 9 HD11 ILE 9 11.464 -20.500 6.613 55 HD12 ILE 9 HD12 ILE 9 12.736 -21.433 7.403 56 HD13 ILE 9 HD13 ILE 9 12.941 -20.894 5.735 57 H ILE 10 H ILE 10 16.313 -18.468 10.103 58 HA ILE 10 HA ILE 10 19.052 -17.948 9.328 59 HB ILE 10 HB ILE 10 18.016 -18.885 12.013 60 HG12 ILE 10 HG13 ILE 10 18.408 -16.031 11.091 61 HG13 ILE 10 HG12 ILE 10 16.843 -16.832 11.170 62 HG21 ILE 10 HG21 ILE 10 20.430 -19.049 11.745 63 HG22 ILE 10 HG22 ILE 10 20.023 -17.760 12.879 64 HG23 ILE 10 HG23 ILE 10 20.503 -17.365 11.229 65 HD11 ILE 10 HD11 ILE 10 17.247 -15.398 13.100 66 HD12 ILE 10 HD12 ILE 10 18.670 -16.357 13.509 67 HD13 ILE 10 HD13 ILE 10 17.066 -17.092 13.561 68 H HIS 11 H HIS 11 20.774 -19.495 9.800 69 HA HIS 11 HA HIS 11 20.043 -22.129 8.850 70 HB2 HIS 11 HB3 HIS 11 22.750 -20.951 9.514 71 HB3 HIS 11 HB2 HIS 11 22.485 -22.517 8.754 72 HD1 HIS 11 HD1 HIS 11 22.011 -22.548 6.255 73 HD2 HIS 11 HD2 HIS 11 22.196 -18.709 7.848 74 HE1 HIS 11 HE1 HIS 11 22.055 -20.989 4.279 75 HE2 HIS 11 HE2 HIS 11 22.330 -18.685 5.265 76 HA PRO 12 HA PRO 12 19.947 -24.040 12.834 77 HB2 PRO 12 HB3 PRO 12 20.403 -26.619 12.087 78 HB3 PRO 12 HB2 PRO 12 18.856 -25.799 11.842 79 HG2 PRO 12 HG3 PRO 12 21.078 -26.283 9.895 80 HG3 PRO 12 HG2 PRO 12 19.326 -26.408 9.652 81 HD2 PRO 12 HD3 PRO 12 20.772 -24.271 8.829 82 HD3 PRO 12 HD2 PRO 12 19.078 -24.145 9.345 83 HA PRO 13 HA PRO 13 24.305 -24.345 13.804 84 HB2 PRO 13 HB3 PRO 13 24.076 -24.048 16.443 85 HB3 PRO 13 HB2 PRO 13 23.702 -22.711 15.349 86 HG2 PRO 13 HG3 PRO 13 21.849 -24.548 16.798 87 HG3 PRO 13 HG2 PRO 13 21.692 -22.810 16.491 88 HD2 PRO 13 HD3 PRO 13 20.475 -24.845 15.020 89 HD3 PRO 13 HD2 PRO 13 20.675 -23.165 14.490 90 H TRP 14 H TRP 14 24.661 -25.431 16.580 91 HA TRP 14 HA TRP 14 25.145 -28.157 15.957 92 HB2 TRP 14 HB3 TRP 14 26.204 -26.499 17.738 93 HB3 TRP 14 HB2 TRP 14 24.964 -27.176 18.783 94 HD1 TRP 14 HD1 TRP 14 25.535 -30.165 17.152 95 HE1 TRP 14 HE1 TRP 14 27.475 -31.557 18.116 96 HE3 TRP 14 HE3 TRP 14 27.959 -26.481 19.736 97 HZ2 TRP 14 HZ2 TRP 14 29.737 -31.138 19.744 98 HZ3 TRP 14 HZ3 TRP 14 30.007 -27.060 20.968 99 HH2 TRP 14 HH2 TRP 14 30.879 -29.343 20.972 100 H GLU 15 H GLU 15 24.315 -29.765 17.863 101 HA GLU 15 HA GLU 15 21.852 -30.632 17.167 102 HB2 GLU 15 HB3 GLU 15 23.312 -30.975 19.771 103 HB3 GLU 15 HB2 GLU 15 21.810 -31.815 19.410 104 HG2 GLU 15 HG3 GLU 15 24.390 -32.022 17.871 105 HG3 GLU 15 HG2 GLU 15 23.695 -33.244 18.940 106 H GLY 16 H GLY 16 20.119 -29.458 17.057 107 HA2 GLY 16 HA3 GLY 16 18.431 -28.858 19.117 108 HA3 GLY 16 HA2 GLY 16 19.428 -27.415 18.937 109 H GLY 17 H GLY 17 17.498 -26.259 18.266 110 HA2 GLY 17 HA3 GLY 17 17.362 -26.134 15.427 111 HA3 GLY 17 HA2 GLY 17 15.919 -26.901 16.078 112 H ILE 18 H ILE 18 15.054 -24.903 14.922 113 HA ILE 18 HA ILE 18 15.111 -22.639 16.790 114 HB ILE 18 HB ILE 18 14.736 -22.714 13.815 115 HG12 ILE 18 HG13 ILE 18 16.483 -21.153 15.721 116 HG13 ILE 18 HG12 ILE 18 16.997 -22.486 14.689 117 HG21 ILE 18 HG21 ILE 18 14.101 -20.339 13.889 118 HG22 ILE 18 HG22 ILE 18 14.005 -20.427 15.647 119 HG23 ILE 18 HG23 ILE 18 12.890 -21.367 14.654 120 HD11 ILE 18 HD11 ILE 18 16.511 -21.119 12.707 121 HD12 ILE 18 HD12 ILE 18 17.711 -20.370 13.758 122 HD13 ILE 18 HD13 ILE 18 16.049 -19.780 13.757 123 H ARG 19 H ARG 19 13.396 -22.077 17.806 124 HA ARG 19 HA ARG 19 10.882 -23.499 17.321 125 HB2 ARG 19 HB3 ARG 19 12.148 -23.236 19.582 126 HB3 ARG 19 HB2 ARG 19 11.479 -21.614 19.579 127 HG2 ARG 19 HG3 ARG 19 9.996 -22.863 20.874 128 HG3 ARG 19 HG2 ARG 19 9.201 -22.713 19.306 129 HD2 ARG 19 HD3 ARG 19 9.824 -24.941 18.700 130 HD3 ARG 19 HD2 ARG 19 10.861 -25.093 20.120 131 HE ARG 19 HE ARG 19 7.991 -25.409 20.005 132 HH11 ARG 19 HH11 ARG 19 10.727 -24.735 22.087 133 HH12 ARG 19 HH12 ARG 19 9.937 -25.296 23.520 134 HH21 ARG 19 HH21 ARG 19 6.958 -26.164 21.883 135 HH22 ARG 19 HH22 ARG 19 7.794 -26.112 23.410 136 H TYR 20 H TYR 20 9.208 -22.442 16.363 137 HA TYR 20 HA TYR 20 9.538 -19.587 15.884 138 HB2 TYR 20 HB3 TYR 20 7.662 -21.658 14.745 139 HB3 TYR 20 HB2 TYR 20 7.474 -19.935 14.421 140 HD1 TYR 20 HD1 TYR 20 9.653 -22.867 13.896 141 HD2 TYR 20 HD2 TYR 20 8.965 -18.779 12.948 142 HE1 TYR 20 HE1 TYR 20 11.320 -23.006 12.094 143 HE2 TYR 20 HE2 TYR 20 10.635 -18.908 11.149 144 HH TYR 20 HH TYR 20 12.573 -20.266 10.525 145 H ARG 21 H ARG 21 6.923 -18.695 15.753 146 HA ARG 21 HA ARG 21 6.569 -18.317 18.594 147 HB2 ARG 21 HB3 ARG 21 6.477 -16.476 16.846 148 HB3 ARG 21 HB2 ARG 21 4.892 -17.097 16.408 149 HG2 ARG 21 HG3 ARG 21 3.983 -16.545 18.510 150 HG3 ARG 21 HG2 ARG 21 5.582 -16.268 19.208 151 HD2 ARG 21 HD3 ARG 21 5.885 -14.374 17.637 152 HD3 ARG 21 HD2 ARG 21 4.230 -14.612 17.081 153 HE ARG 21 HE ARG 21 3.476 -13.996 19.300 154 HH11 ARG 21 HH11 ARG 21 6.823 -13.299 18.554 155 HH12 ARG 21 HH12 ARG 21 6.972 -12.034 19.737 156 HH21 ARG 21 HH21 ARG 21 3.654 -12.342 20.857 157 HH22 ARG 21 HH22 ARG 21 5.159 -11.502 21.055 158 H GLY 22 H GLY 22 4.233 -19.065 15.986 159 HA2 GLY 22 HA3 GLY 22 3.072 -21.120 17.726 160 HA3 GLY 22 HA2 GLY 22 2.023 -19.812 17.196 161 H LEU 23 H LEU 23 4.453 -21.955 15.695 162 HA LEU 23 HA LEU 23 2.525 -22.357 13.502 163 HB2 LEU 23 HB3 LEU 23 5.524 -22.092 13.380 164 HB3 LEU 23 HB2 LEU 23 4.556 -22.684 12.044 165 HG LEU 23 HG LEU 23 4.267 -19.945 13.285 166 HD11 LEU 23 HD11 LEU 23 6.411 -20.146 12.168 167 HD12 LEU 23 HD12 LEU 23 5.321 -19.138 11.216 168 HD13 LEU 23 HD13 LEU 23 5.625 -20.807 10.736 169 HD21 LEU 23 HD21 LEU 23 2.213 -20.814 12.259 170 HD22 LEU 23 HD22 LEU 23 3.096 -21.121 10.763 171 HD23 LEU 23 HD23 LEU 23 2.885 -19.467 11.340 172 H THR 24 H THR 24 2.141 -24.386 12.822 173 HA THR 24 HA THR 24 3.315 -26.593 14.298 174 HB THR 24 HB THR 24 0.873 -26.536 13.768 175 HG1 THR 24 HG1 THR 24 1.424 -28.569 14.161 176 HG21 THR 24 HG21 THR 24 0.977 -25.563 11.533 177 HG22 THR 24 HG22 THR 24 0.140 -27.116 11.497 178 HG23 THR 24 HG23 THR 24 1.807 -26.999 10.932 179 H ARG 25 H ARG 25 3.843 -28.608 12.795 180 HA ARG 25 HA ARG 25 6.073 -27.701 11.211 181 HB2 ARG 25 HB3 ARG 25 6.760 -30.001 11.106 182 HB3 ARG 25 HB2 ARG 25 6.274 -29.626 12.752 183 HG2 ARG 25 HG3 ARG 25 4.113 -30.723 12.339 184 HG3 ARG 25 HG2 ARG 25 4.664 -31.148 10.715 185 HD2 ARG 25 HD3 ARG 25 6.626 -32.287 11.803 186 HD3 ARG 25 HD2 ARG 25 5.817 -32.043 13.348 187 HE ARG 25 HE ARG 25 4.212 -33.393 11.364 188 HH11 ARG 25 HH11 ARG 25 6.523 -33.740 13.956 189 HH12 ARG 25 HH12 ARG 25 6.157 -35.408 14.258 190 HH21 ARG 25 HH21 ARG 25 3.712 -35.584 11.716 191 HH22 ARG 25 HH22 ARG 25 4.532 -36.467 12.975 192 H ASP 26 H ASP 26 6.290 -29.642 9.240 193 HA ASP 26 HA ASP 26 5.816 -29.904 7.035 194 HB2 ASP 26 HB3 ASP 26 3.623 -30.748 7.428 195 HB3 ASP 26 HB2 ASP 26 3.013 -29.164 7.894 196 H GLN 27 H GLN 27 4.479 -27.009 8.508 197 HA GLN 27 HA GLN 27 5.429 -25.296 6.382 198 HB2 GLN 27 HB3 GLN 27 4.431 -24.674 9.177 199 HB3 GLN 27 HB2 GLN 27 4.782 -23.472 7.942 200 HG2 GLN 27 HG3 GLN 27 3.015 -24.357 6.543 201 HG3 GLN 27 HG2 GLN 27 2.694 -25.628 7.721 202 HE21 GLN 27 HE21 GLN 27 3.059 -23.877 10.010 203 HE22 GLN 27 HE22 GLN 27 1.654 -22.864 10.073 204 H VAL 28 H VAL 28 6.701 -23.286 7.662 205 HA VAL 28 HA VAL 28 8.671 -22.516 8.435 206 HB VAL 28 HB VAL 28 9.365 -23.095 10.594 207 HG11 VAL 28 HG11 VAL 28 7.279 -23.240 11.872 208 HG12 VAL 28 HG12 VAL 28 6.419 -23.667 10.393 209 HG13 VAL 28 HG13 VAL 28 7.185 -22.084 10.545 210 HG21 VAL 28 HG21 VAL 28 9.719 -25.489 10.324 211 HG22 VAL 28 HG22 VAL 28 7.976 -25.759 10.316 212 HG23 VAL 28 HG23 VAL 28 8.768 -25.157 11.772 213 H LYS 29 H LYS 29 8.664 -25.168 6.671 214 HA LYS 29 HA LYS 29 11.460 -25.863 7.083 215 HB2 LYS 29 HB3 LYS 29 11.115 -27.601 5.438 216 HB3 LYS 29 HB2 LYS 29 9.810 -27.652 6.612 217 HG2 LYS 29 HG3 LYS 29 8.378 -26.424 5.003 218 HG3 LYS 29 HG2 LYS 29 9.682 -26.536 3.820 219 HD2 LYS 29 HD3 LYS 29 9.596 -29.008 4.036 220 HD3 LYS 29 HD2 LYS 29 8.203 -28.832 5.105 221 HE2 LYS 29 HE3 LYS 29 8.382 -27.976 2.220 222 HE3 LYS 29 HE2 LYS 29 7.468 -29.344 2.853 223 HZ1 LYS 29 HZ1 LYS 29 5.965 -27.560 2.503 224 HZ2 LYS 29 HZ2 LYS 29 6.955 -26.458 3.327 225 HZ3 LYS 29 HZ3 LYS 29 6.175 -27.695 4.181 226 H ALA 30 H ALA 30 9.413 -24.046 4.955 227 HA ALA 30 HA ALA 30 11.739 -22.756 3.818 228 HB1 ALA 30 HB1 ALA 30 11.377 -24.618 2.274 229 HB2 ALA 30 HB2 ALA 30 11.041 -23.068 1.501 230 HB3 ALA 30 HB3 ALA 30 9.711 -24.097 2.031 231 H ILE 31 H ILE 31 11.053 -20.919 4.860 232 HA ILE 31 HA ILE 31 8.563 -19.713 3.839 233 HB ILE 31 HB ILE 31 9.996 -19.074 6.432 234 HG12 ILE 31 HG13 ILE 31 7.366 -20.505 5.982 235 HG13 ILE 31 HG12 ILE 31 8.873 -21.279 6.462 236 HG21 ILE 31 HG21 ILE 31 7.366 -18.072 5.340 237 HG22 ILE 31 HG22 ILE 31 8.861 -17.144 5.463 238 HG23 ILE 31 HG23 ILE 31 8.041 -17.691 6.925 239 HD11 ILE 31 HD11 ILE 31 7.330 -19.245 8.054 240 HD12 ILE 31 HD12 ILE 31 8.865 -19.967 8.533 241 HD13 ILE 31 HD13 ILE 31 7.430 -20.977 8.370 242 H ASN 32 H ASN 32 8.737 -17.766 2.808 243 HA ASN 32 HA ASN 32 11.348 -16.930 1.992 244 HB2 ASN 32 HB3 ASN 32 8.599 -15.776 1.521 245 HB3 ASN 32 HB2 ASN 32 10.066 -15.059 0.858 246 HD21 ASN 32 HD21 ASN 32 11.127 -16.070 -0.809 247 HD22 ASN 32 HD22 ASN 32 10.452 -17.397 -1.691 248 H PHE 33 H PHE 33 8.768 -15.214 3.781 249 HA PHE 33 HA PHE 33 10.890 -13.701 5.147 250 HB2 PHE 33 HB3 PHE 33 8.315 -12.515 4.096 251 HB3 PHE 33 HB2 PHE 33 9.575 -11.651 4.967 252 HD1 PHE 33 HD1 PHE 33 8.371 -12.720 1.783 253 HD2 PHE 33 HD2 PHE 33 11.859 -11.462 3.871 254 HE1 PHE 33 HE1 PHE 33 9.452 -12.175 -0.359 255 HE2 PHE 33 HE2 PHE 33 12.946 -10.913 1.735 256 HZ PHE 33 HZ PHE 33 11.743 -11.266 -0.384 257 H LEU 34 H LEU 34 10.698 -13.766 7.291 258 HA LEU 34 HA LEU 34 8.121 -14.396 8.515 259 HB2 LEU 34 HB3 LEU 34 10.896 -14.010 9.642 260 HB3 LEU 34 HB2 LEU 34 9.485 -14.130 10.672 261 HG LEU 34 HG LEU 34 10.547 -16.261 10.640 262 HD11 LEU 34 HD11 LEU 34 8.128 -16.329 10.617 263 HD12 LEU 34 HD12 LEU 34 8.789 -17.699 9.725 264 HD13 LEU 34 HD13 LEU 34 8.124 -16.320 8.852 265 HD21 LEU 34 HD21 LEU 34 11.860 -16.019 8.609 266 HD22 LEU 34 HD22 LEU 34 10.399 -16.150 7.631 267 HD23 LEU 34 HD23 LEU 34 10.949 -17.529 8.585 268 HA PRO 35 HA PRO 35 7.141 -10.089 8.192 269 HB2 PRO 35 HB3 PRO 35 5.054 -10.171 10.035 270 HB3 PRO 35 HB2 PRO 35 4.918 -10.516 8.308 271 HG2 PRO 35 HG3 PRO 35 5.214 -12.403 10.603 272 HG3 PRO 35 HG2 PRO 35 4.214 -12.556 9.147 273 HD2 PRO 35 HD3 PRO 35 6.499 -13.906 9.380 274 HD3 PRO 35 HD2 PRO 35 6.028 -13.188 7.823 275 H VAL 36 H VAL 36 7.200 -8.179 9.384 276 HA VAL 36 HA VAL 36 9.076 -7.974 11.406 277 HB VAL 36 HB VAL 36 8.363 -6.089 9.990 278 HG11 VAL 36 HG11 VAL 36 5.860 -6.136 11.664 279 HG12 VAL 36 HG12 VAL 36 5.982 -6.429 9.929 280 HG13 VAL 36 HG13 VAL 36 6.323 -4.825 10.580 281 HG21 VAL 36 HG21 VAL 36 9.580 -5.622 12.046 282 HG22 VAL 36 HG22 VAL 36 8.061 -5.551 12.940 283 HG23 VAL 36 HG23 VAL 36 8.413 -4.343 11.705 284 H ASP 37 H ASP 37 8.975 -7.642 13.615 285 HA ASP 37 HA ASP 37 8.213 -7.709 15.751 286 HB2 ASP 37 HB3 ASP 37 5.513 -7.792 14.432 287 HB3 ASP 37 HB2 ASP 37 5.686 -8.060 16.161 288 H TYR 38 H TYR 38 8.379 -10.114 13.634 289 HA TYR 38 HA TYR 38 7.204 -12.210 15.242 290 HB2 TYR 38 HB3 TYR 38 7.445 -12.229 12.675 291 HB3 TYR 38 HB2 TYR 38 9.129 -12.653 12.967 292 HD1 TYR 38 HD1 TYR 38 9.741 -14.868 13.572 293 HD2 TYR 38 HD2 TYR 38 5.645 -13.742 13.479 294 HE1 TYR 38 HE1 TYR 38 9.093 -17.225 13.832 295 HE2 TYR 38 HE2 TYR 38 4.984 -16.092 13.737 296 HH TYR 38 HH TYR 38 5.810 -18.278 13.484 297 H GLU 39 H GLU 39 8.310 -13.771 16.402 298 HA GLU 39 HA GLU 39 11.141 -13.258 16.961 299 HB2 GLU 39 HB3 GLU 39 8.975 -13.606 19.047 300 HB3 GLU 39 HB2 GLU 39 10.698 -13.529 19.381 301 HG2 GLU 39 HG3 GLU 39 10.810 -11.259 18.666 302 HG3 GLU 39 HG2 GLU 39 9.154 -11.312 18.064 303 H ILE 40 H ILE 40 12.336 -15.075 17.281 304 HA ILE 40 HA ILE 40 10.887 -17.624 17.530 305 HB ILE 40 HB ILE 40 12.702 -18.698 16.193 306 HG12 ILE 40 HG13 ILE 40 13.421 -15.832 15.549 307 HG13 ILE 40 HG12 ILE 40 14.417 -16.970 16.444 308 HG21 ILE 40 HG21 ILE 40 10.535 -18.198 15.209 309 HG22 ILE 40 HG22 ILE 40 11.824 -18.005 14.020 310 HG23 ILE 40 HG23 ILE 40 11.093 -16.585 14.770 311 HD11 ILE 40 HD11 ILE 40 15.168 -16.689 14.141 312 HD12 ILE 40 HD12 ILE 40 13.603 -17.261 13.564 313 HD13 ILE 40 HD13 ILE 40 14.662 -18.347 14.467 314 H GLU 41 H GLU 41 12.186 -19.378 18.446 315 HA GLU 41 HA GLU 41 13.969 -18.330 20.552 316 HB2 GLU 41 HB3 GLU 41 11.710 -19.093 21.302 317 HB3 GLU 41 HB2 GLU 41 12.091 -20.698 20.700 318 HG2 GLU 41 HG3 GLU 41 14.007 -20.770 22.289 319 HG3 GLU 41 HG2 GLU 41 13.447 -19.237 22.953 320 H TYR 42 H TYR 42 15.739 -19.599 21.181 321 HA TYR 42 HA TYR 42 16.637 -21.570 19.223 322 HB2 TYR 42 HB3 TYR 42 18.009 -19.948 21.342 323 HB3 TYR 42 HB2 TYR 42 18.769 -21.420 20.748 324 HD1 TYR 42 HD1 TYR 42 20.400 -21.054 19.178 325 HD2 TYR 42 HD2 TYR 42 17.005 -18.494 19.211 326 HE1 TYR 42 HE1 TYR 42 21.319 -19.821 17.258 327 HE2 TYR 42 HE2 TYR 42 17.911 -17.261 17.291 328 HH TYR 42 HH TYR 42 20.580 -18.379 15.461 329 H VAL 43 H VAL 43 15.792 -23.529 19.645 330 HA VAL 43 HA VAL 43 15.764 -24.422 22.447 331 HB VAL 43 HB VAL 43 14.093 -26.122 21.718 332 HG11 VAL 43 HG11 VAL 43 13.333 -23.239 21.259 333 HG12 VAL 43 HG12 VAL 43 13.416 -24.058 22.819 334 HG13 VAL 43 HG13 VAL 43 12.217 -24.555 21.626 335 HG21 VAL 43 HG21 VAL 43 14.617 -26.185 19.338 336 HG22 VAL 43 HG22 VAL 43 14.074 -24.517 19.159 337 HG23 VAL 43 HG23 VAL 43 12.920 -25.781 19.589 338 H CYS 44 H CYS 44 16.259 -26.621 22.897 339 HA CYS 44 HA CYS 44 18.368 -27.675 21.165 340 HB2 CYS 44 HB3 CYS 44 18.561 -27.214 23.727 341 HB3 CYS 44 HB2 CYS 44 17.629 -28.690 23.905 342 H ARG 45 H ARG 45 18.346 -30.100 20.817 343 HA ARG 45 HA ARG 45 15.854 -30.766 19.662 344 HB2 ARG 45 HB3 ARG 45 18.512 -32.012 19.819 345 HB3 ARG 45 HB2 ARG 45 17.173 -33.131 19.604 346 HG2 ARG 45 HG3 ARG 45 17.714 -30.739 17.857 347 HG3 ARG 45 HG2 ARG 45 18.176 -32.401 17.476 348 HD2 ARG 45 HD3 ARG 45 15.865 -33.089 17.471 349 HD3 ARG 45 HD2 ARG 45 15.351 -31.491 18.003 350 HE ARG 45 HE ARG 45 16.717 -31.093 15.633 351 HH11 ARG 45 HH11 ARG 45 13.903 -32.928 16.638 352 HH12 ARG 45 HH12 ARG 45 13.086 -32.757 15.119 353 HH21 ARG 45 HH21 ARG 45 15.634 -30.848 13.632 354 HH22 ARG 45 HH22 ARG 45 14.056 -31.547 13.426 355 H GLY 46 H GLY 46 14.109 -31.475 20.612 356 HA2 GLY 46 HA3 GLY 46 12.979 -33.301 21.697 357 HA3 GLY 46 HA2 GLY 46 14.362 -33.457 22.773 358 H GLU 47 H GLU 47 13.415 -33.151 24.725 359 HA GLU 47 HA GLU 47 11.909 -30.662 25.147 360 HB2 GLU 47 HB3 GLU 47 11.357 -31.578 27.357 361 HB3 GLU 47 HB2 GLU 47 10.890 -32.683 26.074 362 HG2 GLU 47 HG3 GLU 47 12.765 -34.098 26.526 363 HG3 GLU 47 HG2 GLU 47 13.419 -32.935 27.681 364 H ARG 48 H ARG 48 14.788 -30.972 24.627 365 HA ARG 48 HA ARG 48 16.086 -30.221 27.113 366 HB2 ARG 48 HB3 ARG 48 17.204 -30.404 24.303 367 HB3 ARG 48 HB2 ARG 48 18.137 -30.276 25.787 368 HG2 ARG 48 HG3 ARG 48 16.282 -32.549 25.656 369 HG3 ARG 48 HG2 ARG 48 17.622 -32.591 24.508 370 HD2 ARG 48 HD3 ARG 48 18.016 -32.063 27.443 371 HD3 ARG 48 HD2 ARG 48 18.002 -33.690 26.764 372 HE ARG 48 HE ARG 48 19.850 -32.669 25.238 373 HH11 ARG 48 HH11 ARG 48 19.345 -31.982 28.639 374 HH12 ARG 48 HH12 ARG 48 21.037 -31.705 28.960 375 HH21 ARG 48 HH21 ARG 48 22.060 -32.301 25.662 376 HH22 ARG 48 HH22 ARG 48 22.585 -31.912 27.272 377 H GLU 49 H GLU 49 16.641 -28.155 27.634 378 HA GLU 49 HA GLU 49 15.957 -26.089 25.654 379 HB2 GLU 49 HB3 GLU 49 15.765 -25.937 28.662 380 HB3 GLU 49 HB2 GLU 49 15.488 -24.591 27.568 381 HG2 GLU 49 HG3 GLU 49 13.694 -26.089 26.512 382 HG3 GLU 49 HG2 GLU 49 13.833 -27.036 27.994 383 H VAL 50 H VAL 50 17.070 -24.000 26.086 384 HA VAL 50 HA VAL 50 19.822 -24.429 27.038 385 HB VAL 50 HB VAL 50 20.547 -22.650 25.532 386 HG11 VAL 50 HG11 VAL 50 20.212 -23.758 23.375 387 HG12 VAL 50 HG12 VAL 50 18.908 -24.720 24.073 388 HG13 VAL 50 HG13 VAL 50 20.560 -24.922 24.652 389 HG21 VAL 50 HG21 VAL 50 19.037 -21.662 23.886 390 HG22 VAL 50 HG22 VAL 50 18.519 -21.302 25.534 391 HG23 VAL 50 HG23 VAL 50 17.684 -22.541 24.597 392 H VAL 51 H VAL 51 20.701 -22.808 28.389 393 HA VAL 51 HA VAL 51 18.759 -20.774 29.247 394 HB VAL 51 HB VAL 51 19.471 -22.031 31.145 395 HG11 VAL 51 HG11 VAL 51 21.817 -22.294 31.800 396 HG12 VAL 51 HG12 VAL 51 22.313 -21.514 30.297 397 HG13 VAL 51 HG13 VAL 51 21.467 -23.062 30.251 398 HG21 VAL 51 HG21 VAL 51 20.550 -20.323 32.535 399 HG22 VAL 51 HG22 VAL 51 19.277 -19.643 31.522 400 HG23 VAL 51 HG23 VAL 51 20.969 -19.416 31.081 401 H GLY 52 H GLY 52 18.986 -19.250 27.786 402 HA2 GLY 52 HA3 GLY 52 21.457 -17.739 27.696 403 HA3 GLY 52 HA2 GLY 52 21.003 -18.515 26.184 404 HA PRO 53 HA PRO 53 18.594 -14.490 26.463 405 HB2 PRO 53 HB3 PRO 53 20.045 -13.036 24.691 406 HB3 PRO 53 HB2 PRO 53 20.350 -13.000 26.431 407 HG2 PRO 53 HG3 PRO 53 21.805 -14.469 24.278 408 HG3 PRO 53 HG2 PRO 53 22.449 -13.639 25.705 409 HD2 PRO 53 HD3 PRO 53 22.118 -16.350 25.527 410 HD3 PRO 53 HD2 PRO 53 22.112 -15.449 27.057 411 H LYS 54 H LYS 54 17.920 -16.770 25.334 412 HA LYS 54 HA LYS 54 18.209 -17.005 22.525 413 HB2 LYS 54 HB3 LYS 54 16.441 -18.797 22.801 414 HB3 LYS 54 HB2 LYS 54 17.885 -19.002 23.785 415 HG2 LYS 54 HG3 LYS 54 16.749 -18.232 25.742 416 HG3 LYS 54 HG2 LYS 54 15.338 -17.759 24.796 417 HD2 LYS 54 HD3 LYS 54 15.021 -20.142 24.178 418 HD3 LYS 54 HD2 LYS 54 16.347 -20.561 25.266 419 HE2 LYS 54 HE3 LYS 54 15.136 -19.700 27.157 420 HE3 LYS 54 HE2 LYS 54 13.858 -19.084 26.110 421 HZ1 LYS 54 HZ1 LYS 54 13.074 -21.087 27.040 422 HZ2 LYS 54 HZ2 LYS 54 14.512 -21.908 26.708 423 HZ3 LYS 54 HZ3 LYS 54 13.483 -21.458 25.433 424 H VAL 55 H VAL 55 17.467 -15.069 21.590 425 HA VAL 55 HA VAL 55 14.687 -15.229 20.914 426 HB VAL 55 HB VAL 55 14.491 -13.898 22.950 427 HG11 VAL 55 HG11 VAL 55 15.473 -11.644 23.081 428 HG12 VAL 55 HG12 VAL 55 16.380 -11.977 21.604 429 HG13 VAL 55 HG13 VAL 55 16.691 -12.920 23.062 430 HG21 VAL 55 HG21 VAL 55 12.946 -13.443 21.135 431 HG22 VAL 55 HG22 VAL 55 14.067 -12.263 20.455 432 HG23 VAL 55 HG23 VAL 55 13.315 -11.963 22.022 433 H ARG 56 H ARG 56 14.423 -14.711 18.875 434 HA ARG 56 HA ARG 56 16.310 -12.806 17.655 435 HB2 ARG 56 HB3 ARG 56 14.940 -15.173 16.363 436 HB3 ARG 56 HB2 ARG 56 15.849 -13.949 15.488 437 HG2 ARG 56 HG3 ARG 56 16.951 -15.794 17.589 438 HG3 ARG 56 HG2 ARG 56 17.169 -15.951 15.845 439 HD2 ARG 56 HD3 ARG 56 18.325 -13.819 15.779 440 HD3 ARG 56 HD2 ARG 56 18.070 -13.610 17.510 441 HE ARG 56 HE ARG 56 19.756 -15.724 16.324 442 HH11 ARG 56 HH11 ARG 56 18.911 -13.600 18.978 443 HH12 ARG 56 HH12 ARG 56 20.418 -13.825 19.810 444 HH21 ARG 56 HH21 ARG 56 21.718 -16.077 17.441 445 HH22 ARG 56 HH22 ARG 56 21.993 -15.259 18.958 446 H LYS 57 H LYS 57 15.324 -10.955 17.306 447 HA LYS 57 HA LYS 57 12.434 -10.995 16.802 448 HB2 LYS 57 HB3 LYS 57 13.262 -9.798 18.846 449 HB3 LYS 57 HB2 LYS 57 14.116 -8.688 17.783 450 HG2 LYS 57 HG3 LYS 57 12.024 -7.936 16.827 451 HG3 LYS 57 HG2 LYS 57 11.133 -9.114 17.798 452 HD2 LYS 57 HD3 LYS 57 12.788 -6.824 18.859 453 HD3 LYS 57 HD2 LYS 57 11.026 -6.887 18.795 454 HE2 LYS 57 HE3 LYS 57 11.052 -8.829 20.298 455 HE3 LYS 57 HE2 LYS 57 12.812 -8.744 20.369 456 HZ1 LYS 57 HZ1 LYS 57 10.928 -6.647 21.303 457 HZ2 LYS 57 HZ2 LYS 57 12.618 -6.539 21.350 458 HZ3 LYS 57 HZ3 LYS 57 11.819 -7.697 22.295 459 H CYS 58 H CYS 58 11.701 -10.323 14.893 460 HA CYS 58 HA CYS 58 13.630 -9.206 13.001 461 HB2 CYS 58 HB3 CYS 58 12.334 -11.165 12.274 462 HB3 CYS 58 HB2 CYS 58 10.837 -10.282 12.548 463 H LEU 59 H LEU 59 13.743 -7.084 12.908 464 HA LEU 59 HA LEU 59 11.379 -5.458 13.487 465 HB2 LEU 59 HB3 LEU 59 14.213 -4.529 12.999 466 HB3 LEU 59 HB2 LEU 59 12.882 -3.565 13.607 467 HG LEU 59 HG LEU 59 14.333 -5.783 15.039 468 HD11 LEU 59 HD11 LEU 59 14.006 -2.859 15.704 469 HD12 LEU 59 HD12 LEU 59 15.430 -3.572 14.949 470 HD13 LEU 59 HD13 LEU 59 14.971 -4.044 16.586 471 HD21 LEU 59 HD21 LEU 59 11.946 -5.941 15.515 472 HD22 LEU 59 HD22 LEU 59 11.911 -4.230 15.942 473 HD23 LEU 59 HD23 LEU 59 12.839 -5.365 16.922 474 H ALA 60 H ALA 60 11.624 -3.279 11.997 475 HA ALA 60 HA ALA 60 10.946 -4.130 9.361 476 HB1 ALA 60 HB1 ALA 60 11.456 -1.333 10.376 477 HB2 ALA 60 HB2 ALA 60 9.907 -2.177 10.434 478 HB3 ALA 60 HB3 ALA 60 10.633 -1.769 8.879 479 H ASN 61 H ASN 61 13.294 -5.205 9.542 480 HA ASN 61 HA ASN 61 14.845 -3.940 7.491 481 HB2 ASN 61 HB3 ASN 61 16.950 -3.786 8.708 482 HB3 ASN 61 HB2 ASN 61 15.739 -2.798 9.518 483 HD21 ASN 61 HD21 ASN 61 17.811 -5.534 9.739 484 HD22 ASN 61 HD22 ASN 61 17.489 -5.915 11.396 485 H GLY 62 H GLY 62 16.839 -5.448 7.034 486 HA2 GLY 62 HA3 GLY 62 15.585 -8.081 6.860 487 HA3 GLY 62 HA2 GLY 62 16.912 -7.498 5.873 488 H SER 63 H SER 63 16.552 -7.718 9.418 489 HA SER 63 HA SER 63 18.397 -9.920 9.601 490 HB2 SER 63 HB3 SER 63 19.273 -7.222 10.672 491 HB3 SER 63 HB2 SER 63 20.130 -8.747 10.880 492 HG SER 63 HG SER 63 19.671 -8.358 8.273 493 H TRP 64 H TRP 64 18.004 -11.046 11.437 494 HA TRP 64 HA TRP 64 16.155 -10.101 13.399 495 HB2 TRP 64 HB3 TRP 64 18.085 -12.434 13.583 496 HB3 TRP 64 HB2 TRP 64 16.670 -12.171 14.595 497 HD1 TRP 64 HD1 TRP 64 17.634 -13.214 11.024 498 HE1 TRP 64 HE1 TRP 64 15.639 -14.455 9.961 499 HE3 TRP 64 HE3 TRP 64 14.157 -12.439 14.687 500 HZ2 TRP 64 HZ2 TRP 64 12.950 -15.022 10.599 501 HZ3 TRP 64 HZ3 TRP 64 11.899 -13.362 14.386 502 HH2 TRP 64 HH2 TRP 64 11.310 -14.628 12.382 503 H THR 65 H THR 65 16.591 -8.920 15.194 504 HA THR 65 HA THR 65 19.086 -7.537 15.076 505 HB THR 65 HB THR 65 18.020 -6.187 16.956 506 HG1 THR 65 HG1 THR 65 16.392 -7.355 17.758 507 HG21 THR 65 HG21 THR 65 16.560 -5.050 15.361 508 HG22 THR 65 HG22 THR 65 16.625 -6.447 14.291 509 HG23 THR 65 HG23 THR 65 18.085 -5.506 14.603 510 H ASP 66 H ASP 66 19.498 -10.246 16.132 511 HA ASP 66 HA ASP 66 21.192 -9.395 18.289 512 HB2 ASP 66 HB3 ASP 66 18.981 -9.815 19.448 513 HB3 ASP 66 HB2 ASP 66 19.143 -11.503 18.998 514 H MET 67 H MET 67 21.344 -10.862 15.609 515 HA MET 67 HA MET 67 21.677 -13.635 16.333 516 HB2 MET 67 HB3 MET 67 22.334 -12.238 13.736 517 HB3 MET 67 HB2 MET 67 22.336 -13.978 13.984 518 HG2 MET 67 HG3 MET 67 19.944 -13.895 14.488 519 HG3 MET 67 HG2 MET 67 19.953 -12.158 14.203 520 HE1 MET 67 HE1 MET 67 20.608 -11.081 11.813 521 HE2 MET 67 HE2 MET 67 20.943 -12.051 10.378 522 HE3 MET 67 HE3 MET 67 22.064 -12.074 11.738 523 H ASP 68 H ASP 68 23.344 -13.082 17.983 524 HA ASP 68 HA ASP 68 25.561 -14.553 17.019 525 HB2 ASP 68 HB3 ASP 68 26.305 -12.152 16.536 526 HB3 ASP 68 HB2 ASP 68 26.305 -11.903 18.282 527 H THR 69 H THR 69 24.868 -16.075 18.597 528 HA THR 69 HA THR 69 25.074 -15.189 21.375 529 HB THR 69 HB THR 69 22.517 -16.509 20.493 530 HG1 THR 69 HG1 THR 69 22.896 -13.696 20.821 531 HG21 THR 69 HG21 THR 69 22.954 -16.541 22.869 532 HG22 THR 69 HG22 THR 69 21.650 -15.397 22.523 533 HG23 THR 69 HG23 THR 69 23.277 -14.807 22.859 534 HA PRO 70 HA PRO 70 26.199 -19.520 21.681 535 HB2 PRO 70 HB3 PRO 70 27.496 -19.092 24.117 536 HB3 PRO 70 HB2 PRO 70 28.246 -19.027 22.524 537 HG2 PRO 70 HG3 PRO 70 27.855 -16.874 24.328 538 HG3 PRO 70 HG2 PRO 70 28.469 -16.789 22.672 539 HD2 PRO 70 HD3 PRO 70 25.752 -16.220 23.708 540 HD3 PRO 70 HD2 PRO 70 26.576 -15.577 22.271 541 H SER 71 H SER 71 24.031 -20.203 22.063 542 HA SER 71 HA SER 71 22.991 -19.994 24.770 543 HB2 SER 71 HB3 SER 71 21.769 -21.316 22.337 544 HB3 SER 71 HB2 SER 71 20.948 -20.942 23.854 545 HG SER 71 HG SER 71 22.191 -18.778 22.732 546 H ARG 72 H ARG 72 23.447 -21.470 26.239 547 HA ARG 72 HA ARG 72 24.709 -23.958 25.432 548 HB2 ARG 72 HB3 ARG 72 25.151 -24.185 27.897 549 HB3 ARG 72 HB2 ARG 72 25.846 -22.753 27.151 550 HG2 ARG 72 HG3 ARG 72 23.889 -21.455 27.986 551 HG3 ARG 72 HG2 ARG 72 23.374 -22.893 28.865 552 HD2 ARG 72 HD3 ARG 72 24.576 -21.437 30.360 553 HD3 ARG 72 HD2 ARG 72 25.541 -22.882 30.064 554 HE ARG 72 HE ARG 72 26.729 -21.408 28.358 555 HH11 ARG 72 HH11 ARG 72 25.301 -20.188 31.318 556 HH12 ARG 72 HH12 ARG 72 26.404 -18.846 31.439 557 HH21 ARG 72 HH21 ARG 72 28.171 -19.641 28.508 558 HH22 ARG 72 HH22 ARG 72 28.024 -18.533 29.842 559 H CYS 73 H CYS 73 23.611 -25.767 25.196 560 HA CYS 73 HA CYS 73 20.883 -26.046 26.009 561 HB2 CYS 73 HB3 CYS 73 21.678 -27.101 23.955 562 HB3 CYS 73 HB2 CYS 73 22.842 -28.056 24.863 563 H VAL 74 H VAL 74 20.417 -26.232 28.089 564 HA VAL 74 HA VAL 74 21.801 -28.266 29.689 565 HB VAL 74 HB VAL 74 21.163 -25.479 30.687 566 HG11 VAL 74 HG11 VAL 74 22.279 -26.188 32.753 567 HG12 VAL 74 HG12 VAL 74 22.444 -27.816 32.095 568 HG13 VAL 74 HG13 VAL 74 20.842 -27.152 32.416 569 HG21 VAL 74 HG21 VAL 74 23.829 -26.789 30.166 570 HG22 VAL 74 HG22 VAL 74 23.596 -25.224 30.943 571 HG23 VAL 74 HG23 VAL 74 23.123 -25.450 29.258 572 H ARG 75 H ARG 75 20.136 -29.669 29.759 573 HA ARG 75 HA ARG 75 18.165 -29.372 31.694 574 HB2 ARG 75 HB3 ARG 75 16.942 -27.910 30.225 575 HB3 ARG 75 HB2 ARG 75 17.134 -29.017 28.872 576 HG2 ARG 75 HG3 ARG 75 15.493 -30.417 29.600 577 HG3 ARG 75 HG2 ARG 75 15.750 -30.021 31.300 578 HD2 ARG 75 HD3 ARG 75 14.548 -28.113 29.300 579 HD3 ARG 75 HD2 ARG 75 13.594 -29.182 30.328 580 HE ARG 75 HE ARG 75 15.478 -27.516 31.749 581 HH11 ARG 75 HH11 ARG 75 12.229 -27.666 30.427 582 HH12 ARG 75 HH12 ARG 75 11.573 -26.553 31.595 583 HH21 ARG 75 HH21 ARG 75 14.615 -26.091 33.288 584 HH22 ARG 75 HH22 ARG 75 12.925 -25.682 33.239 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 -0.986 -2.623 -3.311 2 H2 GLY 1 HT2 GLY 1 -0.591 -3.625 -2.006 3 H3 GLY 1 HT3 GLY 1 -0.276 -4.132 -3.590 4 HA2 GLY 1 HA2 GLY 1 1.343 -2.358 -3.871 5 HA3 GLY 1 HA3 GLY 1 1.013 -1.828 -2.227 6 HA PRO 2 HA PRO 2 3.989 -5.565 -2.375 7 HB2 PRO 2 HB3 PRO 2 6.301 -4.328 -3.482 8 HB3 PRO 2 HB2 PRO 2 5.310 -5.597 -4.199 9 HG2 PRO 2 HG3 PRO 2 5.537 -2.989 -5.145 10 HG3 PRO 2 HG2 PRO 2 4.256 -4.133 -5.574 11 HD2 PRO 2 HD3 PRO 2 4.216 -1.880 -3.625 12 HD3 PRO 2 HD2 PRO 2 2.916 -2.504 -4.662 13 H THR 3 H THR 3 3.786 -4.961 -0.132 14 HA THR 3 HA THR 3 6.147 -3.509 0.848 15 HB THR 3 HB THR 3 4.780 -3.203 2.972 16 HG1 THR 3 HG1 THR 3 2.902 -4.162 2.981 17 HG21 THR 3 HG21 THR 3 3.769 -1.884 0.448 18 HG22 THR 3 HG22 THR 3 5.177 -1.379 1.383 19 HG23 THR 3 HG23 THR 3 3.565 -1.269 2.089 20 H SER 4 H SER 4 7.613 -5.085 1.194 21 HA SER 4 HA SER 4 6.789 -7.335 2.916 22 HB2 SER 4 HB3 SER 4 8.830 -7.507 0.695 23 HB3 SER 4 HB2 SER 4 8.198 -8.834 1.669 24 HG SER 4 HG SER 4 6.107 -8.337 0.746 25 H GLU 5 H GLU 5 7.627 -6.601 4.809 26 HA GLU 5 HA GLU 5 10.549 -6.287 4.880 27 HB2 GLU 5 HB3 GLU 5 8.498 -4.988 6.690 28 HB3 GLU 5 HB2 GLU 5 10.242 -4.859 6.878 29 HG2 GLU 5 HG3 GLU 5 10.417 -3.713 4.749 30 HG3 GLU 5 HG2 GLU 5 8.685 -3.900 4.485 31 H GLY 6 H GLY 6 11.292 -8.204 5.542 32 HA2 GLY 6 HA3 GLY 6 10.411 -9.280 8.060 33 HA3 GLY 6 HA2 GLY 6 9.949 -10.257 6.677 34 H CYS 7 H CYS 7 11.449 -11.418 8.494 35 HA CYS 7 HA CYS 7 14.229 -11.326 7.543 36 HB2 CYS 7 HB3 CYS 7 13.091 -12.590 10.049 37 HB3 CYS 7 HB2 CYS 7 14.796 -12.428 9.646 38 H GLN 8 H GLN 8 15.270 -13.299 6.937 39 HA GLN 8 HA GLN 8 13.428 -15.237 5.832 40 HB2 GLN 8 HB3 GLN 8 15.382 -16.219 4.769 41 HB3 GLN 8 HB2 GLN 8 15.340 -14.487 4.488 42 HG2 GLN 8 HG3 GLN 8 17.102 -14.089 5.979 43 HG3 GLN 8 HG2 GLN 8 16.963 -15.688 6.704 44 HE21 GLN 8 HE21 GLN 8 16.737 -17.078 4.171 45 HE22 GLN 8 HE22 GLN 8 18.296 -17.047 3.444 46 H ILE 9 H ILE 9 14.402 -17.607 5.917 47 HA ILE 9 HA ILE 9 14.392 -18.380 8.718 48 HB ILE 9 HB ILE 9 14.195 -19.956 6.150 49 HG12 ILE 9 HG13 ILE 9 12.262 -19.426 8.418 50 HG13 ILE 9 HG12 ILE 9 12.174 -18.763 6.789 51 HG21 ILE 9 HG21 ILE 9 13.852 -21.971 7.508 52 HG22 ILE 9 HG22 ILE 9 14.237 -21.049 8.962 53 HG23 ILE 9 HG23 ILE 9 15.469 -21.299 7.723 54 HD11 ILE 9 HD11 ILE 9 10.578 -20.553 7.069 55 HD12 ILE 9 HD12 ILE 9 11.865 -21.657 7.558 56 HD13 ILE 9 HD13 ILE 9 11.822 -21.026 5.912 57 H ILE 10 H ILE 10 16.010 -19.532 9.720 58 HA ILE 10 HA ILE 10 18.676 -19.165 8.557 59 HB ILE 10 HB ILE 10 18.036 -19.888 11.420 60 HG12 ILE 10 HG13 ILE 10 18.374 -17.088 10.333 61 HG13 ILE 10 HG12 ILE 10 16.806 -17.818 10.658 62 HG21 ILE 10 HG21 ILE 10 20.389 -18.469 10.171 63 HG22 ILE 10 HG22 ILE 10 20.369 -20.143 10.726 64 HG23 ILE 10 HG23 ILE 10 20.191 -18.827 11.887 65 HD11 ILE 10 HD11 ILE 10 17.497 -16.360 12.466 66 HD12 ILE 10 HD12 ILE 10 18.968 -17.310 12.685 67 HD13 ILE 10 HD13 ILE 10 17.395 -18.035 13.012 68 H HIS 11 H HIS 11 20.290 -20.930 9.159 69 HA HIS 11 HA HIS 11 19.129 -23.523 8.509 70 HB2 HIS 11 HB3 HIS 11 22.027 -22.680 8.769 71 HB3 HIS 11 HB2 HIS 11 21.473 -24.257 8.227 72 HD1 HIS 11 HD1 HIS 11 20.748 -24.484 5.803 73 HD2 HIS 11 HD2 HIS 11 21.660 -20.576 6.897 74 HE1 HIS 11 HE1 HIS 11 20.848 -23.179 3.649 75 HE2 HIS 11 HE2 HIS 11 21.640 -20.882 4.331 76 HA PRO 12 HA PRO 12 19.499 -24.902 12.752 77 HB2 PRO 12 HB3 PRO 12 19.217 -27.566 12.305 78 HB3 PRO 12 HB2 PRO 12 17.853 -26.442 12.277 79 HG2 PRO 12 HG3 PRO 12 19.391 -27.618 10.001 80 HG3 PRO 12 HG2 PRO 12 17.645 -27.356 10.155 81 HD2 PRO 12 HD3 PRO 12 19.281 -25.702 8.740 82 HD3 PRO 12 HD2 PRO 12 17.796 -25.147 9.535 83 HA PRO 13 HA PRO 13 23.855 -25.912 12.143 84 HB2 PRO 13 HB3 PRO 13 24.655 -24.460 14.373 85 HB3 PRO 13 HB2 PRO 13 24.513 -23.832 12.733 86 HG2 PRO 13 HG3 PRO 13 22.928 -23.157 15.006 87 HG3 PRO 13 HG2 PRO 13 22.746 -22.570 13.348 88 HD2 PRO 13 HD3 PRO 13 21.241 -24.669 14.778 89 HD3 PRO 13 HD2 PRO 13 20.768 -23.698 13.369 90 H TRP 14 H TRP 14 23.241 -25.484 15.603 91 HA TRP 14 HA TRP 14 24.558 -28.058 16.066 92 HB2 TRP 14 HB3 TRP 14 25.387 -25.824 17.085 93 HB3 TRP 14 HB2 TRP 14 24.014 -25.973 18.176 94 HD1 TRP 14 HD1 TRP 14 24.516 -27.221 20.360 95 HE1 TRP 14 HE1 TRP 14 26.325 -28.865 21.176 96 HE3 TRP 14 HE3 TRP 14 27.072 -27.845 15.975 97 HZ2 TRP 14 HZ2 TRP 14 28.546 -30.238 20.094 98 HZ3 TRP 14 HZ3 TRP 14 29.027 -29.340 15.951 99 HH2 TRP 14 HH2 TRP 14 29.747 -30.510 17.970 100 H GLU 15 H GLU 15 23.730 -28.878 18.426 101 HA GLU 15 HA GLU 15 21.303 -30.117 18.117 102 HB2 GLU 15 HB3 GLU 15 22.507 -29.274 20.759 103 HB3 GLU 15 HB2 GLU 15 21.370 -30.589 20.500 104 HG2 GLU 15 HG3 GLU 15 24.159 -30.463 19.377 105 HG3 GLU 15 HG2 GLU 15 23.679 -31.362 20.814 106 H GLY 16 H GLY 16 21.923 -26.888 19.314 107 HA2 GLY 16 HA3 GLY 16 19.277 -26.435 20.307 108 HA3 GLY 16 HA2 GLY 16 20.495 -25.207 19.984 109 H GLY 17 H GLY 17 17.663 -26.735 18.878 110 HA2 GLY 17 HA3 GLY 17 17.893 -25.729 16.157 111 HA3 GLY 17 HA2 GLY 17 16.573 -26.688 16.810 112 H ILE 18 H ILE 18 15.331 -25.016 15.570 113 HA ILE 18 HA ILE 18 15.094 -22.535 17.120 114 HB ILE 18 HB ILE 18 14.888 -22.956 14.153 115 HG12 ILE 18 HG13 ILE 18 16.479 -21.158 15.972 116 HG13 ILE 18 HG12 ILE 18 17.091 -22.531 15.054 117 HG21 ILE 18 HG21 ILE 18 13.962 -20.541 15.714 118 HG22 ILE 18 HG22 ILE 18 12.947 -21.622 14.758 119 HG23 ILE 18 HG23 ILE 18 14.153 -20.609 13.963 120 HD11 ILE 18 HD11 ILE 18 16.596 -21.336 12.965 121 HD12 ILE 18 HD12 ILE 18 17.738 -20.465 13.986 122 HD13 ILE 18 HD13 ILE 18 16.054 -19.945 13.904 123 H ARG 19 H ARG 19 13.227 -21.811 17.738 124 HA ARG 19 HA ARG 19 10.835 -23.448 17.214 125 HB2 ARG 19 HB3 ARG 19 11.890 -23.427 19.538 126 HB3 ARG 19 HB2 ARG 19 11.399 -21.747 19.638 127 HG2 ARG 19 HG3 ARG 19 9.815 -23.233 20.773 128 HG3 ARG 19 HG2 ARG 19 9.067 -22.355 19.436 129 HD2 ARG 19 HD3 ARG 19 9.131 -24.286 18.041 130 HD3 ARG 19 HD2 ARG 19 10.137 -25.161 19.193 131 HE ARG 19 HE ARG 19 8.150 -25.056 20.718 132 HH11 ARG 19 HH11 ARG 19 7.708 -24.818 17.248 133 HH12 ARG 19 HH12 ARG 19 6.122 -25.520 17.272 134 HH21 ARG 19 HH21 ARG 19 6.100 -26.006 20.753 135 HH22 ARG 19 HH22 ARG 19 5.212 -26.230 19.270 136 H TYR 20 H TYR 20 9.083 -22.347 16.410 137 HA TYR 20 HA TYR 20 9.478 -19.509 15.904 138 HB2 TYR 20 HB3 TYR 20 7.584 -21.559 14.772 139 HB3 TYR 20 HB2 TYR 20 7.377 -19.835 14.467 140 HD1 TYR 20 HD1 TYR 20 9.743 -22.666 14.041 141 HD2 TYR 20 HD2 TYR 20 8.663 -18.735 12.830 142 HE1 TYR 20 HE1 TYR 20 11.383 -22.780 12.211 143 HE2 TYR 20 HE2 TYR 20 10.293 -18.843 10.998 144 HH TYR 20 HH TYR 20 12.348 -20.051 10.445 145 H ARG 21 H ARG 21 6.889 -18.596 15.730 146 HA ARG 21 HA ARG 21 6.243 -18.537 18.605 147 HB2 ARG 21 HB3 ARG 21 7.298 -16.491 17.466 148 HB3 ARG 21 HB2 ARG 21 5.762 -16.298 16.641 149 HG2 ARG 21 HG3 ARG 21 5.767 -16.493 19.608 150 HG3 ARG 21 HG2 ARG 21 6.309 -14.996 18.853 151 HD2 ARG 21 HD3 ARG 21 3.639 -16.341 18.454 152 HD3 ARG 21 HD2 ARG 21 3.944 -14.878 19.391 153 HE ARG 21 HE ARG 21 3.686 -15.101 16.530 154 HH11 ARG 21 HH11 ARG 21 5.141 -13.182 19.098 155 HH12 ARG 21 HH12 ARG 21 5.071 -11.705 18.190 156 HH21 ARG 21 HH21 ARG 21 3.632 -13.162 15.339 157 HH22 ARG 21 HH22 ARG 21 4.225 -11.686 16.045 158 H GLY 22 H GLY 22 4.915 -18.351 15.339 159 HA2 GLY 22 HA3 GLY 22 2.411 -19.483 16.344 160 HA3 GLY 22 HA2 GLY 22 2.326 -17.951 15.483 161 H LEU 23 H LEU 23 4.045 -21.037 15.024 162 HA LEU 23 HA LEU 23 2.736 -21.342 12.436 163 HB2 LEU 23 HB3 LEU 23 5.711 -21.119 12.827 164 HB3 LEU 23 HB2 LEU 23 5.036 -22.014 11.478 165 HG LEU 23 HG LEU 23 4.575 -19.080 12.028 166 HD11 LEU 23 HD11 LEU 23 6.869 -19.561 11.344 167 HD12 LEU 23 HD12 LEU 23 5.985 -18.705 10.081 168 HD13 LEU 23 HD13 LEU 23 6.267 -20.440 9.937 169 HD21 LEU 23 HD21 LEU 23 3.559 -19.061 9.799 170 HD22 LEU 23 HD22 LEU 23 2.678 -20.115 10.904 171 HD23 LEU 23 HD23 LEU 23 3.757 -20.809 9.693 172 H THR 24 H THR 24 2.473 -23.424 11.811 173 HA THR 24 HA THR 24 3.132 -25.447 13.814 174 HB THR 24 HB THR 24 0.741 -25.098 13.101 175 HG1 THR 24 HG1 THR 24 1.428 -27.089 14.007 176 HG21 THR 24 HG21 THR 24 1.684 -26.360 10.525 177 HG22 THR 24 HG22 THR 24 1.163 -24.686 10.714 178 HG23 THR 24 HG23 THR 24 0.012 -26.000 10.957 179 H ARG 25 H ARG 25 3.212 -27.738 12.574 180 HA ARG 25 HA ARG 25 5.730 -27.813 11.284 181 HB2 ARG 25 HB3 ARG 25 5.193 -30.231 10.980 182 HB3 ARG 25 HB2 ARG 25 4.994 -29.665 12.633 183 HG2 ARG 25 HG3 ARG 25 2.563 -29.449 12.226 184 HG3 ARG 25 HG2 ARG 25 2.805 -30.140 10.622 185 HD2 ARG 25 HD3 ARG 25 3.587 -32.203 11.571 186 HD3 ARG 25 HD2 ARG 25 3.554 -31.512 13.195 187 HE ARG 25 HE ARG 25 0.999 -31.389 11.925 188 HH11 ARG 25 HH11 ARG 25 3.182 -33.476 13.683 189 HH12 ARG 25 HH12 ARG 25 1.924 -34.527 14.264 190 HH21 ARG 25 HH21 ARG 25 -0.676 -32.752 12.698 191 HH22 ARG 25 HH22 ARG 25 -0.270 -34.114 13.705 192 H ASP 26 H ASP 26 5.636 -29.571 9.254 193 HA ASP 26 HA ASP 26 5.358 -29.822 7.015 194 HB2 ASP 26 HB3 ASP 26 2.945 -29.962 7.449 195 HB3 ASP 26 HB2 ASP 26 2.825 -28.208 7.384 196 H GLN 27 H GLN 27 4.777 -26.596 8.245 197 HA GLN 27 HA GLN 27 6.033 -25.363 5.916 198 HB2 GLN 27 HB3 GLN 27 4.792 -24.152 8.393 199 HB3 GLN 27 HB2 GLN 27 5.363 -23.246 6.999 200 HG2 GLN 27 HG3 GLN 27 3.676 -24.173 5.606 201 HG3 GLN 27 HG2 GLN 27 3.204 -25.331 6.847 202 HE21 GLN 27 HE21 GLN 27 3.353 -23.358 8.998 203 HE22 GLN 27 HE22 GLN 27 1.958 -22.349 8.809 204 H VAL 28 H VAL 28 7.048 -23.136 7.443 205 HA VAL 28 HA VAL 28 8.906 -22.333 8.405 206 HB VAL 28 HB VAL 28 9.565 -23.060 10.534 207 HG11 VAL 28 HG11 VAL 28 6.654 -23.738 10.194 208 HG12 VAL 28 HG12 VAL 28 7.343 -22.138 10.472 209 HG13 VAL 28 HG13 VAL 28 7.452 -23.374 11.725 210 HG21 VAL 28 HG21 VAL 28 8.315 -25.751 9.983 211 HG22 VAL 28 HG22 VAL 28 9.013 -25.237 11.519 212 HG23 VAL 28 HG23 VAL 28 10.041 -25.401 10.096 213 H LYS 29 H LYS 29 9.120 -24.660 6.343 214 HA LYS 29 HA LYS 29 11.979 -25.169 6.787 215 HB2 LYS 29 HB3 LYS 29 10.001 -26.517 4.939 216 HB3 LYS 29 HB2 LYS 29 11.713 -26.911 5.025 217 HG2 LYS 29 HG3 LYS 29 11.488 -27.679 7.281 218 HG3 LYS 29 HG2 LYS 29 9.816 -27.120 7.353 219 HD2 LYS 29 HD3 LYS 29 9.920 -29.534 7.013 220 HD3 LYS 29 HD2 LYS 29 9.202 -28.730 5.616 221 HE2 LYS 29 HE3 LYS 29 11.415 -28.820 4.495 222 HE3 LYS 29 HE2 LYS 29 12.033 -29.738 5.867 223 HZ1 LYS 29 HZ1 LYS 29 9.767 -30.589 4.146 224 HZ2 LYS 29 HZ2 LYS 29 10.479 -31.495 5.389 225 HZ3 LYS 29 HZ3 LYS 29 11.362 -31.146 3.984 226 H ALA 30 H ALA 30 9.639 -23.935 4.458 227 HA ALA 30 HA ALA 30 11.817 -22.399 3.229 228 HB1 ALA 30 HB1 ALA 30 9.667 -23.839 1.682 229 HB2 ALA 30 HB2 ALA 30 11.371 -24.292 1.751 230 HB3 ALA 30 HB3 ALA 30 10.892 -22.768 1.003 231 H ILE 31 H ILE 31 11.094 -20.646 4.469 232 HA ILE 31 HA ILE 31 8.770 -19.274 3.307 233 HB ILE 31 HB ILE 31 9.462 -19.319 6.262 234 HG12 ILE 31 HG13 ILE 31 7.002 -20.320 4.805 235 HG13 ILE 31 HG12 ILE 31 8.262 -21.331 5.506 236 HG21 ILE 31 HG21 ILE 31 7.538 -17.851 6.568 237 HG22 ILE 31 HG22 ILE 31 7.297 -17.792 4.821 238 HG23 ILE 31 HG23 ILE 31 8.755 -17.102 5.535 239 HD11 ILE 31 HD11 ILE 31 6.309 -21.246 6.940 240 HD12 ILE 31 HD12 ILE 31 6.424 -19.488 7.022 241 HD13 ILE 31 HD13 ILE 31 7.694 -20.489 7.727 242 H ASN 32 H ASN 32 9.383 -17.335 2.525 243 HA ASN 32 HA ASN 32 12.170 -16.682 2.884 244 HB2 ASN 32 HB3 ASN 32 12.030 -15.306 0.965 245 HB3 ASN 32 HB2 ASN 32 11.080 -16.744 0.627 246 HD21 ASN 32 HD21 ASN 32 8.719 -15.971 2.039 247 HD22 ASN 32 HD22 ASN 32 8.002 -14.660 1.170 248 H PHE 33 H PHE 33 9.168 -15.356 4.071 249 HA PHE 33 HA PHE 33 10.758 -13.243 5.336 250 HB2 PHE 33 HB3 PHE 33 8.320 -12.809 3.652 251 HB3 PHE 33 HB2 PHE 33 8.740 -11.679 4.929 252 HD1 PHE 33 HD1 PHE 33 8.831 -12.004 1.577 253 HD2 PHE 33 HD2 PHE 33 11.501 -11.243 4.801 254 HE1 PHE 33 HE1 PHE 33 10.350 -10.835 0.038 255 HE2 PHE 33 HE2 PHE 33 13.027 -10.072 3.264 256 HZ PHE 33 HZ PHE 33 12.453 -9.865 0.881 257 H LEU 34 H LEU 34 10.599 -13.850 7.401 258 HA LEU 34 HA LEU 34 7.974 -14.161 8.623 259 HB2 LEU 34 HB3 LEU 34 10.774 -14.047 9.763 260 HB3 LEU 34 HB2 LEU 34 9.345 -14.095 10.775 261 HG LEU 34 HG LEU 34 10.234 -16.292 10.697 262 HD11 LEU 34 HD11 LEU 34 7.863 -16.114 8.853 263 HD12 LEU 34 HD12 LEU 34 7.828 -16.212 10.615 264 HD13 LEU 34 HD13 LEU 34 8.418 -17.577 9.665 265 HD21 LEU 34 HD21 LEU 34 10.200 -16.083 7.691 266 HD22 LEU 34 HD22 LEU 34 10.598 -17.530 8.618 267 HD23 LEU 34 HD23 LEU 34 11.631 -16.105 8.723 268 HA PRO 35 HA PRO 35 7.608 -9.747 8.306 269 HB2 PRO 35 HB3 PRO 35 5.382 -9.495 9.914 270 HB3 PRO 35 HB2 PRO 35 5.346 -9.943 8.206 271 HG2 PRO 35 HG3 PRO 35 5.218 -11.698 10.625 272 HG3 PRO 35 HG2 PRO 35 4.297 -11.805 9.113 273 HD2 PRO 35 HD3 PRO 35 6.381 -13.415 9.592 274 HD3 PRO 35 HD2 PRO 35 6.062 -12.780 7.965 275 H VAL 36 H VAL 36 8.009 -7.900 9.469 276 HA VAL 36 HA VAL 36 9.439 -8.057 11.876 277 HB VAL 36 HB VAL 36 9.857 -6.179 10.483 278 HG11 VAL 36 HG11 VAL 36 6.954 -5.412 10.786 279 HG12 VAL 36 HG12 VAL 36 7.715 -6.053 9.330 280 HG13 VAL 36 HG13 VAL 36 8.188 -4.471 9.947 281 HG21 VAL 36 HG21 VAL 36 10.070 -5.709 12.857 282 HG22 VAL 36 HG22 VAL 36 8.378 -5.225 12.934 283 HG23 VAL 36 HG23 VAL 36 9.526 -4.270 11.993 284 H ASP 37 H ASP 37 8.460 -9.028 13.487 285 HA ASP 37 HA ASP 37 6.858 -7.976 15.375 286 HB2 ASP 37 HB3 ASP 37 5.064 -7.678 13.679 287 HB3 ASP 37 HB2 ASP 37 5.096 -9.407 13.355 288 H TYR 38 H TYR 38 7.656 -10.661 13.384 289 HA TYR 38 HA TYR 38 6.721 -12.716 15.116 290 HB2 TYR 38 HB3 TYR 38 7.210 -12.711 12.537 291 HB3 TYR 38 HB2 TYR 38 8.827 -13.185 13.046 292 HD1 TYR 38 HD1 TYR 38 9.237 -15.365 14.007 293 HD2 TYR 38 HD2 TYR 38 5.304 -14.168 12.919 294 HE1 TYR 38 HE1 TYR 38 8.466 -17.684 14.255 295 HE2 TYR 38 HE2 TYR 38 4.527 -16.484 13.157 296 HH TYR 38 HH TYR 38 5.496 -18.763 13.090 297 H GLU 39 H GLU 39 7.862 -14.122 16.403 298 HA GLU 39 HA GLU 39 10.605 -13.341 17.150 299 HB2 GLU 39 HB3 GLU 39 8.506 -14.432 19.034 300 HB3 GLU 39 HB2 GLU 39 10.089 -13.799 19.455 301 HG2 GLU 39 HG3 GLU 39 9.423 -11.573 18.934 302 HG3 GLU 39 HG2 GLU 39 7.907 -12.134 18.230 303 H ILE 40 H ILE 40 11.996 -15.075 17.720 304 HA ILE 40 HA ILE 40 10.850 -17.775 17.539 305 HB ILE 40 HB ILE 40 12.930 -18.581 16.443 306 HG12 ILE 40 HG13 ILE 40 13.470 -15.655 15.925 307 HG13 ILE 40 HG12 ILE 40 14.340 -16.636 17.099 308 HG21 ILE 40 HG21 ILE 40 10.915 -18.230 15.142 309 HG22 ILE 40 HG22 ILE 40 12.346 -17.831 14.191 310 HG23 ILE 40 HG23 ILE 40 11.359 -16.542 14.881 311 HD11 ILE 40 HD11 ILE 40 15.139 -18.073 15.305 312 HD12 ILE 40 HD12 ILE 40 15.597 -16.390 15.045 313 HD13 ILE 40 HD13 ILE 40 14.262 -17.093 14.130 314 H GLU 41 H GLU 41 11.840 -19.348 18.769 315 HA GLU 41 HA GLU 41 13.741 -18.389 20.809 316 HB2 GLU 41 HB3 GLU 41 11.424 -18.872 21.655 317 HB3 GLU 41 HB2 GLU 41 11.634 -20.540 21.141 318 HG2 GLU 41 HG3 GLU 41 13.445 -20.830 22.712 319 HG3 GLU 41 HG2 GLU 41 13.348 -19.132 23.176 320 H TYR 42 H TYR 42 14.921 -20.388 21.823 321 HA TYR 42 HA TYR 42 15.765 -22.123 19.603 322 HB2 TYR 42 HB3 TYR 42 17.358 -21.014 21.916 323 HB3 TYR 42 HB2 TYR 42 17.954 -22.282 20.850 324 HD1 TYR 42 HD1 TYR 42 18.889 -21.757 18.747 325 HD2 TYR 42 HD2 TYR 42 16.838 -18.749 20.948 326 HE1 TYR 42 HE1 TYR 42 19.718 -20.053 17.179 327 HE2 TYR 42 HE2 TYR 42 17.658 -17.040 19.385 328 HH TYR 42 HH TYR 42 19.198 -17.840 16.422 329 H VAL 43 H VAL 43 14.598 -23.944 19.934 330 HA VAL 43 HA VAL 43 14.675 -25.180 22.586 331 HB VAL 43 HB VAL 43 13.128 -26.888 21.582 332 HG11 VAL 43 HG11 VAL 43 12.184 -24.026 21.489 333 HG12 VAL 43 HG12 VAL 43 12.308 -25.030 22.934 334 HG13 VAL 43 HG13 VAL 43 11.163 -25.454 21.664 335 HG21 VAL 43 HG21 VAL 43 13.703 -26.593 19.233 336 HG22 VAL 43 HG22 VAL 43 13.063 -24.950 19.268 337 HG23 VAL 43 HG23 VAL 43 11.979 -26.324 19.488 338 H CYS 44 H CYS 44 15.866 -26.962 23.017 339 HA CYS 44 HA CYS 44 17.871 -27.613 21.011 340 HB2 CYS 44 HB3 CYS 44 18.505 -27.002 23.343 341 HB3 CYS 44 HB2 CYS 44 17.701 -28.459 23.908 342 H ARG 45 H ARG 45 18.424 -29.645 20.403 343 HA ARG 45 HA ARG 45 16.288 -31.263 19.653 344 HB2 ARG 45 HB3 ARG 45 18.507 -31.040 18.510 345 HB3 ARG 45 HB2 ARG 45 19.211 -32.025 19.782 346 HG2 ARG 45 HG3 ARG 45 16.894 -33.062 18.249 347 HG3 ARG 45 HG2 ARG 45 18.500 -33.089 17.513 348 HD2 ARG 45 HD3 ARG 45 19.352 -34.326 19.450 349 HD3 ARG 45 HD2 ARG 45 17.742 -34.313 20.165 350 HE ARG 45 HE ARG 45 17.254 -35.513 17.837 351 HH11 ARG 45 HH11 ARG 45 19.825 -36.001 20.169 352 HH12 ARG 45 HH12 ARG 45 19.974 -37.705 19.834 353 HH21 ARG 45 HH21 ARG 45 17.430 -37.728 17.405 354 HH22 ARG 45 HH22 ARG 45 18.614 -38.693 18.248 355 H GLY 46 H GLY 46 15.371 -33.052 20.467 356 HA2 GLY 46 HA3 GLY 46 14.996 -34.804 21.962 357 HA3 GLY 46 HA2 GLY 46 16.468 -34.362 22.821 358 H GLU 47 H GLU 47 16.077 -33.691 24.815 359 HA GLU 47 HA GLU 47 14.071 -31.601 25.167 360 HB2 GLU 47 HB3 GLU 47 14.218 -34.113 26.826 361 HB3 GLU 47 HB2 GLU 47 13.454 -32.639 27.407 362 HG2 GLU 47 HG3 GLU 47 11.933 -32.699 25.468 363 HG3 GLU 47 HG2 GLU 47 12.663 -34.224 24.973 364 H ARG 48 H ARG 48 15.874 -30.249 25.151 365 HA ARG 48 HA ARG 48 17.331 -30.211 27.702 366 HB2 ARG 48 HB3 ARG 48 18.500 -29.711 24.957 367 HB3 ARG 48 HB2 ARG 48 19.327 -29.352 26.463 368 HG2 ARG 48 HG3 ARG 48 18.434 -32.091 25.592 369 HG3 ARG 48 HG2 ARG 48 20.071 -31.446 25.430 370 HD2 ARG 48 HD3 ARG 48 20.124 -31.132 27.894 371 HD3 ARG 48 HD2 ARG 48 18.553 -31.930 27.991 372 HE ARG 48 HE ARG 48 20.439 -33.538 26.591 373 HH11 ARG 48 HH11 ARG 48 19.528 -32.503 29.827 374 HH12 ARG 48 HH12 ARG 48 20.167 -33.937 30.581 375 HH21 ARG 48 HH21 ARG 48 21.276 -35.394 27.590 376 HH22 ARG 48 HH22 ARG 48 21.156 -35.583 29.313 377 H GLU 49 H GLU 49 17.221 -28.302 28.701 378 HA GLU 49 HA GLU 49 15.924 -26.082 27.347 379 HB2 GLU 49 HB3 GLU 49 16.882 -26.424 30.191 380 HB3 GLU 49 HB2 GLU 49 16.025 -25.010 29.593 381 HG2 GLU 49 HG3 GLU 49 14.064 -26.311 29.151 382 HG3 GLU 49 HG2 GLU 49 14.921 -27.804 29.532 383 H VAL 50 H VAL 50 16.867 -24.152 26.848 384 HA VAL 50 HA VAL 50 19.789 -24.171 26.823 385 HB VAL 50 HB VAL 50 19.603 -22.331 25.170 386 HG11 VAL 50 HG11 VAL 50 18.049 -24.818 24.472 387 HG12 VAL 50 HG12 VAL 50 19.802 -24.626 24.403 388 HG13 VAL 50 HG13 VAL 50 18.771 -23.697 23.316 389 HG21 VAL 50 HG21 VAL 50 17.427 -21.832 24.151 390 HG22 VAL 50 HG22 VAL 50 17.466 -21.383 25.856 391 HG23 VAL 50 HG23 VAL 50 16.635 -22.855 25.350 392 H VAL 51 H VAL 51 20.931 -22.903 28.154 393 HA VAL 51 HA VAL 51 19.515 -20.711 29.489 394 HB VAL 51 HB VAL 51 20.637 -22.117 31.065 395 HG11 VAL 51 HG11 VAL 51 22.213 -23.213 29.579 396 HG12 VAL 51 HG12 VAL 51 23.043 -22.571 30.996 397 HG13 VAL 51 HG13 VAL 51 23.151 -21.724 29.453 398 HG21 VAL 51 HG21 VAL 51 22.215 -20.554 32.121 399 HG22 VAL 51 HG22 VAL 51 20.747 -19.750 31.567 400 HG23 VAL 51 HG23 VAL 51 22.239 -19.600 30.638 401 H GLY 52 H GLY 52 19.439 -19.193 27.981 402 HA2 GLY 52 HA3 GLY 52 21.872 -17.717 27.495 403 HA3 GLY 52 HA2 GLY 52 21.109 -18.373 26.051 404 HA PRO 53 HA PRO 53 18.833 -14.384 27.036 405 HB2 PRO 53 HB3 PRO 53 20.338 -13.147 24.873 406 HB3 PRO 53 HB2 PRO 53 20.119 -12.578 26.528 407 HG2 PRO 53 HG3 PRO 53 22.500 -13.476 25.548 408 HG3 PRO 53 HG2 PRO 53 22.048 -13.565 27.260 409 HD2 PRO 53 HD3 PRO 53 22.027 -15.704 25.172 410 HD3 PRO 53 HD2 PRO 53 22.464 -15.805 26.891 411 H LYS 54 H LYS 54 17.910 -16.561 25.886 412 HA LYS 54 HA LYS 54 17.954 -16.566 23.042 413 HB2 LYS 54 HB3 LYS 54 16.230 -18.443 23.348 414 HB3 LYS 54 HB2 LYS 54 17.863 -18.699 23.933 415 HG2 LYS 54 HG3 LYS 54 16.733 -19.500 25.722 416 HG3 LYS 54 HG2 LYS 54 16.777 -17.804 26.195 417 HD2 LYS 54 HD3 LYS 54 14.537 -17.461 25.381 418 HD3 LYS 54 HD2 LYS 54 14.492 -19.087 24.697 419 HE2 LYS 54 HE3 LYS 54 14.613 -20.053 26.921 420 HE3 LYS 54 HE2 LYS 54 14.764 -18.444 27.631 421 HZ1 LYS 54 HZ1 LYS 54 12.568 -17.915 27.041 422 HZ2 LYS 54 HZ2 LYS 54 12.485 -19.485 27.681 423 HZ3 LYS 54 HZ3 LYS 54 12.417 -19.248 26.004 424 H VAL 55 H VAL 55 17.099 -14.675 22.311 425 HA VAL 55 HA VAL 55 14.306 -14.949 21.752 426 HB VAL 55 HB VAL 55 14.108 -13.670 23.821 427 HG11 VAL 55 HG11 VAL 55 15.032 -11.412 24.027 428 HG12 VAL 55 HG12 VAL 55 15.877 -11.625 22.494 429 HG13 VAL 55 HG13 VAL 55 16.300 -12.629 23.880 430 HG21 VAL 55 HG21 VAL 55 12.485 -13.208 22.102 431 HG22 VAL 55 HG22 VAL 55 13.563 -12.030 21.356 432 HG23 VAL 55 HG23 VAL 55 12.878 -11.712 22.950 433 H ARG 56 H ARG 56 14.003 -14.422 19.706 434 HA ARG 56 HA ARG 56 15.734 -12.375 18.495 435 HB2 ARG 56 HB3 ARG 56 14.861 -14.880 17.053 436 HB3 ARG 56 HB2 ARG 56 15.993 -13.663 16.491 437 HG2 ARG 56 HG3 ARG 56 16.457 -15.530 18.803 438 HG3 ARG 56 HG2 ARG 56 17.087 -15.743 17.169 439 HD2 ARG 56 HD3 ARG 56 18.160 -13.452 17.473 440 HD3 ARG 56 HD2 ARG 56 17.778 -13.629 19.186 441 HE ARG 56 HE ARG 56 19.202 -15.860 18.030 442 HH11 ARG 56 HH11 ARG 56 19.479 -12.798 19.705 443 HH12 ARG 56 HH12 ARG 56 21.118 -13.073 20.200 444 HH21 ARG 56 HH21 ARG 56 21.363 -16.213 18.677 445 HH22 ARG 56 HH22 ARG 56 22.184 -15.000 19.611 446 H LYS 57 H LYS 57 14.441 -10.769 17.882 447 HA LYS 57 HA LYS 57 11.770 -11.465 16.841 448 HB2 LYS 57 HB3 LYS 57 11.804 -10.128 18.970 449 HB3 LYS 57 HB2 LYS 57 12.619 -8.842 18.090 450 HG2 LYS 57 HG3 LYS 57 10.712 -8.517 16.678 451 HG3 LYS 57 HG2 LYS 57 9.906 -9.929 17.367 452 HD2 LYS 57 HD3 LYS 57 10.607 -7.375 18.816 453 HD3 LYS 57 HD2 LYS 57 8.993 -7.888 18.318 454 HE2 LYS 57 HE3 LYS 57 9.187 -9.856 19.786 455 HE3 LYS 57 HE2 LYS 57 10.777 -9.297 20.303 456 HZ1 LYS 57 HZ1 LYS 57 8.175 -7.937 20.765 457 HZ2 LYS 57 HZ2 LYS 57 9.684 -7.263 21.139 458 HZ3 LYS 57 HZ3 LYS 57 9.168 -8.670 21.928 459 H CYS 58 H CYS 58 11.211 -10.680 14.846 460 HA CYS 58 HA CYS 58 13.412 -9.942 13.173 461 HB2 CYS 58 HB3 CYS 58 11.595 -11.412 12.381 462 HB3 CYS 58 HB2 CYS 58 10.467 -10.064 12.497 463 H LEU 59 H LEU 59 13.863 -8.038 12.184 464 HA LEU 59 HA LEU 59 12.650 -5.661 13.390 465 HB2 LEU 59 HB3 LEU 59 15.155 -5.953 11.717 466 HB3 LEU 59 HB2 LEU 59 14.615 -4.483 12.510 467 HG LEU 59 HG LEU 59 15.448 -7.014 13.935 468 HD11 LEU 59 HD11 LEU 59 16.868 -4.380 13.575 469 HD12 LEU 59 HD12 LEU 59 17.338 -5.928 12.872 470 HD13 LEU 59 HD13 LEU 59 17.403 -5.695 14.621 471 HD21 LEU 59 HD21 LEU 59 13.751 -5.719 15.145 472 HD22 LEU 59 HD22 LEU 59 14.761 -4.280 15.009 473 HD23 LEU 59 HD23 LEU 59 15.317 -5.661 15.955 474 H ALA 60 H ALA 60 12.805 -3.687 11.734 475 HA ALA 60 HA ALA 60 11.109 -4.305 9.480 476 HB1 ALA 60 HB1 ALA 60 11.201 -1.891 9.046 477 HB2 ALA 60 HB2 ALA 60 12.448 -1.721 10.282 478 HB3 ALA 60 HB3 ALA 60 10.820 -2.222 10.736 479 H ASN 61 H ASN 61 13.476 -5.678 9.404 480 HA ASN 61 HA ASN 61 14.765 -4.850 6.980 481 HB2 ASN 61 HB3 ASN 61 16.212 -3.516 8.201 482 HB3 ASN 61 HB2 ASN 61 16.012 -4.465 9.667 483 HD21 ASN 61 HD21 ASN 61 17.597 -4.342 6.544 484 HD22 ASN 61 HD22 ASN 61 18.907 -5.403 6.967 485 H GLY 62 H GLY 62 16.213 -6.589 6.213 486 HA2 GLY 62 HA3 GLY 62 15.068 -9.146 6.816 487 HA3 GLY 62 HA2 GLY 62 16.346 -8.820 5.657 488 H SER 63 H SER 63 16.129 -8.386 9.177 489 HA SER 63 HA SER 63 17.968 -10.524 9.721 490 HB2 SER 63 HB3 SER 63 18.843 -7.659 10.211 491 HB3 SER 63 HB2 SER 63 19.688 -9.094 10.791 492 HG SER 63 HG SER 63 19.249 -9.302 8.143 493 H TRP 64 H TRP 64 18.083 -10.983 11.977 494 HA TRP 64 HA TRP 64 15.669 -10.136 13.332 495 HB2 TRP 64 HB3 TRP 64 17.781 -12.161 14.106 496 HB3 TRP 64 HB2 TRP 64 16.272 -11.891 14.975 497 HD1 TRP 64 HD1 TRP 64 17.573 -13.300 11.626 498 HE1 TRP 64 HE1 TRP 64 15.758 -14.835 10.625 499 HE3 TRP 64 HE3 TRP 64 13.813 -12.412 14.983 500 HZ2 TRP 64 HZ2 TRP 64 13.089 -15.563 11.189 501 HZ3 TRP 64 HZ3 TRP 64 11.664 -13.566 14.678 502 HH2 TRP 64 HH2 TRP 64 11.310 -15.109 12.819 503 H THR 65 H THR 65 15.995 -9.886 15.860 504 HA THR 65 HA THR 65 17.035 -7.395 16.332 505 HB THR 65 HB THR 65 17.141 -8.252 18.815 506 HG1 THR 65 HG1 THR 65 16.564 -10.265 19.093 507 HG21 THR 65 HG21 THR 65 14.707 -7.998 18.984 508 HG22 THR 65 HG22 THR 65 14.574 -8.156 17.231 509 HG23 THR 65 HG23 THR 65 15.419 -6.775 17.933 510 H ASP 66 H ASP 66 18.602 -10.489 17.054 511 HA ASP 66 HA ASP 66 21.228 -9.294 16.754 512 HB2 ASP 66 HB3 ASP 66 20.715 -8.928 19.171 513 HB3 ASP 66 HB2 ASP 66 20.411 -10.647 19.347 514 H MET 67 H MET 67 22.645 -10.841 15.937 515 HA MET 67 HA MET 67 22.056 -13.628 16.618 516 HB2 MET 67 HB3 MET 67 22.555 -12.588 13.827 517 HB3 MET 67 HB2 MET 67 22.798 -14.273 14.264 518 HG2 MET 67 HG3 MET 67 20.202 -12.782 14.535 519 HG3 MET 67 HG2 MET 67 20.626 -13.840 13.190 520 HE1 MET 67 HE1 MET 67 17.922 -15.838 15.241 521 HE2 MET 67 HE2 MET 67 18.327 -15.128 13.678 522 HE3 MET 67 HE3 MET 67 18.008 -14.085 15.062 523 H ASP 68 H ASP 68 23.761 -12.961 18.137 524 HA ASP 68 HA ASP 68 25.955 -14.559 17.329 525 HB2 ASP 68 HB3 ASP 68 26.691 -12.272 16.505 526 HB3 ASP 68 HB2 ASP 68 26.684 -11.746 18.185 527 H THR 69 H THR 69 25.228 -15.847 19.032 528 HA THR 69 HA THR 69 25.682 -14.816 21.712 529 HB THR 69 HB THR 69 22.956 -15.942 21.187 530 HG1 THR 69 HG1 THR 69 23.632 -13.179 20.908 531 HG21 THR 69 HG21 THR 69 23.697 -15.598 23.496 532 HG22 THR 69 HG22 THR 69 22.362 -14.517 23.089 533 HG23 THR 69 HG23 THR 69 24.013 -13.899 23.141 534 HA PRO 70 HA PRO 70 26.668 -19.167 22.090 535 HB2 PRO 70 HB3 PRO 70 27.490 -19.099 24.660 536 HB3 PRO 70 HB2 PRO 70 28.471 -18.456 23.339 537 HG2 PRO 70 HG3 PRO 70 26.710 -17.002 25.272 538 HG3 PRO 70 HG2 PRO 70 28.330 -16.570 24.697 539 HD2 PRO 70 HD3 PRO 70 26.050 -15.458 23.711 540 HD3 PRO 70 HD2 PRO 70 27.529 -15.656 22.751 541 H SER 71 H SER 71 24.124 -19.211 21.938 542 HA SER 71 HA SER 71 22.774 -19.794 24.409 543 HB2 SER 71 HB3 SER 71 20.980 -20.640 22.771 544 HB3 SER 71 HB2 SER 71 21.394 -18.926 22.690 545 HG SER 71 HG SER 71 22.496 -20.945 21.020 546 H ARG 72 H ARG 72 22.856 -21.676 25.480 547 HA ARG 72 HA ARG 72 23.683 -24.083 24.013 548 HB2 ARG 72 HB3 ARG 72 25.174 -24.660 25.922 549 HB3 ARG 72 HB2 ARG 72 25.694 -23.247 25.018 550 HG2 ARG 72 HG3 ARG 72 24.705 -21.802 26.750 551 HG3 ARG 72 HG2 ARG 72 24.265 -23.243 27.668 552 HD2 ARG 72 HD3 ARG 72 26.357 -22.190 28.465 553 HD3 ARG 72 HD2 ARG 72 26.584 -23.852 27.915 554 HE ARG 72 HE ARG 72 27.540 -22.943 25.862 555 HH11 ARG 72 HH11 ARG 72 27.227 -20.737 28.576 556 HH12 ARG 72 HH12 ARG 72 28.515 -19.699 28.037 557 HH21 ARG 72 HH21 ARG 72 29.223 -21.574 25.157 558 HH22 ARG 72 HH22 ARG 72 29.641 -20.166 26.084 559 H CYS 73 H CYS 73 22.833 -25.984 24.693 560 HA CYS 73 HA CYS 73 20.820 -25.812 26.833 561 HB2 CYS 73 HB3 CYS 73 19.967 -27.971 25.687 562 HB3 CYS 73 HB2 CYS 73 19.653 -26.425 24.911 563 H VAL 74 H VAL 74 21.689 -26.492 28.675 564 HA VAL 74 HA VAL 74 23.359 -28.916 28.594 565 HB VAL 74 HB VAL 74 24.640 -26.786 28.954 566 HG11 VAL 74 HG11 VAL 74 23.024 -25.555 30.254 567 HG12 VAL 74 HG12 VAL 74 24.522 -25.730 31.171 568 HG13 VAL 74 HG13 VAL 74 23.128 -26.738 31.556 569 HG21 VAL 74 HG21 VAL 74 25.536 -28.938 29.663 570 HG22 VAL 74 HG22 VAL 74 24.724 -28.772 31.220 571 HG23 VAL 74 HG23 VAL 74 26.014 -27.655 30.773 572 H ARG 75 H ARG 75 20.438 -27.969 29.409 573 HA ARG 75 HA ARG 75 20.390 -29.628 31.834 574 HB2 ARG 75 HB3 ARG 75 19.945 -27.207 32.322 575 HB3 ARG 75 HB2 ARG 75 18.532 -27.306 31.278 576 HG2 ARG 75 HG3 ARG 75 17.477 -28.875 32.740 577 HG3 ARG 75 HG2 ARG 75 18.941 -29.024 33.714 578 HD2 ARG 75 HD3 ARG 75 17.461 -27.606 34.903 579 HD3 ARG 75 HD2 ARG 75 18.728 -26.583 34.233 580 HE ARG 75 HE ARG 75 16.128 -26.843 32.862 581 HH11 ARG 75 HH11 ARG 75 18.589 -24.874 34.424 582 HH12 ARG 75 HH12 ARG 75 17.815 -23.365 34.030 583 HH21 ARG 75 HH21 ARG 75 15.086 -24.856 32.378 584 HH22 ARG 75 HH22 ARG 75 15.814 -23.355 32.890
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