NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
560937 | 2m4v | 19023 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 1H SER 1 -15.011 27.840 6.867 2 H2 SER 1 2H SER 1 -16.452 28.237 7.540 3 H3 SER 1 3H SER 1 -15.099 28.179 8.469 4 HA SER 1 HA SER 1 -15.732 30.449 8.015 5 HB2 SER 1 2HB SER 1 -13.123 29.632 6.677 6 HB3 SER 1 3HB SER 1 -13.538 31.242 7.302 7 HG SER 1 HG SER 1 -12.318 30.023 8.814 8 H MET 2 H MET 2 -15.864 32.191 6.473 9 HA MET 2 HA MET 2 -15.951 31.563 3.603 10 HB2 MET 2 2HB MET 2 -18.209 32.358 3.250 11 HB3 MET 2 3HB MET 2 -18.213 31.001 4.361 12 HG2 MET 2 2HG MET 2 -19.769 32.460 5.262 13 HG3 MET 2 3HG MET 2 -18.351 32.713 6.269 14 HE1 MET 2 3HE MET 2 -20.866 34.616 6.306 15 HE2 MET 2 1HE MET 2 -19.402 34.903 7.277 16 HE3 MET 2 2HE MET 2 -20.094 36.217 6.301 17 H ALA 3 H ALA 3 -16.400 33.590 2.306 18 HA ALA 3 HA ALA 3 -15.693 36.126 3.638 19 HB1 ALA 3 3HB ALA 3 -13.949 36.627 1.969 20 HB2 ALA 3 1HB ALA 3 -13.525 35.180 2.903 21 HB3 ALA 3 2HB ALA 3 -14.154 35.017 1.246 22 H ASP 4 H ASP 4 -16.379 37.978 2.516 23 HA ASP 4 HA ASP 4 -18.750 37.701 0.909 24 HB2 ASP 4 2HB ASP 4 -18.399 39.520 2.505 25 HB3 ASP 4 3HB ASP 4 -16.998 40.088 1.598 26 H ARG 5 H ARG 5 -15.481 38.780 0.131 27 HA ARG 5 HA ARG 5 -15.768 37.864 -2.686 28 HB2 ARG 5 2HB ARG 5 -14.648 40.487 -1.659 29 HB3 ARG 5 3HB ARG 5 -14.082 39.809 -3.185 30 HG2 ARG 5 2HG ARG 5 -16.103 40.062 -4.275 31 HG3 ARG 5 3HG ARG 5 -17.070 40.056 -2.800 32 HD2 ARG 5 2HD ARG 5 -15.146 42.308 -3.465 33 HD3 ARG 5 3HD ARG 5 -16.840 42.268 -3.993 34 HE ARG 5 HE ARG 5 -17.237 41.851 -1.388 35 HH11 ARG 5 1HH2 ARG 5 -15.228 44.364 -2.814 36 HH12 ARG 5 2HH2 ARG 5 -15.537 45.438 -1.475 37 HH21 ARG 5 1HH1 ARG 5 -17.586 43.149 0.133 38 HH22 ARG 5 2HH1 ARG 5 -16.873 44.765 0.218 39 H VAL 6 H VAL 6 -13.909 37.032 -3.639 40 HA VAL 6 HA VAL 6 -11.454 36.662 -2.082 41 HB VAL 6 HB VAL 6 -12.921 34.893 -1.191 42 HG11 VAL 6 1HG1 VAL 6 -12.907 33.659 -3.971 43 HG12 VAL 6 2HG1 VAL 6 -13.607 32.973 -2.494 44 HG13 VAL 6 3HG1 VAL 6 -14.310 34.432 -3.203 45 HG21 VAL 6 3HG2 VAL 6 -10.467 34.555 -1.300 46 HG22 VAL 6 1HG2 VAL 6 -11.391 33.047 -1.371 47 HG23 VAL 6 2HG2 VAL 6 -10.670 33.700 -2.850 48 H LEU 7 H LEU 7 -9.685 36.135 -3.309 49 HA LEU 7 HA LEU 7 -10.048 35.534 -6.210 50 HB2 LEU 7 2HB LEU 7 -8.006 37.405 -4.951 51 HB3 LEU 7 3HB LEU 7 -7.935 36.825 -6.612 52 HG LEU 7 HG LEU 7 -10.199 38.526 -5.468 53 HD11 LEU 7 1HD1 LEU 7 -9.222 40.337 -6.809 54 HD12 LEU 7 2HD1 LEU 7 -8.063 39.749 -5.606 55 HD13 LEU 7 3HD1 LEU 7 -7.889 39.270 -7.310 56 HD21 LEU 7 3HD2 LEU 7 -9.576 37.666 -8.332 57 HD22 LEU 7 1HD2 LEU 7 -10.987 37.173 -7.367 58 HD23 LEU 7 2HD2 LEU 7 -10.810 38.854 -7.859 59 H ARG 8 H ARG 8 -9.170 33.702 -6.768 60 HA ARG 8 HA ARG 8 -6.837 32.508 -5.445 61 HB2 ARG 8 2HB ARG 8 -8.105 30.403 -4.882 62 HB3 ARG 8 3HB ARG 8 -8.439 31.799 -3.867 63 HG2 ARG 8 2HG ARG 8 -10.565 32.210 -5.105 64 HG3 ARG 8 3HG ARG 8 -10.257 30.766 -6.092 65 HD2 ARG 8 2HD ARG 8 -10.369 29.342 -4.123 66 HD3 ARG 8 3HD ARG 8 -10.416 30.756 -3.048 67 HE ARG 8 HE ARG 8 -12.611 30.896 -4.894 68 HH11 ARG 8 2HH2 ARG 8 -11.702 28.972 -2.101 69 HH12 ARG 8 1HH2 ARG 8 -13.361 28.746 -1.619 70 HH21 ARG 8 1HH1 ARG 8 -14.652 30.693 -4.168 71 HH22 ARG 8 2HH1 ARG 8 -15.003 29.657 -2.800 72 H GLY 9 H GLY 9 -5.979 30.711 -6.500 73 HA2 GLY 9 HA2 GLY 9 -5.302 29.539 -8.391 74 HA3 GLY 9 HA3 GLY 9 -6.797 29.966 -9.222 75 H SER 10 H SER 10 -4.121 31.877 -10.996 76 HA SER 10 HA SER 10 -4.744 28.999 -10.457 77 HB2 SER 10 2HB SER 10 -5.141 30.435 -13.104 78 HB3 SER 10 3HB SER 10 -5.365 28.699 -12.803 79 HG SER 10 HG SER 10 -7.341 29.891 -12.719 80 H ARG 11 H ARG 11 -2.264 30.578 -10.110 81 HA ARG 11 HA ARG 11 -0.403 30.169 -12.219 82 HB2 ARG 11 2HB ARG 11 -0.173 31.759 -10.306 83 HB3 ARG 11 3HB ARG 11 0.056 30.401 -9.217 84 HG2 ARG 11 2HG ARG 11 2.208 31.314 -9.636 85 HG3 ARG 11 3HG ARG 11 2.154 29.777 -10.475 86 HD2 ARG 11 2HD ARG 11 3.243 31.401 -11.882 87 HD3 ARG 11 3HD ARG 11 1.684 31.002 -12.615 88 HE ARG 11 HE ARG 11 1.460 33.319 -10.898 89 HH11 ARG 11 1HH2 ARG 11 2.684 32.465 -14.068 90 HH12 ARG 11 2HH2 ARG 11 2.481 34.084 -14.682 91 HH21 ARG 11 1HH1 ARG 11 1.219 35.358 -11.747 92 HH22 ARG 11 2HH1 ARG 11 1.678 35.674 -13.394 93 H LEU 12 H LEU 12 -1.399 27.962 -9.692 94 HA LEU 12 HA LEU 12 0.525 25.871 -10.566 95 HB2 LEU 12 2HB LEU 12 -1.367 26.058 -8.187 96 HB3 LEU 12 3HB LEU 12 -0.442 24.628 -8.581 97 HG LEU 12 HG LEU 12 0.628 25.714 -6.804 98 HD11 LEU 12 1HD1 LEU 12 2.319 26.262 -9.272 99 HD12 LEU 12 2HD1 LEU 12 2.885 25.965 -7.618 100 HD13 LEU 12 3HD1 LEU 12 2.086 24.666 -8.520 101 HD21 LEU 12 3HD2 LEU 12 1.530 27.912 -6.758 102 HD22 LEU 12 1HD2 LEU 12 1.100 28.220 -8.444 103 HD23 LEU 12 2HD2 LEU 12 -0.177 28.052 -7.210 104 H GLY 13 H GLY 13 -1.996 26.861 -12.084 105 HA2 GLY 13 HA2 GLY 13 -3.338 25.765 -13.669 106 HA3 GLY 13 HA3 GLY 13 -3.035 24.219 -12.883 107 H ALA 14 H ALA 14 -6.514 24.779 -11.899 108 HA ALA 14 HA ALA 14 -4.930 23.900 -14.230 109 HB1 ALA 14 3HB ALA 14 -5.229 21.516 -13.647 110 HB2 ALA 14 1HB ALA 14 -4.295 22.334 -12.384 111 HB3 ALA 14 2HB ALA 14 -6.013 21.970 -12.120 112 H VAL 15 H VAL 15 -6.223 22.545 -15.704 113 HA VAL 15 HA VAL 15 -8.998 23.476 -16.000 114 HB VAL 15 HB VAL 15 -9.027 22.102 -18.047 115 HG11 VAL 15 1HG1 VAL 15 -6.643 23.982 -17.872 116 HG12 VAL 15 2HG1 VAL 15 -7.519 23.498 -19.341 117 HG13 VAL 15 3HG1 VAL 15 -8.342 24.459 -18.104 118 HG21 VAL 15 3HG2 VAL 15 -6.973 21.130 -18.948 119 HG22 VAL 15 1HG2 VAL 15 -6.094 21.502 -17.456 120 HG23 VAL 15 2HG2 VAL 15 -7.428 20.323 -17.443 121 H SER 16 H SER 16 -10.776 22.183 -16.315 122 HA SER 16 HA SER 16 -11.020 20.014 -14.312 123 HB2 SER 16 2HB SER 16 -13.062 21.646 -15.861 124 HB3 SER 16 3HB SER 16 -13.444 20.391 -14.674 125 HG SER 16 HG SER 16 -11.831 22.664 -14.114 126 H TYR 17 H TYR 17 -12.480 18.223 -14.836 127 HA TYR 17 HA TYR 17 -12.930 16.284 -15.850 128 HB2 TYR 17 2HB TYR 17 -14.289 16.456 -17.872 129 HB3 TYR 17 3HB TYR 17 -14.706 17.609 -16.637 130 HD1 TYR 17 HD1 TYR 17 -13.122 17.237 -19.994 131 HD2 TYR 17 HD2 TYR 17 -14.585 19.977 -16.997 132 HE1 TYR 17 HE1 TYR 17 -12.892 19.135 -21.599 133 HE2 TYR 17 HE2 TYR 17 -14.269 21.875 -18.570 134 HH TYR 17 HH TYR 17 -13.661 22.511 -20.689 135 H GLU 18 H GLU 18 -12.898 15.052 -18.174 136 HA GLU 18 HA GLU 18 -10.078 14.299 -18.360 137 HB2 GLU 18 2HB GLU 18 -12.582 13.048 -19.542 138 HB3 GLU 18 3HB GLU 18 -10.950 12.361 -19.618 139 HG2 GLU 18 2HG GLU 18 -10.862 12.308 -17.130 140 HG3 GLU 18 3HG GLU 18 -12.522 12.904 -17.064 141 H THR 19 H THR 19 -9.940 16.673 -19.388 142 HA THR 19 HA THR 19 -10.340 16.727 -22.294 143 HB THR 19 HB THR 19 -10.689 18.737 -20.963 144 HG1 THR 19 HG1 THR 19 -9.589 20.069 -22.384 145 HG21 THR 19 1HG2 THR 19 -7.673 18.853 -20.571 146 HG22 THR 19 2HG2 THR 19 -8.874 20.080 -20.111 147 HG23 THR 19 3HG2 THR 19 -8.859 18.516 -19.289 148 H ASP 20 H ASP 20 -8.773 16.678 -23.872 149 HA ASP 20 HA ASP 20 -5.962 16.262 -23.236 150 HB2 ASP 20 2HB ASP 20 -6.975 13.982 -22.914 151 HB3 ASP 20 3HB ASP 20 -7.557 14.029 -24.577 152 H ARG 21 H ARG 21 -4.606 16.392 -25.156 153 HA ARG 21 HA ARG 21 -5.476 18.156 -27.204 154 HB2 ARG 21 2HB ARG 21 -3.322 17.765 -28.235 155 HB3 ARG 21 3HB ARG 21 -3.152 17.940 -26.490 156 HG2 ARG 21 2HG ARG 21 -2.940 15.451 -26.269 157 HG3 ARG 21 3HG ARG 21 -3.131 15.295 -28.020 158 HD2 ARG 21 2HD ARG 21 -0.807 15.136 -27.539 159 HD3 ARG 21 3HD ARG 21 -1.071 16.672 -28.350 160 HE ARG 21 HE ARG 21 -0.521 16.236 -25.429 161 HH11 ARG 21 2HH2 ARG 21 -0.570 18.541 -28.078 162 HH12 ARG 21 1HH2 ARG 21 0.213 19.773 -27.127 163 HH21 ARG 21 2HH1 ARG 21 0.469 17.850 -24.291 164 HH22 ARG 21 1HH1 ARG 21 0.785 19.384 -25.046 165 H ASN 22 H ASN 22 -5.788 14.674 -27.129 166 HA ASN 22 HA ASN 22 -6.206 14.175 -29.903 167 HB2 ASN 22 2HB ASN 22 -5.821 12.474 -28.129 168 HB3 ASN 22 3HB ASN 22 -7.403 12.836 -27.435 169 HD21 ASN 22 2HD2 ASN 22 -5.826 11.677 -30.465 170 HD22 ASN 22 1HD2 ASN 22 -7.182 10.657 -30.921 171 H HIS 23 H HIS 23 -8.230 15.986 -27.723 172 HA HIS 23 HA HIS 23 -10.754 15.691 -29.106 173 HB2 HIS 23 2HB HIS 23 -10.397 16.511 -26.760 174 HB3 HIS 23 3HB HIS 23 -9.691 17.988 -27.417 175 HD2 HIS 23 HD2 HIS 23 -11.355 19.897 -28.103 176 HE1 HIS 23 HE1 HIS 23 -15.035 17.793 -27.613 177 HE2 HIS 23 HE2 HIS 23 -13.988 20.070 -28.065 178 H ASP 24 H ASP 24 -7.857 17.334 -29.996 179 HA ASP 24 HA ASP 24 -7.230 18.846 -31.527 180 HB2 ASP 24 2HB ASP 24 -9.821 18.234 -32.984 181 HB3 ASP 24 3HB ASP 24 -8.440 19.081 -33.644 182 H LEU 25 H LEU 25 -8.087 20.864 -32.900 183 HA LEU 25 HA LEU 25 -9.621 22.660 -31.081 184 HB2 LEU 25 2HB LEU 25 -7.119 23.301 -32.688 185 HB3 LEU 25 3HB LEU 25 -8.104 24.494 -31.850 186 HG LEU 25 HG LEU 25 -6.585 22.223 -30.483 187 HD11 LEU 25 1HD1 LEU 25 -6.008 25.212 -30.627 188 HD12 LEU 25 2HD1 LEU 25 -5.090 24.005 -29.697 189 HD13 LEU 25 3HD1 LEU 25 -5.102 23.933 -31.466 190 HD21 LEU 25 3HD2 LEU 25 -8.115 24.605 -29.344 191 HD22 LEU 25 1HD2 LEU 25 -8.537 22.888 -29.145 192 HD23 LEU 25 2HD2 LEU 25 -7.066 23.518 -28.404 193 H ALA 26 H ALA 26 -10.862 24.224 -32.030 194 HA ALA 26 HA ALA 26 -11.280 24.258 -34.953 195 HB1 ALA 26 3HB ALA 26 -13.717 23.868 -34.646 196 HB2 ALA 26 1HB ALA 26 -12.770 22.489 -34.066 197 HB3 ALA 26 2HB ALA 26 -13.463 23.643 -32.904 198 HA PRO 27 HA PRO 27 -11.972 28.603 -34.489 199 HB2 PRO 27 2HB PRO 27 -14.602 28.244 -35.946 200 HB3 PRO 27 3HB PRO 27 -13.326 29.479 -36.202 201 HG2 PRO 27 2HG PRO 27 -13.452 27.336 -37.830 202 HG3 PRO 27 3HG PRO 27 -11.856 27.829 -37.166 203 HD2 PRO 27 2HD PRO 27 -13.726 25.665 -36.151 204 HD3 PRO 27 3HD PRO 27 -11.959 25.580 -36.462 205 H ARG 28 H ARG 28 -12.322 29.364 -32.604 206 HA ARG 28 HA ARG 28 -14.976 29.302 -31.260 207 HB2 ARG 28 2HB ARG 28 -14.044 28.422 -29.219 208 HB3 ARG 28 3HB ARG 28 -13.676 27.337 -30.555 209 HG2 ARG 28 2HG ARG 28 -11.357 28.388 -30.669 210 HG3 ARG 28 3HG ARG 28 -11.781 29.291 -29.199 211 HD2 ARG 28 2HD ARG 28 -12.190 27.148 -28.020 212 HD3 ARG 28 3HD ARG 28 -11.744 26.255 -29.490 213 HE ARG 28 HE ARG 28 -9.570 27.915 -29.003 214 HH11 ARG 28 2HH1 ARG 28 -11.110 25.354 -27.173 215 HH12 ARG 28 1HH1 ARG 28 -9.665 25.015 -26.262 216 HH21 ARG 28 1HH2 ARG 28 -7.767 27.435 -27.797 217 HH22 ARG 28 2HH2 ARG 28 -7.823 26.159 -26.619 218 H GLN 29 H GLN 29 -14.998 30.507 -29.224 219 HA GLN 29 HA GLN 29 -13.459 33.064 -29.198 220 HB2 GLN 29 2HB GLN 29 -16.427 32.772 -28.596 221 HB3 GLN 29 3HB GLN 29 -15.488 34.260 -28.559 222 HG2 GLN 29 2HG GLN 29 -16.007 34.671 -30.703 223 HG3 GLN 29 3HG GLN 29 -15.297 33.139 -31.222 224 HE21 GLN 29 1HE2 GLN 29 -16.800 31.190 -30.283 225 HE22 GLN 29 2HE2 GLN 29 -18.458 31.325 -30.867 226 H ILE 30 H ILE 30 -12.335 32.894 -27.366 227 HA ILE 30 HA ILE 30 -13.429 31.568 -24.943 228 HB ILE 30 HB ILE 30 -10.730 32.937 -25.161 229 HG12 ILE 30 2HG1 ILE 30 -10.647 31.334 -26.929 230 HG13 ILE 30 3HG1 ILE 30 -9.713 30.743 -25.566 231 HG21 ILE 30 1HG2 ILE 30 -10.198 31.388 -23.283 232 HG22 ILE 30 2HG2 ILE 30 -11.517 32.493 -22.887 233 HG23 ILE 30 3HG2 ILE 30 -11.877 30.807 -23.292 234 HD11 ILE 30 3HD1 ILE 30 -11.601 29.225 -24.964 235 HD12 ILE 30 1HD1 ILE 30 -12.474 29.785 -26.419 236 HD13 ILE 30 2HD1 ILE 30 -10.936 28.924 -26.570 237 H ALA 31 H ALA 31 -14.906 32.837 -23.920 238 HA ALA 31 HA ALA 31 -14.312 35.720 -23.410 239 HB1 ALA 31 3HB ALA 31 -16.670 35.770 -22.603 240 HB2 ALA 31 1HB ALA 31 -16.509 35.295 -24.300 241 HB3 ALA 31 2HB ALA 31 -16.836 34.060 -23.059 242 H ARG 32 H ARG 32 -14.732 36.489 -21.208 243 HA ARG 32 HA ARG 32 -14.214 34.499 -19.036 244 HB2 ARG 32 2HB ARG 32 -13.008 37.228 -19.488 245 HB3 ARG 32 3HB ARG 32 -13.302 36.692 -17.833 246 HG2 ARG 32 2HG ARG 32 -11.835 34.898 -17.937 247 HG3 ARG 32 3HG ARG 32 -11.824 34.858 -19.702 248 HD2 ARG 32 2HD ARG 32 -9.745 35.762 -19.085 249 HD3 ARG 32 3HD ARG 32 -10.711 37.131 -19.669 250 HE ARG 32 HE ARG 32 -11.132 37.311 -16.978 251 HH11 ARG 32 1HH2 ARG 32 -8.093 36.949 -18.722 252 HH12 ARG 32 2HH2 ARG 32 -7.230 37.894 -17.542 253 HH21 ARG 32 1HH1 ARG 32 -10.012 38.441 -15.581 254 HH22 ARG 32 2HH1 ARG 32 -8.282 38.724 -15.773 255 H TYR 33 H TYR 33 -15.247 34.829 -17.097 256 HA TYR 33 HA TYR 33 -17.295 36.946 -16.947 257 HB2 TYR 33 2HB TYR 33 -17.965 34.016 -16.520 258 HB3 TYR 33 3HB TYR 33 -18.996 35.361 -16.140 259 HD1 TYR 33 HD2 TYR 33 -17.333 33.604 -18.995 260 HD2 TYR 33 HD1 TYR 33 -20.424 36.302 -17.721 261 HE1 TYR 33 HE2 TYR 33 -18.412 33.449 -21.241 262 HE2 TYR 33 HE1 TYR 33 -21.477 36.173 -19.971 263 HH TYR 33 HH TYR 33 -21.475 35.183 -21.957 264 H ARG 34 H ARG 34 -17.672 37.685 -14.944 265 HA ARG 34 HA ARG 34 -16.001 36.652 -12.698 266 HB2 ARG 34 2HB ARG 34 -15.608 38.970 -13.630 267 HB3 ARG 34 3HB ARG 34 -17.222 39.420 -13.076 268 HG2 ARG 34 2HG ARG 34 -16.589 38.834 -10.746 269 HG3 ARG 34 3HG ARG 34 -14.988 38.344 -11.283 270 HD2 ARG 34 2HD ARG 34 -16.199 41.119 -11.425 271 HD3 ARG 34 3HD ARG 34 -14.970 40.553 -10.278 272 HE ARG 34 HE ARG 34 -13.523 40.169 -12.417 273 HH11 ARG 34 1HH2 ARG 34 -15.611 42.970 -11.969 274 HH12 ARG 34 2HH2 ARG 34 -14.598 43.952 -12.991 275 HH21 ARG 34 1HH1 ARG 34 -12.372 41.383 -13.625 276 HH22 ARG 34 2HH1 ARG 34 -12.759 43.080 -13.926 277 H THR 35 H THR 35 -16.899 35.780 -11.024 278 HA THR 35 HA THR 35 -19.803 35.478 -10.770 279 HB THR 35 HB THR 35 -19.339 34.066 -8.839 280 HG1 THR 35 HG1 THR 35 -16.636 34.589 -9.324 281 HG21 THR 35 1HG2 THR 35 -18.021 32.326 -9.871 282 HG22 THR 35 2HG2 THR 35 -19.195 33.017 -11.013 283 HG23 THR 35 3HG2 THR 35 -17.472 33.433 -11.144 284 H ASP 36 H ASP 36 -20.593 35.571 -8.311 285 HA ASP 36 HA ASP 36 -20.540 38.383 -7.706 286 HB2 ASP 36 2HB ASP 36 -22.563 36.900 -7.563 287 HB3 ASP 36 3HB ASP 36 -21.836 36.094 -6.170 288 H ASN 37 H ASN 37 -18.553 35.762 -6.559 289 HA ASN 37 HA ASN 37 -17.740 37.352 -4.188 290 HB2 ASN 37 2HB ASN 37 -16.273 34.902 -4.938 291 HB3 ASN 37 3HB ASN 37 -16.559 35.617 -3.389 292 HD21 ASN 37 1HD2 ASN 37 -16.936 32.894 -4.564 293 HD22 ASN 37 2HD2 ASN 37 -18.569 32.456 -4.018 294 H GLY 38 H GLY 38 -17.200 37.809 -7.364 295 HA2 GLY 38 HA2 GLY 38 -15.569 39.074 -8.466 296 HA3 GLY 38 HA3 GLY 38 -14.471 38.922 -7.089 297 H GLU 39 H GLU 39 -15.605 35.847 -7.763 298 HA GLU 39 HA GLU 39 -12.958 35.032 -8.635 299 HB2 GLU 39 2HB GLU 39 -15.343 33.192 -8.788 300 HB3 GLU 39 3HB GLU 39 -13.670 32.836 -8.453 301 HG2 GLU 39 2HG GLU 39 -14.236 34.398 -6.290 302 HG3 GLU 39 3HG GLU 39 -15.878 33.878 -6.719 303 H GLU 40 H GLU 40 -12.264 35.217 -10.695 304 HA GLU 40 HA GLU 40 -14.233 35.331 -12.914 305 HB2 GLU 40 2HB GLU 40 -11.320 36.118 -12.684 306 HB3 GLU 40 3HB GLU 40 -12.118 35.889 -14.249 307 HG2 GLU 40 2HG GLU 40 -13.912 37.473 -13.533 308 HG3 GLU 40 3HG GLU 40 -12.980 37.806 -12.068 309 H PHE 41 H PHE 41 -14.481 33.828 -14.398 310 HA PHE 41 HA PHE 41 -12.465 31.648 -14.778 311 HB2 PHE 41 2HB PHE 41 -15.485 31.409 -14.684 312 HB3 PHE 41 3HB PHE 41 -14.398 30.134 -15.166 313 HD1 PHE 41 HD1 PHE 41 -15.560 32.158 -12.218 314 HD2 PHE 41 HD2 PHE 41 -13.077 28.876 -13.563 315 HE1 PHE 41 HE1 PHE 41 -15.228 31.437 -9.914 316 HE2 PHE 41 HE2 PHE 41 -12.608 28.281 -11.204 317 HZ PHE 41 HZ PHE 41 -13.678 29.564 -9.364 318 H GLU 42 H GLU 42 -12.665 30.559 -16.832 319 HA GLU 42 HA GLU 42 -13.363 32.425 -19.046 320 HB2 GLU 42 2HB GLU 42 -11.438 30.101 -19.274 321 HB3 GLU 42 3HB GLU 42 -11.694 31.449 -20.370 322 HG2 GLU 42 2HG GLU 42 -9.813 32.255 -19.434 323 HG3 GLU 42 3HG GLU 42 -10.896 32.852 -18.187 324 H VAL 43 H VAL 43 -14.737 31.837 -20.592 325 HA VAL 43 HA VAL 43 -15.742 29.009 -20.714 326 HB VAL 43 HB VAL 43 -17.435 31.465 -21.188 327 HG11 VAL 43 1HG1 VAL 43 -18.084 29.431 -22.488 328 HG12 VAL 43 2HG1 VAL 43 -18.169 28.517 -20.968 329 HG13 VAL 43 3HG1 VAL 43 -19.266 29.886 -21.273 330 HG21 VAL 43 3HG2 VAL 43 -18.540 31.007 -19.135 331 HG22 VAL 43 1HG2 VAL 43 -17.566 29.547 -18.833 332 HG23 VAL 43 2HG2 VAL 43 -16.841 31.169 -18.746 333 HA PRO 44 HA PRO 44 -14.447 29.624 -25.047 334 HB2 PRO 44 2HB PRO 44 -14.749 26.675 -25.072 335 HB3 PRO 44 3HB PRO 44 -13.387 27.651 -25.642 336 HG2 PRO 44 2HG PRO 44 -13.247 26.197 -23.326 337 HG3 PRO 44 3HG PRO 44 -12.483 27.813 -23.441 338 HD2 PRO 44 2HD PRO 44 -15.155 27.091 -22.218 339 HD3 PRO 44 3HD PRO 44 -13.869 28.194 -21.625 340 H PHE 45 H PHE 45 -15.891 30.086 -26.497 341 HA PHE 45 HA PHE 45 -18.466 28.547 -26.812 342 HB2 PHE 45 2HB PHE 45 -17.771 31.444 -27.311 343 HB3 PHE 45 3HB PHE 45 -19.143 30.695 -28.075 344 HD1 PHE 45 HD2 PHE 45 -17.665 31.607 -24.774 345 HD2 PHE 45 HD1 PHE 45 -21.193 30.320 -26.883 346 HE1 PHE 45 HE2 PHE 45 -19.045 32.123 -22.790 347 HE2 PHE 45 HE1 PHE 45 -22.578 30.880 -24.894 348 HZ PHE 45 HZ PHE 45 -21.476 31.725 -22.807 349 H ALA 46 H ALA 46 -19.038 27.864 -28.871 350 HA ALA 46 HA ALA 46 -16.793 27.562 -30.782 351 HB1 ALA 46 3HB ALA 46 -18.133 25.588 -30.130 352 HB2 ALA 46 1HB ALA 46 -19.599 26.363 -30.774 353 HB3 ALA 46 2HB ALA 46 -18.269 25.919 -31.866 354 H ASP 47 H ASP 47 -17.124 27.963 -33.102 355 HA ASP 47 HA ASP 47 -18.103 30.516 -33.773 356 HB2 ASP 47 2HB ASP 47 -16.415 29.393 -35.058 357 HB3 ASP 47 3HB ASP 47 -17.516 28.074 -35.475 358 H ASP 48 H ASP 48 -19.912 27.565 -33.490 359 HA ASP 48 HA ASP 48 -22.253 28.351 -35.031 360 HB2 ASP 48 2HB ASP 48 -21.538 26.009 -34.472 361 HB3 ASP 48 3HB ASP 48 -21.948 26.325 -32.789 362 H ALA 49 H ALA 49 -21.003 29.462 -32.084 363 HA ALA 49 HA ALA 49 -23.630 30.477 -31.081 364 HB1 ALA 49 3HB ALA 49 -22.791 28.524 -29.783 365 HB2 ALA 49 1HB ALA 49 -21.280 29.409 -29.462 366 HB3 ALA 49 2HB ALA 49 -22.823 30.010 -28.819 367 H GLU 50 H GLU 50 -23.338 32.222 -29.460 368 HA GLU 50 HA GLU 50 -20.971 33.976 -29.802 369 HB2 GLU 50 2HB GLU 50 -22.338 35.933 -29.922 370 HB3 GLU 50 3HB GLU 50 -22.776 34.858 -31.239 371 HG2 GLU 50 2HG GLU 50 -24.379 35.007 -28.639 372 HG3 GLU 50 3HG GLU 50 -24.646 36.098 -29.983 373 H ILE 51 H ILE 51 -21.002 35.702 -28.029 374 HA ILE 51 HA ILE 51 -21.145 34.405 -25.437 375 HB ILE 51 HB ILE 51 -20.143 37.194 -26.004 376 HG12 ILE 51 2HG1 ILE 51 -19.018 35.787 -27.626 377 HG13 ILE 51 3HG1 ILE 51 -17.897 36.333 -26.376 378 HG21 ILE 51 1HG2 ILE 51 -20.407 36.542 -23.611 379 HG22 ILE 51 2HG2 ILE 51 -19.339 35.159 -23.889 380 HG23 ILE 51 3HG2 ILE 51 -18.715 36.798 -24.055 381 HD11 ILE 51 3HD1 ILE 51 -17.426 34.041 -26.960 382 HD12 ILE 51 1HD1 ILE 51 -18.100 34.032 -25.332 383 HD13 ILE 51 2HD1 ILE 51 -19.114 33.566 -26.715 384 HA PRO 52 HA PRO 52 -24.917 36.855 -24.523 385 HB2 PRO 52 2HB PRO 52 -25.659 35.374 -22.342 386 HB3 PRO 52 3HB PRO 52 -26.021 34.884 -24.028 387 HG2 PRO 52 2HG PRO 52 -23.795 33.946 -22.213 388 HG3 PRO 52 3HG PRO 52 -24.845 32.971 -23.300 389 HD2 PRO 52 2HD PRO 52 -22.291 33.813 -23.943 390 HD3 PRO 52 3HD PRO 52 -23.540 33.550 -25.174 391 H GLY 53 H GLY 53 -25.216 38.387 -22.927 392 HA2 GLY 53 HA2 GLY 53 -23.136 39.704 -21.712 393 HA3 GLY 53 HA3 GLY 53 -24.812 39.812 -21.164 394 H THR 54 H THR 54 -24.905 36.975 -20.218 395 HA THR 54 HA THR 54 -22.720 36.822 -18.271 396 HB THR 54 HB THR 54 -24.324 36.233 -16.423 397 HG1 THR 54 HG1 THR 54 -26.552 36.597 -16.770 398 HG21 THR 54 1HG2 THR 54 -25.300 38.362 -15.898 399 HG22 THR 54 2HG2 THR 54 -23.759 38.663 -16.697 400 HG23 THR 54 3HG2 THR 54 -25.260 38.878 -17.601 401 H TRP 55 H TRP 55 -22.537 34.688 -17.208 402 HA TRP 55 HA TRP 55 -23.889 32.373 -18.375 403 HB2 TRP 55 2HB TRP 55 -22.124 33.054 -20.075 404 HB3 TRP 55 3HB TRP 55 -20.913 32.719 -18.847 405 HD1 TRP 55 HD1 TRP 55 -20.358 30.222 -18.355 406 HE1 TRP 55 HE1 TRP 55 -20.709 28.062 -19.656 407 HE3 TRP 55 HE3 TRP 55 -24.055 31.811 -21.475 408 HZ2 TRP 55 HZ2 TRP 55 -22.509 27.080 -21.723 409 HZ3 TRP 55 HZ3 TRP 55 -25.100 30.239 -23.107 410 HH2 TRP 55 HH2 TRP 55 -24.328 27.880 -23.241 411 H LEU 56 H LEU 56 -23.470 30.419 -17.180 412 HA LEU 56 HA LEU 56 -22.762 30.853 -14.418 413 HB2 LEU 56 2HB LEU 56 -24.340 29.050 -15.836 414 HB3 LEU 56 3HB LEU 56 -22.965 28.063 -15.339 415 HG LEU 56 HG LEU 56 -24.602 29.775 -13.426 416 HD11 LEU 56 1HD1 LEU 56 -26.023 28.044 -14.456 417 HD12 LEU 56 2HD1 LEU 56 -24.828 26.796 -14.034 418 HD13 LEU 56 3HD1 LEU 56 -25.702 27.672 -12.755 419 HD21 LEU 56 3HD2 LEU 56 -23.623 28.284 -11.705 420 HD22 LEU 56 1HD2 LEU 56 -22.659 27.465 -12.957 421 HD23 LEU 56 2HD2 LEU 56 -22.363 29.167 -12.573 422 H CYS 57 H CYS 57 -20.884 30.639 -13.425 423 HA CYS 57 HA CYS 57 -18.488 29.729 -14.919 424 HB2 CYS 57 2HB CYS 57 -18.882 31.222 -12.295 425 HB3 CYS 57 3HB CYS 57 -17.308 30.674 -12.887 426 HG CYS 57 HG CYS 57 -17.480 33.206 -13.405 427 H ARG 58 H ARG 58 -16.882 28.333 -13.879 428 HA ARG 58 HA ARG 58 -18.087 25.914 -12.971 429 HB2 ARG 58 2HB ARG 58 -16.190 24.982 -13.631 430 HB3 ARG 58 3HB ARG 58 -15.713 26.579 -14.191 431 HG2 ARG 58 2HG ARG 58 -14.608 26.923 -11.911 432 HG3 ARG 58 3HG ARG 58 -14.920 25.205 -11.602 433 HD2 ARG 58 2HD ARG 58 -13.704 24.668 -13.745 434 HD3 ARG 58 3HD ARG 58 -13.255 26.382 -13.859 435 HE ARG 58 HE ARG 58 -12.531 25.294 -11.283 436 HH11 ARG 58 1HH2 ARG 58 -11.382 25.290 -14.612 437 HH12 ARG 58 2HH2 ARG 58 -9.776 24.781 -14.100 438 HH21 ARG 58 1HH1 ARG 58 -10.423 24.646 -10.797 439 HH22 ARG 58 2HH1 ARG 58 -9.300 24.401 -12.122 440 H ASN 59 H ASN 59 -17.103 28.588 -11.095 441 HA ASN 59 HA ASN 59 -16.784 27.358 -8.544 442 HB2 ASN 59 2HB ASN 59 -16.132 29.614 -9.020 443 HB3 ASN 59 3HB ASN 59 -17.789 30.086 -9.419 444 HD21 ASN 59 1HD2 ASN 59 -17.788 31.812 -7.877 445 HD22 ASN 59 2HD2 ASN 59 -17.636 31.488 -6.166 446 H GLY 60 H GLY 60 -19.583 27.715 -10.546 447 HA2 GLY 60 HA2 GLY 60 -21.684 26.712 -10.223 448 HA3 GLY 60 HA3 GLY 60 -21.433 26.665 -8.475 449 H MET 61 H MET 61 -20.597 29.722 -9.880 450 HA MET 61 HA MET 61 -23.242 30.865 -9.130 451 HB2 MET 61 2HB MET 61 -21.240 31.396 -7.645 452 HB3 MET 61 3HB MET 61 -20.544 32.255 -8.998 453 HG2 MET 61 2HG MET 61 -21.717 33.762 -7.426 454 HG3 MET 61 3HG MET 61 -22.387 33.837 -9.054 455 HE1 MET 61 3HE MET 61 -25.608 34.563 -7.022 456 HE2 MET 61 1HE MET 61 -23.984 35.109 -6.565 457 HE3 MET 61 2HE MET 61 -24.475 35.110 -8.278 458 H GLU 62 H GLU 62 -24.131 32.472 -10.398 459 HA GLU 62 HA GLU 62 -23.538 32.482 -13.218 460 HB2 GLU 62 2HB GLU 62 -25.242 34.248 -13.359 461 HB3 GLU 62 3HB GLU 62 -25.774 32.753 -12.601 462 HG2 GLU 62 2HG GLU 62 -25.561 33.821 -10.350 463 HG3 GLU 62 3HG GLU 62 -25.109 35.338 -11.128 464 H GLY 63 H GLY 63 -21.814 33.325 -14.089 465 HA2 GLY 63 HA2 GLY 63 -20.420 35.620 -12.906 466 HA3 GLY 63 HA3 GLY 63 -19.834 34.615 -14.213 467 H THR 64 H THR 64 -20.075 37.585 -14.005 468 HA THR 64 HA THR 64 -21.780 38.074 -16.411 469 HB THR 64 HB THR 64 -20.607 40.084 -14.453 470 HG1 THR 64 HG1 THR 64 -22.296 38.894 -13.557 471 HG21 THR 64 1HG2 THR 64 -22.485 40.454 -16.835 472 HG22 THR 64 2HG2 THR 64 -22.283 41.657 -15.541 473 HG23 THR 64 3HG2 THR 64 -20.908 41.220 -16.560 474 H LEU 65 H LEU 65 -20.973 38.931 -18.266 475 HA LEU 65 HA LEU 65 -18.389 38.123 -19.006 476 HB2 LEU 65 2HB LEU 65 -20.479 38.316 -20.352 477 HB3 LEU 65 3HB LEU 65 -20.308 40.051 -20.350 478 HG LEU 65 HG LEU 65 -18.676 37.917 -21.773 479 HD11 LEU 65 1HD1 LEU 65 -20.167 40.396 -22.748 480 HD12 LEU 65 2HD1 LEU 65 -19.415 39.154 -23.768 481 HD13 LEU 65 3HD1 LEU 65 -20.809 38.742 -22.757 482 HD21 LEU 65 3HD2 LEU 65 -17.336 39.758 -22.835 483 HD22 LEU 65 1HD2 LEU 65 -17.914 40.854 -21.561 484 HD23 LEU 65 2HD2 LEU 65 -16.919 39.420 -21.166 485 H ILE 66 H ILE 66 -16.455 39.015 -18.675 486 HA ILE 66 HA ILE 66 -16.101 41.961 -18.752 487 HB ILE 66 HB ILE 66 -14.435 41.965 -17.066 488 HG12 ILE 66 2HG1 ILE 66 -13.352 39.843 -17.176 489 HG13 ILE 66 3HG1 ILE 66 -13.965 40.066 -15.543 490 HG21 ILE 66 1HG2 ILE 66 -15.766 41.637 -15.066 491 HG22 ILE 66 2HG2 ILE 66 -16.744 42.343 -16.364 492 HG23 ILE 66 3HG2 ILE 66 -16.920 40.629 -15.950 493 HD11 ILE 66 3HD1 ILE 66 -15.907 38.604 -16.160 494 HD12 ILE 66 1HD1 ILE 66 -14.993 38.241 -17.642 495 HD13 ILE 66 2HD1 ILE 66 -14.310 37.826 -16.067 496 H GLU 67 H GLU 67 -14.037 42.677 -19.523 497 HA GLU 67 HA GLU 67 -12.868 40.846 -21.526 498 HB2 GLU 67 2HB GLU 67 -12.387 43.791 -20.959 499 HB3 GLU 67 3HB GLU 67 -11.577 42.848 -22.219 500 HG2 GLU 67 2HG GLU 67 -13.789 42.319 -23.239 501 HG3 GLU 67 3HG GLU 67 -14.582 43.329 -22.028 502 H GLY 68 H GLY 68 -10.908 39.928 -21.458 503 HA2 GLY 68 HA2 GLY 68 -9.306 39.993 -18.992 504 HA3 GLY 68 HA3 GLY 68 -9.077 38.949 -20.396 505 H ASP 69 H ASP 69 -9.334 42.206 -21.410 506 HA ASP 69 HA ASP 69 -6.517 42.876 -21.291 507 HB2 ASP 69 2HB ASP 69 -6.249 42.939 -23.695 508 HB3 ASP 69 3HB ASP 69 -6.655 41.308 -23.194 509 H LEU 70 H LEU 70 -6.234 44.875 -22.547 510 HA LEU 70 HA LEU 70 -7.658 46.855 -21.129 511 HB2 LEU 70 2HB LEU 70 -5.506 46.926 -23.258 512 HB3 LEU 70 3HB LEU 70 -6.134 48.427 -22.599 513 HG LEU 70 HG LEU 70 -4.897 46.237 -20.878 514 HD11 LEU 70 1HD1 LEU 70 -2.912 47.696 -20.803 515 HD12 LEU 70 2HD1 LEU 70 -3.243 47.164 -22.459 516 HD13 LEU 70 3HD1 LEU 70 -3.675 48.815 -21.958 517 HD21 LEU 70 3HD2 LEU 70 -4.703 48.108 -19.232 518 HD22 LEU 70 1HD2 LEU 70 -5.604 49.160 -20.348 519 HD23 LEU 70 2HD2 LEU 70 -6.387 47.742 -19.616 520 HA PRO 71 HA PRO 71 -10.876 48.392 -23.570 521 HB2 PRO 71 2HB PRO 71 -9.897 51.217 -23.173 522 HB3 PRO 71 3HB PRO 71 -11.521 50.526 -22.876 523 HG2 PRO 71 2HG PRO 71 -9.841 50.969 -20.806 524 HG3 PRO 71 3HG PRO 71 -10.762 49.429 -20.884 525 HD2 PRO 71 2HD PRO 71 -7.893 49.943 -21.731 526 HD3 PRO 71 3HD PRO 71 -8.554 48.639 -20.703 527 H GLU 72 H GLU 72 -7.950 50.318 -24.498 528 HA GLU 72 HA GLU 72 -8.681 49.941 -27.374 529 HB2 GLU 72 2HB GLU 72 -7.827 52.570 -26.106 530 HB3 GLU 72 3HB GLU 72 -8.183 52.279 -27.816 531 HG2 GLU 72 2HG GLU 72 -10.528 51.632 -27.136 532 HG3 GLU 72 3HG GLU 72 -10.157 52.196 -25.507 533 HA PRO 73 HA PRO 73 -4.248 48.974 -27.835 534 HB2 PRO 73 2HB PRO 73 -5.619 46.282 -28.028 535 HB3 PRO 73 3HB PRO 73 -3.896 46.644 -27.686 536 HG2 PRO 73 2HG PRO 73 -5.554 45.974 -25.667 537 HG3 PRO 73 3HG PRO 73 -4.417 47.350 -25.460 538 HD2 PRO 73 2HD PRO 73 -7.369 47.438 -26.120 539 HD3 PRO 73 3HD PRO 73 -6.432 48.437 -24.982 540 H LYS 74 H LYS 74 -3.924 47.576 -30.044 541 HA LYS 74 HA LYS 74 -5.880 48.410 -32.092 542 HB2 LYS 74 2HB LYS 74 -3.476 48.303 -32.625 543 HB3 LYS 74 3HB LYS 74 -3.468 46.561 -32.307 544 HG2 LYS 74 2HG LYS 74 -5.141 46.228 -34.139 545 HG3 LYS 74 3HG LYS 74 -5.161 47.975 -34.426 546 HD2 LYS 74 2HD LYS 74 -2.745 47.912 -35.005 547 HD3 LYS 74 3HD LYS 74 -2.722 46.159 -34.708 548 HE2 LYS 74 2HE LYS 74 -4.430 45.839 -36.486 549 HE3 LYS 74 3HE LYS 74 -4.455 47.583 -36.781 550 HZ1 LYS 74 HZ1 LYS 74 -2.108 47.439 -37.430 551 HZ2 LYS 74 HZ2 LYS 74 -2.084 45.827 -37.157 552 HZ3 LYS 74 HZ3 LYS 74 -3.003 46.440 -38.357 553 H LYS 75 H LYS 75 -7.803 47.534 -31.672 554 HA LYS 75 HA LYS 75 -8.187 44.627 -32.052 555 HB2 LYS 75 2HB LYS 75 -9.631 44.415 -30.068 556 HB3 LYS 75 3HB LYS 75 -7.961 44.794 -29.660 557 HG2 LYS 75 2HG LYS 75 -8.698 47.247 -29.443 558 HG3 LYS 75 3HG LYS 75 -10.361 46.678 -29.539 559 HD2 LYS 75 2HD LYS 75 -8.357 45.611 -27.498 560 HD3 LYS 75 3HD LYS 75 -9.303 47.077 -27.232 561 HE2 LYS 75 2HE LYS 75 -11.398 45.871 -27.423 562 HE3 LYS 75 3HE LYS 75 -10.549 44.363 -27.806 563 HZ1 LYS 75 HZ1 LYS 75 -9.625 44.314 -25.626 564 HZ2 LYS 75 HZ2 LYS 75 -10.070 45.830 -25.273 565 HZ3 LYS 75 HZ3 LYS 75 -11.222 44.664 -25.400 566 H VAL 76 H VAL 76 -9.967 44.099 -33.091 567 HA VAL 76 HA VAL 76 -12.149 46.072 -33.568 568 HB VAL 76 HB VAL 76 -12.240 45.470 -35.946 569 HG11 VAL 76 1HG1 VAL 76 -10.417 46.852 -36.721 570 HG12 VAL 76 2HG1 VAL 76 -11.060 47.521 -35.213 571 HG13 VAL 76 3HG1 VAL 76 -9.526 46.622 -35.205 572 HG21 VAL 76 3HG2 VAL 76 -10.359 44.408 -37.090 573 HG22 VAL 76 1HG2 VAL 76 -9.537 44.116 -35.546 574 HG23 VAL 76 2HG2 VAL 76 -11.065 43.288 -35.922 575 H LYS 77 H LYS 77 -14.136 45.169 -34.316 576 HA LYS 77 HA LYS 77 -14.808 42.661 -33.046 577 HB2 LYS 77 2HB LYS 77 -16.528 44.593 -34.625 578 HB3 LYS 77 3HB LYS 77 -17.104 43.068 -33.945 579 HG2 LYS 77 2HG LYS 77 -16.429 43.806 -31.681 580 HG3 LYS 77 3HG LYS 77 -15.773 45.304 -32.349 581 HD2 LYS 77 2HD LYS 77 -17.919 45.771 -31.377 582 HD3 LYS 77 3HD LYS 77 -18.040 45.955 -33.132 583 HE2 LYS 77 2HE LYS 77 -19.086 43.706 -33.298 584 HE3 LYS 77 3HE LYS 77 -18.911 43.489 -31.551 585 HZ1 LYS 77 HZ1 LYS 77 -20.408 45.388 -31.235 586 HZ2 LYS 77 HZ2 LYS 77 -20.565 45.592 -32.849 587 HZ3 LYS 77 HZ3 LYS 77 -21.144 44.245 -32.135 588 HA PRO 78 HA PRO 78 -15.769 40.857 -37.324 589 HB2 PRO 78 2HB PRO 78 -14.007 42.401 -39.210 590 HB3 PRO 78 3HB PRO 78 -15.651 41.748 -39.482 591 HG2 PRO 78 2HG PRO 78 -15.294 44.393 -39.040 592 HG3 PRO 78 3HG PRO 78 -16.646 43.527 -38.232 593 HD2 PRO 78 2HD PRO 78 -13.900 44.171 -37.106 594 HD3 PRO 78 3HD PRO 78 -15.499 44.508 -36.401 595 HA PRO 79 HA PRO 79 -15.485 39.432 -39.156 596 HB2 PRO 79 2HB PRO 79 -15.070 36.820 -39.692 597 HB3 PRO 79 3HB PRO 79 -14.138 38.115 -40.503 598 HG2 PRO 79 2HG PRO 79 -13.299 36.442 -38.109 599 HG3 PRO 79 3HG PRO 79 -12.369 36.781 -39.604 600 HD2 PRO 79 2HD PRO 79 -12.044 38.233 -37.291 601 HD3 PRO 79 3HD PRO 79 -11.862 38.963 -38.911 602 H ARG 80 H ARG 80 -14.315 37.755 -36.264 603 HA ARG 80 HA ARG 80 -17.063 37.162 -35.331 604 HB2 ARG 80 2HB ARG 80 -14.831 35.110 -35.668 605 HB3 ARG 80 3HB ARG 80 -16.222 34.832 -34.639 606 HG2 ARG 80 2HG ARG 80 -16.394 35.370 -37.640 607 HG3 ARG 80 3HG ARG 80 -16.353 33.775 -36.921 608 HD2 ARG 80 2HD ARG 80 -18.514 35.809 -36.208 609 HD3 ARG 80 3HD ARG 80 -18.639 34.692 -37.557 610 HE ARG 80 HE ARG 80 -18.649 32.815 -36.098 611 HH11 ARG 80 1HH1 ARG 80 -18.434 35.681 -34.067 612 HH12 ARG 80 2HH1 ARG 80 -18.949 34.740 -32.686 613 HH21 ARG 80 1HH2 ARG 80 -19.770 31.953 -34.427 614 HH22 ARG 80 2HH2 ARG 80 -19.828 32.788 -32.892 Start of MODEL 2 1 H1 SER 1 1H SER 1 22.140 13.855 -26.564 2 H2 SER 1 2H SER 1 23.092 13.884 -27.913 3 H3 SER 1 3H SER 1 22.019 15.094 -27.638 4 HA SER 1 HA SER 1 24.324 15.710 -27.196 5 HB2 SER 1 2HB SER 1 22.443 15.839 -24.804 6 HB3 SER 1 3HB SER 1 23.823 16.911 -25.132 7 HG SER 1 HG SER 1 21.882 17.848 -25.871 8 H MET 2 H MET 2 26.320 13.986 -24.720 9 HA MET 2 HA MET 2 25.933 16.573 -26.172 10 HB2 MET 2 2HB MET 2 28.110 15.574 -24.308 11 HB3 MET 2 3HB MET 2 28.091 17.154 -25.103 12 HG2 MET 2 2HG MET 2 25.941 17.693 -24.008 13 HG3 MET 2 3HG MET 2 25.984 16.156 -23.145 14 HE1 MET 2 3HE MET 2 27.523 15.587 -21.141 15 HE2 MET 2 1HE MET 2 28.979 15.801 -22.142 16 HE3 MET 2 2HE MET 2 28.858 16.609 -20.567 17 H ALA 3 H ALA 3 27.874 13.575 -26.366 18 HA ALA 3 HA ALA 3 29.558 14.553 -28.525 19 HB1 ALA 3 3HB ALA 3 29.041 11.730 -27.492 20 HB2 ALA 3 1HB ALA 3 30.347 12.224 -28.591 21 HB3 ALA 3 2HB ALA 3 30.312 12.842 -26.928 22 H ASP 4 H ASP 4 26.674 12.426 -28.378 23 HA ASP 4 HA ASP 4 26.390 12.399 -31.321 24 HB2 ASP 4 2HB ASP 4 24.683 11.243 -29.087 25 HB3 ASP 4 3HB ASP 4 24.298 11.126 -30.803 26 H ARG 5 H ARG 5 25.110 13.712 -32.463 27 HA ARG 5 HA ARG 5 23.476 15.804 -31.062 28 HB2 ARG 5 2HB ARG 5 25.068 15.858 -33.654 29 HB3 ARG 5 3HB ARG 5 23.767 16.994 -33.338 30 HG2 ARG 5 2HG ARG 5 25.761 18.092 -32.784 31 HG3 ARG 5 3HG ARG 5 24.909 17.775 -31.274 32 HD2 ARG 5 2HD ARG 5 26.464 15.987 -30.710 33 HD3 ARG 5 3HD ARG 5 27.201 16.067 -32.326 34 HE ARG 5 HE ARG 5 27.298 18.600 -30.889 35 HH11 ARG 5 1HH1 ARG 5 29.025 15.551 -31.085 36 HH12 ARG 5 2HH1 ARG 5 30.564 16.315 -30.768 37 HH21 ARG 5 1HH2 ARG 5 29.266 19.469 -30.372 38 HH22 ARG 5 2HH2 ARG 5 30.674 18.453 -30.296 39 H VAL 6 H VAL 6 21.529 16.476 -31.990 40 HA VAL 6 HA VAL 6 20.213 14.832 -34.040 41 HB VAL 6 HB VAL 6 19.846 13.579 -31.947 42 HG11 VAL 6 1HG1 VAL 6 18.275 15.992 -30.950 43 HG12 VAL 6 2HG1 VAL 6 18.396 14.404 -30.173 44 HG13 VAL 6 3HG1 VAL 6 19.830 15.430 -30.304 45 HG21 VAL 6 3HG2 VAL 6 18.165 13.511 -33.764 46 HG22 VAL 6 1HG2 VAL 6 17.479 13.237 -32.157 47 HG23 VAL 6 2HG2 VAL 6 17.253 14.806 -32.946 48 H LEU 7 H LEU 7 18.380 15.831 -34.961 49 HA LEU 7 HA LEU 7 18.342 18.759 -34.736 50 HB2 LEU 7 2HB LEU 7 16.878 16.894 -36.635 51 HB3 LEU 7 3HB LEU 7 16.958 18.650 -36.766 52 HG LEU 7 HG LEU 7 19.322 16.744 -37.038 53 HD11 LEU 7 1HD1 LEU 7 19.286 17.429 -39.390 54 HD12 LEU 7 2HD1 LEU 7 17.744 16.688 -38.933 55 HD13 LEU 7 3HD1 LEU 7 17.864 18.456 -39.092 56 HD21 LEU 7 3HD2 LEU 7 20.562 18.755 -37.822 57 HD22 LEU 7 1HD2 LEU 7 19.184 19.776 -37.353 58 HD23 LEU 7 2HD2 LEU 7 20.108 18.881 -36.121 59 H ARG 8 H ARG 8 17.442 17.725 -32.405 60 HA ARG 8 HA ARG 8 14.581 18.532 -32.239 61 HB2 ARG 8 2HB ARG 8 15.737 15.949 -31.084 62 HB3 ARG 8 3HB ARG 8 14.146 16.585 -30.695 63 HG2 ARG 8 2HG ARG 8 15.018 15.679 -33.472 64 HG3 ARG 8 3HG ARG 8 14.082 14.731 -32.322 65 HD2 ARG 8 2HD ARG 8 12.265 16.437 -32.380 66 HD3 ARG 8 3HD ARG 8 13.198 17.383 -33.535 67 HE ARG 8 HE ARG 8 12.706 15.902 -35.243 68 HH11 ARG 8 1HH2 ARG 8 11.506 14.473 -32.271 69 HH12 ARG 8 2HH2 ARG 8 10.595 13.257 -33.124 70 HH21 ARG 8 1HH1 ARG 8 11.524 14.325 -36.255 71 HH22 ARG 8 2HH1 ARG 8 10.610 13.182 -35.317 72 H GLY 9 H GLY 9 13.883 19.027 -30.076 73 HA2 GLY 9 HA2 GLY 9 15.765 20.618 -28.572 74 HA3 GLY 9 HA3 GLY 9 14.098 20.266 -28.130 75 H SER 10 H SER 10 16.001 20.452 -26.199 76 HA SER 10 HA SER 10 16.055 17.746 -25.008 77 HB2 SER 10 2HB SER 10 18.215 17.953 -26.182 78 HB3 SER 10 3HB SER 10 18.554 19.461 -25.308 79 HG SER 10 HG SER 10 19.460 17.431 -24.421 80 H ARG 11 H ARG 11 16.454 17.752 -22.750 81 HA ARG 11 HA ARG 11 15.722 20.272 -21.317 82 HB2 ARG 11 2HB ARG 11 15.551 17.364 -20.437 83 HB3 ARG 11 3HB ARG 11 15.210 18.758 -19.399 84 HG2 ARG 11 2HG ARG 11 13.475 19.527 -21.022 85 HG3 ARG 11 3HG ARG 11 13.725 18.051 -21.966 86 HD2 ARG 11 2HD ARG 11 13.039 16.668 -20.062 87 HD3 ARG 11 3HD ARG 11 12.871 18.093 -19.035 88 HE ARG 11 HE ARG 11 11.019 17.154 -21.111 89 HH11 ARG 11 1HH1 ARG 11 11.817 19.934 -19.102 90 HH12 ARG 11 2HH1 ARG 11 10.325 20.751 -19.556 91 HH21 ARG 11 2HH2 ARG 11 9.126 18.289 -21.540 92 HH22 ARG 11 1HH2 ARG 11 8.917 19.879 -20.837 93 H LEU 12 H LEU 12 18.515 18.897 -22.246 94 HA LEU 12 HA LEU 12 20.079 19.360 -19.809 95 HB2 LEU 12 2HB LEU 12 20.756 17.678 -21.474 96 HB3 LEU 12 3HB LEU 12 20.881 18.929 -22.711 97 HG LEU 12 HG LEU 12 22.731 20.010 -21.432 98 HD11 LEU 12 1HD1 LEU 12 23.835 18.729 -19.609 99 HD12 LEU 12 2HD1 LEU 12 22.230 19.285 -19.139 100 HD13 LEU 12 3HD1 LEU 12 22.477 17.584 -19.601 101 HD21 LEU 12 3HD2 LEU 12 24.420 18.289 -21.896 102 HD22 LEU 12 1HD2 LEU 12 23.149 17.050 -22.011 103 HD23 LEU 12 2HD2 LEU 12 23.222 18.378 -23.196 104 H GLY 13 H GLY 13 20.139 21.392 -19.062 105 HA2 GLY 13 HA2 GLY 13 20.747 23.618 -18.899 106 HA3 GLY 13 HA3 GLY 13 21.283 23.594 -20.578 107 H ALA 14 H ALA 14 19.086 23.077 -22.039 108 HA ALA 14 HA ALA 14 17.360 25.428 -21.771 109 HB1 ALA 14 3HB ALA 14 16.433 24.623 -23.912 110 HB2 ALA 14 1HB ALA 14 18.204 24.687 -23.958 111 HB3 ALA 14 2HB ALA 14 17.376 23.126 -23.765 112 H VAL 15 H VAL 15 14.975 25.241 -21.924 113 HA VAL 15 HA VAL 15 13.795 22.934 -20.458 114 HB VAL 15 HB VAL 15 12.398 24.545 -19.208 115 HG11 VAL 15 1HG1 VAL 15 14.381 23.484 -18.179 116 HG12 VAL 15 2HG1 VAL 15 15.373 24.875 -18.671 117 HG13 VAL 15 3HG1 VAL 15 14.047 25.089 -17.510 118 HG21 VAL 15 3HG2 VAL 15 13.060 26.869 -18.925 119 HG22 VAL 15 1HG2 VAL 15 14.361 26.689 -20.114 120 HG23 VAL 15 2HG2 VAL 15 12.660 26.568 -20.620 121 H SER 16 H SER 16 11.541 22.646 -20.700 122 HA SER 16 HA SER 16 10.067 24.185 -22.724 123 HB2 SER 16 2HB SER 16 11.269 22.449 -24.047 124 HB3 SER 16 3HB SER 16 10.500 21.189 -23.061 125 HG SER 16 HG SER 16 9.371 21.642 -25.044 126 H TYR 17 H TYR 17 7.867 24.118 -22.408 127 HA TYR 17 HA TYR 17 6.579 22.198 -20.621 128 HB2 TYR 17 2HB TYR 17 5.746 23.902 -19.053 129 HB3 TYR 17 3HB TYR 17 7.482 23.715 -18.966 130 HD1 TYR 17 HD1 TYR 17 4.727 25.974 -20.015 131 HD2 TYR 17 HD2 TYR 17 9.000 25.520 -19.592 132 HE1 TYR 17 HE1 TYR 17 5.025 28.426 -20.343 133 HE2 TYR 17 HE2 TYR 17 9.293 27.970 -19.909 134 HH TYR 17 HH TYR 17 8.257 29.981 -20.275 135 H GLU 18 H GLU 18 4.246 22.489 -20.496 136 HA GLU 18 HA GLU 18 3.125 23.239 -23.085 137 HB2 GLU 18 2HB GLU 18 2.448 21.211 -21.861 138 HB3 GLU 18 3HB GLU 18 1.767 22.204 -20.567 139 HG2 GLU 18 2HG GLU 18 0.162 23.205 -22.181 140 HG3 GLU 18 3HG GLU 18 0.899 22.287 -23.495 141 H THR 19 H THR 19 3.051 25.365 -23.466 142 HA THR 19 HA THR 19 2.163 27.362 -21.506 143 HB THR 19 HB THR 19 2.612 27.620 -24.504 144 HG1 THR 19 HG1 THR 19 4.473 27.092 -23.262 145 HG21 THR 19 1HG2 THR 19 1.216 29.481 -23.697 146 HG22 THR 19 2HG2 THR 19 2.325 29.749 -22.332 147 HG23 THR 19 3HG2 THR 19 2.859 30.048 -24.000 148 H ASP 20 H ASP 20 0.139 28.170 -21.226 149 HA ASP 20 HA ASP 20 -2.085 26.700 -22.366 150 HB2 ASP 20 2HB ASP 20 -1.817 27.276 -19.955 151 HB3 ASP 20 3HB ASP 20 -2.083 28.971 -20.357 152 H ARG 21 H ARG 21 -0.913 28.061 -24.445 153 HA ARG 21 HA ARG 21 -2.189 30.594 -25.063 154 HB2 ARG 21 2HB ARG 21 0.021 29.829 -25.955 155 HB3 ARG 21 3HB ARG 21 -0.815 28.630 -26.951 156 HG2 ARG 21 2HG ARG 21 -1.996 30.436 -28.162 157 HG3 ARG 21 3HG ARG 21 -1.292 31.641 -27.066 158 HD2 ARG 21 2HD ARG 21 0.984 31.004 -27.835 159 HD3 ARG 21 3HD ARG 21 0.281 29.858 -28.974 160 HE ARG 21 HE ARG 21 0.261 32.837 -29.134 161 HH11 ARG 21 1HH2 ARG 21 -0.817 29.889 -30.726 162 HH12 ARG 21 2HH2 ARG 21 -1.092 30.738 -32.224 163 HH21 ARG 21 1HH1 ARG 21 -0.120 33.790 -30.915 164 HH22 ARG 21 2HH1 ARG 21 -0.739 32.955 -32.343 165 H ASN 22 H ASN 22 -4.179 30.918 -25.662 166 HA ASN 22 HA ASN 22 -5.839 28.705 -26.798 167 HB2 ASN 22 2HB ASN 22 -7.558 29.253 -25.144 168 HB3 ASN 22 3HB ASN 22 -6.051 28.807 -24.356 169 HD21 ASN 22 2HD2 ASN 22 -4.864 30.437 -23.171 170 HD22 ASN 22 1HD2 ASN 22 -5.621 31.988 -22.820 171 H HIS 23 H HIS 23 -4.845 31.795 -27.434 172 HA HIS 23 HA HIS 23 -7.327 32.645 -28.822 173 HB2 HIS 23 2HB HIS 23 -6.145 34.804 -29.043 174 HB3 HIS 23 3HB HIS 23 -6.318 34.280 -27.375 175 HD2 HIS 23 HD2 HIS 23 -3.636 34.908 -30.055 176 HE1 HIS 23 HE1 HIS 23 -1.549 34.029 -26.442 177 HE2 HIS 23 HE2 HIS 23 -1.285 34.799 -28.853 178 H ASP 24 H ASP 24 -5.491 30.400 -29.691 179 HA ASP 24 HA ASP 24 -4.168 31.129 -32.135 180 HB2 ASP 24 2HB ASP 24 -4.090 28.678 -32.479 181 HB3 ASP 24 3HB ASP 24 -3.528 29.169 -30.884 182 H LEU 25 H LEU 25 -4.681 30.362 -34.242 183 HA LEU 25 HA LEU 25 -7.267 31.329 -35.029 184 HB2 LEU 25 2HB LEU 25 -6.449 31.455 -37.207 185 HB3 LEU 25 3HB LEU 25 -5.357 32.212 -36.064 186 HG LEU 25 HG LEU 25 -4.886 29.498 -37.354 187 HD11 LEU 25 1HD1 LEU 25 -3.270 30.668 -38.788 188 HD12 LEU 25 2HD1 LEU 25 -4.892 31.340 -38.999 189 HD13 LEU 25 3HD1 LEU 25 -3.694 32.217 -38.020 190 HD21 LEU 25 3HD2 LEU 25 -2.482 29.923 -36.708 191 HD22 LEU 25 1HD2 LEU 25 -3.052 31.255 -35.682 192 HD23 LEU 25 2HD2 LEU 25 -3.543 29.563 -35.362 193 H ALA 26 H ALA 26 -8.412 29.625 -34.014 194 HA ALA 26 HA ALA 26 -9.430 27.863 -36.150 195 HB1 ALA 26 3HB ALA 26 -8.088 26.370 -34.729 196 HB2 ALA 26 1HB ALA 26 -8.966 26.919 -33.287 197 HB3 ALA 26 2HB ALA 26 -9.812 25.997 -34.549 198 HA PRO 27 HA PRO 27 -13.077 29.833 -35.177 199 HB2 PRO 27 2HB PRO 27 -14.767 27.438 -35.828 200 HB3 PRO 27 3HB PRO 27 -14.667 29.029 -36.637 201 HG2 PRO 27 2HG PRO 27 -13.538 26.827 -37.738 202 HG3 PRO 27 3HG PRO 27 -12.661 28.397 -37.767 203 HD2 PRO 27 2HD PRO 27 -12.379 26.144 -35.737 204 HD3 PRO 27 3HD PRO 27 -11.110 26.905 -36.728 205 H ARG 28 H ARG 28 -12.421 29.732 -32.804 206 HA ARG 28 HA ARG 28 -14.921 29.321 -31.297 207 HB2 ARG 28 2HB ARG 28 -13.973 28.181 -29.477 208 HB3 ARG 28 3HB ARG 28 -13.453 27.336 -30.934 209 HG2 ARG 28 2HG ARG 28 -11.239 28.627 -30.747 210 HG3 ARG 28 3HG ARG 28 -11.794 29.148 -29.142 211 HD2 ARG 28 2HD ARG 28 -12.162 26.700 -28.574 212 HD3 ARG 28 3HD ARG 28 -11.380 26.272 -30.094 213 HE ARG 28 HE ARG 28 -10.123 27.038 -27.622 214 HH11 ARG 28 1HH1 ARG 28 -9.526 27.300 -31.072 215 HH12 ARG 28 2HH1 ARG 28 -7.786 27.367 -30.835 216 HH21 ARG 28 1HH2 ARG 28 -7.921 27.174 -27.436 217 HH22 ARG 28 2HH2 ARG 28 -6.957 27.472 -28.872 218 H GLN 29 H GLN 29 -14.880 30.380 -29.178 219 HA GLN 29 HA GLN 29 -13.350 32.937 -29.059 220 HB2 GLN 29 2HB GLN 29 -16.345 32.701 -28.568 221 HB3 GLN 29 3HB GLN 29 -15.370 34.160 -28.481 222 HG2 GLN 29 2HG GLN 29 -15.811 34.608 -30.633 223 HG3 GLN 29 3HG GLN 29 -15.075 33.088 -31.140 224 HE21 GLN 29 1HE2 GLN 29 -16.707 31.138 -30.194 225 HE22 GLN 29 2HE2 GLN 29 -18.304 31.306 -30.920 226 H ILE 30 H ILE 30 -12.245 32.648 -27.231 227 HA ILE 30 HA ILE 30 -13.443 31.346 -24.852 228 HB ILE 30 HB ILE 30 -10.717 32.674 -25.011 229 HG12 ILE 30 2HG1 ILE 30 -10.599 31.062 -26.754 230 HG13 ILE 30 3HG1 ILE 30 -9.749 30.430 -25.356 231 HG21 ILE 30 1HG2 ILE 30 -11.576 32.277 -22.756 232 HG22 ILE 30 2HG2 ILE 30 -11.947 30.588 -23.149 233 HG23 ILE 30 3HG2 ILE 30 -10.260 31.150 -23.100 234 HD11 ILE 30 3HD1 ILE 30 -11.707 28.978 -24.847 235 HD12 ILE 30 1HD1 ILE 30 -12.505 29.578 -26.328 236 HD13 ILE 30 2HD1 ILE 30 -10.996 28.663 -26.435 237 H ALA 31 H ALA 31 -14.950 32.644 -23.896 238 HA ALA 31 HA ALA 31 -14.353 35.531 -23.432 239 HB1 ALA 31 3HB ALA 31 -16.910 33.904 -23.169 240 HB2 ALA 31 1HB ALA 31 -16.743 35.618 -22.728 241 HB3 ALA 31 2HB ALA 31 -16.511 35.119 -24.411 242 H ARG 32 H ARG 32 -14.667 36.377 -21.302 243 HA ARG 32 HA ARG 32 -14.205 34.431 -19.074 244 HB2 ARG 32 2HB ARG 32 -12.815 37.005 -19.752 245 HB3 ARG 32 3HB ARG 32 -13.215 36.758 -18.045 246 HG2 ARG 32 2HG ARG 32 -12.091 34.676 -17.945 247 HG3 ARG 32 3HG ARG 32 -11.826 34.621 -19.699 248 HD2 ARG 32 2HD ARG 32 -10.198 36.343 -19.614 249 HD3 ARG 32 3HD ARG 32 -10.606 36.772 -17.935 250 HE ARG 32 HE ARG 32 -9.892 34.211 -17.582 251 HH11 ARG 32 1HH2 ARG 32 -8.071 36.625 -19.406 252 HH12 ARG 32 2HH2 ARG 32 -6.567 35.826 -19.032 253 HH21 ARG 32 1HH1 ARG 32 -8.025 33.228 -17.295 254 HH22 ARG 32 2HH1 ARG 32 -6.531 33.958 -17.855 255 H TYR 33 H TYR 33 -15.241 34.768 -17.137 256 HA TYR 33 HA TYR 33 -17.264 36.920 -16.984 257 HB2 TYR 33 2HB TYR 33 -17.935 33.999 -16.534 258 HB3 TYR 33 3HB TYR 33 -18.959 35.350 -16.159 259 HD1 TYR 33 HD1 TYR 33 -17.307 33.576 -19.018 260 HD2 TYR 33 HD2 TYR 33 -20.410 36.254 -17.728 261 HE1 TYR 33 HE1 TYR 33 -18.420 33.383 -21.246 262 HE2 TYR 33 HE2 TYR 33 -21.485 36.104 -19.961 263 HH TYR 33 HH TYR 33 -21.504 35.088 -21.941 264 H ARG 34 H ARG 34 -17.650 37.653 -14.960 265 HA ARG 34 HA ARG 34 -15.974 36.622 -12.705 266 HB2 ARG 34 2HB ARG 34 -15.456 38.887 -13.551 267 HB3 ARG 34 3HB ARG 34 -17.120 39.390 -13.263 268 HG2 ARG 34 2HG ARG 34 -16.878 39.094 -10.867 269 HG3 ARG 34 3HG ARG 34 -15.283 38.354 -11.053 270 HD2 ARG 34 2HD ARG 34 -15.493 40.996 -12.344 271 HD3 ARG 34 3HD ARG 34 -15.882 41.063 -10.626 272 HE ARG 34 HE ARG 34 -13.291 40.035 -11.782 273 HH11 ARG 34 1HH1 ARG 34 -14.839 41.679 -9.075 274 HH12 ARG 34 2HH1 ARG 34 -13.306 41.876 -8.271 275 HH21 ARG 34 1HH2 ARG 34 -11.538 40.314 -10.800 276 HH22 ARG 34 2HH2 ARG 34 -11.424 41.103 -9.222 277 H THR 35 H THR 35 -16.873 35.840 -10.971 278 HA THR 35 HA THR 35 -19.786 35.554 -10.746 279 HB THR 35 HB THR 35 -19.333 34.149 -8.793 280 HG1 THR 35 HG1 THR 35 -16.625 34.595 -9.312 281 HG21 THR 35 1HG2 THR 35 -18.042 32.392 -9.821 282 HG22 THR 35 2HG2 THR 35 -19.224 33.084 -10.955 283 HG23 THR 35 3HG2 THR 35 -17.498 33.481 -11.113 284 H ASP 36 H ASP 36 -20.569 35.663 -8.279 285 HA ASP 36 HA ASP 36 -20.528 38.475 -7.696 286 HB2 ASP 36 2HB ASP 36 -22.534 36.975 -7.509 287 HB3 ASP 36 3HB ASP 36 -21.778 36.181 -6.124 288 H ASN 37 H ASN 37 -18.491 35.888 -6.544 289 HA ASN 37 HA ASN 37 -17.665 37.531 -4.202 290 HB2 ASN 37 2HB ASN 37 -16.248 35.051 -4.987 291 HB3 ASN 37 3HB ASN 37 -16.392 35.805 -3.439 292 HD21 ASN 37 1HD2 ASN 37 -16.921 33.069 -4.500 293 HD22 ASN 37 2HD2 ASN 37 -18.526 32.686 -3.837 294 H GLY 38 H GLY 38 -17.146 37.885 -7.405 295 HA2 GLY 38 HA2 GLY 38 -15.532 39.060 -8.602 296 HA3 GLY 38 HA3 GLY 38 -14.428 39.027 -7.224 297 H GLU 39 H GLU 39 -15.623 35.889 -7.837 298 HA GLU 39 HA GLU 39 -12.947 35.034 -8.645 299 HB2 GLU 39 2HB GLU 39 -15.351 33.215 -8.740 300 HB3 GLU 39 3HB GLU 39 -13.681 32.838 -8.416 301 HG2 GLU 39 2HG GLU 39 -14.208 34.471 -6.287 302 HG3 GLU 39 3HG GLU 39 -15.854 33.944 -6.696 303 H GLU 40 H GLU 40 -12.251 35.192 -10.693 304 HA GLU 40 HA GLU 40 -14.179 35.353 -12.940 305 HB2 GLU 40 2HB GLU 40 -11.276 36.101 -12.567 306 HB3 GLU 40 3HB GLU 40 -11.989 35.955 -14.183 307 HG2 GLU 40 2HG GLU 40 -13.652 37.605 -13.725 308 HG3 GLU 40 3HG GLU 40 -13.237 37.666 -12.013 309 H PHE 41 H PHE 41 -14.479 33.820 -14.401 310 HA PHE 41 HA PHE 41 -12.502 31.600 -14.776 311 HB2 PHE 41 2HB PHE 41 -15.521 31.417 -14.628 312 HB3 PHE 41 3HB PHE 41 -14.465 30.113 -15.106 313 HD1 PHE 41 HD2 PHE 41 -15.564 32.189 -12.190 314 HD2 PHE 41 HD1 PHE 41 -13.077 28.904 -13.520 315 HE1 PHE 41 HE2 PHE 41 -15.214 31.483 -9.880 316 HE2 PHE 41 HE1 PHE 41 -12.689 28.248 -11.164 317 HZ PHE 41 HZ PHE 41 -13.743 29.549 -9.326 318 H GLU 42 H GLU 42 -12.736 30.449 -16.770 319 HA GLU 42 HA GLU 42 -13.463 32.233 -19.030 320 HB2 GLU 42 2HB GLU 42 -11.564 29.860 -19.176 321 HB3 GLU 42 3HB GLU 42 -11.845 31.168 -20.322 322 HG2 GLU 42 2HG GLU 42 -9.909 31.932 -19.420 323 HG3 GLU 42 3HG GLU 42 -11.093 32.733 -18.390 324 H VAL 43 H VAL 43 -14.834 31.646 -20.536 325 HA VAL 43 HA VAL 43 -15.906 28.845 -20.637 326 HB VAL 43 HB VAL 43 -17.493 31.362 -21.153 327 HG11 VAL 43 1HG1 VAL 43 -18.367 28.459 -20.871 328 HG12 VAL 43 2HG1 VAL 43 -19.388 29.873 -21.239 329 HG13 VAL 43 3HG1 VAL 43 -18.210 29.319 -22.416 330 HG21 VAL 43 3HG2 VAL 43 -18.622 31.007 -19.096 331 HG22 VAL 43 1HG2 VAL 43 -17.724 29.506 -18.758 332 HG23 VAL 43 2HG2 VAL 43 -16.920 31.093 -18.700 333 HA PRO 44 HA PRO 44 -14.500 29.427 -24.949 334 HB2 PRO 44 2HB PRO 44 -14.874 26.483 -24.982 335 HB3 PRO 44 3HB PRO 44 -13.482 27.428 -25.532 336 HG2 PRO 44 2HG PRO 44 -13.406 25.987 -23.208 337 HG3 PRO 44 3HG PRO 44 -12.624 27.596 -23.309 338 HD2 PRO 44 2HD PRO 44 -15.331 26.902 -22.144 339 HD3 PRO 44 3HD PRO 44 -14.046 27.993 -21.524 340 H PHE 45 H PHE 45 -15.880 29.935 -26.451 341 HA PHE 45 HA PHE 45 -18.477 28.463 -26.875 342 HB2 PHE 45 2HB PHE 45 -17.699 31.353 -27.280 343 HB3 PHE 45 3HB PHE 45 -19.062 30.668 -28.107 344 HD1 PHE 45 HD1 PHE 45 -17.664 31.522 -24.765 345 HD2 PHE 45 HD2 PHE 45 -21.165 30.261 -26.937 346 HE1 PHE 45 HE1 PHE 45 -19.070 32.003 -22.789 347 HE2 PHE 45 HE2 PHE 45 -22.570 30.768 -24.952 348 HZ PHE 45 HZ PHE 45 -21.500 31.586 -22.839 349 H ALA 46 H ALA 46 -19.031 27.865 -28.988 350 HA ALA 46 HA ALA 46 -16.783 27.615 -30.903 351 HB1 ALA 46 3HB ALA 46 -18.289 26.066 -32.073 352 HB2 ALA 46 1HB ALA 46 -18.144 25.627 -30.361 353 HB3 ALA 46 2HB ALA 46 -19.604 26.460 -30.944 354 H ASP 47 H ASP 47 -17.064 28.232 -33.172 355 HA ASP 47 HA ASP 47 -18.092 30.838 -33.617 356 HB2 ASP 47 2HB ASP 47 -16.291 29.780 -34.893 357 HB3 ASP 47 3HB ASP 47 -17.426 28.621 -35.589 358 H ASP 48 H ASP 48 -19.817 27.824 -33.683 359 HA ASP 48 HA ASP 48 -22.130 28.703 -35.223 360 HB2 ASP 48 2HB ASP 48 -21.378 26.334 -34.895 361 HB3 ASP 48 3HB ASP 48 -21.822 26.463 -33.195 362 H ALA 49 H ALA 49 -20.999 29.499 -32.120 363 HA ALA 49 HA ALA 49 -23.677 30.334 -31.092 364 HB1 ALA 49 3HB ALA 49 -21.222 29.433 -29.527 365 HB2 ALA 49 1HB ALA 49 -22.806 29.872 -28.857 366 HB3 ALA 49 2HB ALA 49 -22.649 28.422 -29.862 367 H GLU 50 H GLU 50 -23.403 32.046 -29.350 368 HA GLU 50 HA GLU 50 -21.240 34.029 -29.832 369 HB2 GLU 50 2HB GLU 50 -24.229 34.622 -29.764 370 HB3 GLU 50 3HB GLU 50 -22.980 35.848 -29.525 371 HG2 GLU 50 2HG GLU 50 -22.030 35.373 -31.748 372 HG3 GLU 50 3HG GLU 50 -23.265 34.144 -32.021 373 H ILE 51 H ILE 51 -21.139 35.600 -28.043 374 HA ILE 51 HA ILE 51 -21.231 34.305 -25.438 375 HB ILE 51 HB ILE 51 -20.212 37.091 -25.994 376 HG12 ILE 51 2HG1 ILE 51 -19.146 35.709 -27.670 377 HG13 ILE 51 3HG1 ILE 51 -17.989 36.237 -26.446 378 HG21 ILE 51 1HG2 ILE 51 -18.736 36.628 -24.088 379 HG22 ILE 51 2HG2 ILE 51 -20.425 36.402 -23.611 380 HG23 ILE 51 3HG2 ILE 51 -19.391 35.000 -23.937 381 HD11 ILE 51 3HD1 ILE 51 -18.143 33.932 -25.431 382 HD12 ILE 51 1HD1 ILE 51 -19.216 33.472 -26.772 383 HD13 ILE 51 2HD1 ILE 51 -17.540 33.953 -27.088 384 HA PRO 52 HA PRO 52 -24.968 36.792 -24.498 385 HB2 PRO 52 2HB PRO 52 -25.701 35.338 -22.297 386 HB3 PRO 52 3HB PRO 52 -26.081 34.835 -23.975 387 HG2 PRO 52 2HG PRO 52 -23.846 33.895 -22.171 388 HG3 PRO 52 3HG PRO 52 -24.912 32.920 -23.242 389 HD2 PRO 52 2HD PRO 52 -22.356 33.737 -23.916 390 HD3 PRO 52 3HD PRO 52 -23.620 33.475 -25.130 391 H GLY 53 H GLY 53 -25.251 38.338 -22.904 392 HA2 GLY 53 HA2 GLY 53 -23.142 39.652 -21.725 393 HA3 GLY 53 HA3 GLY 53 -24.812 39.776 -21.161 394 H THR 54 H THR 54 -24.893 36.923 -20.231 395 HA THR 54 HA THR 54 -22.719 36.785 -18.279 396 HB THR 54 HB THR 54 -24.317 36.211 -16.420 397 HG1 THR 54 HG1 THR 54 -26.351 37.091 -18.208 398 HG21 THR 54 1HG2 THR 54 -25.309 38.345 -15.905 399 HG22 THR 54 2HG2 THR 54 -23.736 38.621 -16.653 400 HG23 THR 54 3HG2 THR 54 -25.200 38.874 -17.601 401 H TRP 55 H TRP 55 -22.540 34.656 -17.201 402 HA TRP 55 HA TRP 55 -23.920 32.343 -18.334 403 HB2 TRP 55 2HB TRP 55 -22.168 33.001 -20.061 404 HB3 TRP 55 3HB TRP 55 -20.946 32.658 -18.846 405 HD1 TRP 55 HD1 TRP 55 -20.417 30.158 -18.343 406 HE1 TRP 55 HE1 TRP 55 -20.800 27.994 -19.623 407 HE3 TRP 55 HE3 TRP 55 -24.122 31.763 -21.433 408 HZ2 TRP 55 HZ2 TRP 55 -22.615 27.021 -21.684 409 HZ3 TRP 55 HZ3 TRP 55 -25.185 30.200 -23.064 410 HH2 TRP 55 HH2 TRP 55 -24.432 27.835 -23.198 411 H LEU 56 H LEU 56 -23.493 30.395 -17.133 412 HA LEU 56 HA LEU 56 -22.791 30.835 -14.376 413 HB2 LEU 56 2HB LEU 56 -24.325 29.001 -15.797 414 HB3 LEU 56 3HB LEU 56 -22.931 28.041 -15.305 415 HG LEU 56 HG LEU 56 -24.620 29.701 -13.390 416 HD11 LEU 56 1HD1 LEU 56 -25.979 27.925 -14.430 417 HD12 LEU 56 2HD1 LEU 56 -24.749 26.716 -13.999 418 HD13 LEU 56 3HD1 LEU 56 -25.658 27.564 -12.727 419 HD21 LEU 56 3HD2 LEU 56 -23.602 28.234 -11.667 420 HD22 LEU 56 1HD2 LEU 56 -22.594 27.467 -12.918 421 HD23 LEU 56 2HD2 LEU 56 -22.375 29.179 -12.517 422 H CYS 57 H CYS 57 -20.905 30.624 -13.351 423 HA CYS 57 HA CYS 57 -18.493 29.833 -14.876 424 HB2 CYS 57 2HB CYS 57 -18.951 31.343 -12.281 425 HB3 CYS 57 3HB CYS 57 -17.354 30.805 -12.800 426 HG CYS 57 HG CYS 57 -17.512 33.304 -13.396 427 H ARG 58 H ARG 58 -16.779 28.668 -13.726 428 HA ARG 58 HA ARG 58 -17.731 26.090 -12.970 429 HB2 ARG 58 2HB ARG 58 -14.876 27.061 -12.615 430 HB3 ARG 58 3HB ARG 58 -15.434 25.417 -12.908 431 HG2 ARG 58 2HG ARG 58 -16.198 26.126 -15.206 432 HG3 ARG 58 3HG ARG 58 -15.521 27.736 -14.893 433 HD2 ARG 58 2HD ARG 58 -13.287 26.602 -14.453 434 HD3 ARG 58 3HD ARG 58 -14.019 25.115 -15.089 435 HE ARG 58 HE ARG 58 -14.376 27.367 -16.898 436 HH11 ARG 58 1HH2 ARG 58 -11.968 24.982 -15.994 437 HH12 ARG 58 2HH2 ARG 58 -11.118 25.154 -17.505 438 HH21 ARG 58 1HH1 ARG 58 -13.228 27.599 -18.716 439 HH22 ARG 58 2HH1 ARG 58 -11.829 26.592 -19.030 440 H ASN 59 H ASN 59 -17.059 28.802 -10.976 441 HA ASN 59 HA ASN 59 -16.748 27.477 -8.450 442 HB2 ASN 59 2HB ASN 59 -16.130 29.774 -8.833 443 HB3 ASN 59 3HB ASN 59 -17.786 30.211 -9.272 444 HD21 ASN 59 1HD2 ASN 59 -17.810 31.897 -7.709 445 HD22 ASN 59 2HD2 ASN 59 -17.786 31.537 -5.997 446 H GLY 60 H GLY 60 -19.494 27.837 -10.525 447 HA2 GLY 60 HA2 GLY 60 -21.598 26.818 -10.284 448 HA3 GLY 60 HA3 GLY 60 -21.376 26.686 -8.538 449 H MET 61 H MET 61 -20.571 29.800 -9.837 450 HA MET 61 HA MET 61 -23.220 30.914 -9.063 451 HB2 MET 61 2HB MET 61 -21.208 31.462 -7.587 452 HB3 MET 61 3HB MET 61 -20.534 32.343 -8.935 453 HG2 MET 61 2HG MET 61 -21.709 33.824 -7.358 454 HG3 MET 61 3HG MET 61 -22.406 33.892 -8.975 455 HE1 MET 61 3HE MET 61 -23.927 35.128 -6.427 456 HE2 MET 61 1HE MET 61 -24.495 35.153 -8.116 457 HE3 MET 61 2HE MET 61 -25.569 34.584 -6.818 458 H GLU 62 H GLU 62 -24.100 32.559 -10.341 459 HA GLU 62 HA GLU 62 -23.552 32.467 -13.182 460 HB2 GLU 62 2HB GLU 62 -25.308 34.297 -11.510 461 HB3 GLU 62 3HB GLU 62 -25.212 34.327 -13.279 462 HG2 GLU 62 2HG GLU 62 -25.929 31.953 -13.366 463 HG3 GLU 62 3HG GLU 62 -26.065 31.922 -11.607 464 H GLY 63 H GLY 63 -21.784 33.292 -14.057 465 HA2 GLY 63 HA2 GLY 63 -20.400 35.608 -12.921 466 HA3 GLY 63 HA3 GLY 63 -19.832 34.605 -14.237 467 H THR 64 H THR 64 -20.070 37.567 -14.020 468 HA THR 64 HA THR 64 -21.768 38.047 -16.431 469 HB THR 64 HB THR 64 -20.574 40.073 -14.500 470 HG1 THR 64 HG1 THR 64 -22.262 38.900 -13.575 471 HG21 THR 64 1HG2 THR 64 -22.247 41.643 -15.591 472 HG22 THR 64 2HG2 THR 64 -20.890 41.180 -16.621 473 HG23 THR 64 3HG2 THR 64 -22.477 40.424 -16.865 474 H LEU 65 H LEU 65 -20.953 38.872 -18.291 475 HA LEU 65 HA LEU 65 -18.342 38.097 -19.007 476 HB2 LEU 65 2HB LEU 65 -20.452 38.245 -20.353 477 HB3 LEU 65 3HB LEU 65 -20.277 39.977 -20.396 478 HG LEU 65 HG LEU 65 -18.646 37.792 -21.743 479 HD11 LEU 65 1HD1 LEU 65 -20.100 40.256 -22.805 480 HD12 LEU 65 2HD1 LEU 65 -19.345 38.981 -23.781 481 HD13 LEU 65 3HD1 LEU 65 -20.755 38.607 -22.776 482 HD21 LEU 65 3HD2 LEU 65 -17.257 39.562 -22.830 483 HD22 LEU 65 1HD2 LEU 65 -17.851 40.726 -21.623 484 HD23 LEU 65 2HD2 LEU 65 -16.885 39.300 -21.136 485 H ILE 66 H ILE 66 -16.427 39.056 -18.667 486 HA ILE 66 HA ILE 66 -16.202 42.025 -18.553 487 HB ILE 66 HB ILE 66 -14.494 41.959 -16.905 488 HG12 ILE 66 2HG1 ILE 66 -13.363 39.866 -17.176 489 HG13 ILE 66 3HG1 ILE 66 -13.938 39.984 -15.519 490 HG21 ILE 66 1HG2 ILE 66 -15.785 41.456 -14.921 491 HG22 ILE 66 2HG2 ILE 66 -16.797 42.230 -16.156 492 HG23 ILE 66 3HG2 ILE 66 -16.928 40.489 -15.867 493 HD11 ILE 66 3HD1 ILE 66 -14.987 38.264 -17.699 494 HD12 ILE 66 1HD1 ILE 66 -14.283 37.771 -16.152 495 HD13 ILE 66 2HD1 ILE 66 -15.886 38.537 -16.196 496 H GLU 67 H GLU 67 -14.239 42.935 -19.249 497 HA GLU 67 HA GLU 67 -12.861 41.496 -21.373 498 HB2 GLU 67 2HB GLU 67 -13.399 44.022 -21.283 499 HB3 GLU 67 3HB GLU 67 -12.045 44.156 -20.165 500 HG2 GLU 67 2HG GLU 67 -11.229 44.703 -22.334 501 HG3 GLU 67 3HG GLU 67 -10.569 43.122 -21.952 502 H GLY 68 H GLY 68 -10.851 40.582 -21.352 503 HA2 GLY 68 HA2 GLY 68 -8.873 40.821 -19.288 504 HA3 GLY 68 HA3 GLY 68 -9.909 39.427 -18.956 505 H ASP 69 H ASP 69 -8.504 40.813 -21.980 506 HA ASP 69 HA ASP 69 -6.983 38.341 -22.497 507 HB2 ASP 69 2HB ASP 69 -9.174 37.919 -23.522 508 HB3 ASP 69 3HB ASP 69 -9.096 39.457 -24.383 509 H LEU 70 H LEU 70 -5.051 38.860 -23.166 510 HA LEU 70 HA LEU 70 -4.466 41.538 -24.353 511 HB2 LEU 70 2HB LEU 70 -2.767 39.778 -22.555 512 HB3 LEU 70 3HB LEU 70 -2.153 41.143 -23.461 513 HG LEU 70 HG LEU 70 -2.407 41.790 -21.217 514 HD11 LEU 70 1HD1 LEU 70 -3.719 43.804 -21.426 515 HD12 LEU 70 2HD1 LEU 70 -2.893 43.485 -22.961 516 HD13 LEU 70 3HD1 LEU 70 -4.631 43.137 -22.792 517 HD21 LEU 70 3HD2 LEU 70 -4.238 40.215 -20.547 518 HD22 LEU 70 1HD2 LEU 70 -4.413 41.873 -19.947 519 HD23 LEU 70 2HD2 LEU 70 -5.403 41.329 -21.306 520 HA PRO 71 HA PRO 71 -3.043 39.315 -27.917 521 HB2 PRO 71 2HB PRO 71 -1.867 41.271 -29.363 522 HB3 PRO 71 3HB PRO 71 -3.599 41.333 -28.935 523 HG2 PRO 71 2HG PRO 71 -1.298 42.690 -27.478 524 HG3 PRO 71 3HG PRO 71 -2.819 43.432 -28.071 525 HD2 PRO 71 2HD PRO 71 -2.516 42.557 -25.492 526 HD3 PRO 71 3HD PRO 71 -4.080 42.456 -26.355 527 H GLU 72 H GLU 72 -1.690 38.183 -26.195 528 HA GLU 72 HA GLU 72 0.240 37.492 -25.176 529 HB2 GLU 72 2HB GLU 72 1.737 36.354 -26.825 530 HB3 GLU 72 3HB GLU 72 0.035 35.933 -26.831 531 HG2 GLU 72 2HG GLU 72 -0.387 37.191 -28.849 532 HG3 GLU 72 3HG GLU 72 1.229 37.888 -28.820 533 HA PRO 73 HA PRO 73 2.558 41.527 -25.233 534 HB2 PRO 73 2HB PRO 73 2.627 40.600 -22.347 535 HB3 PRO 73 3HB PRO 73 2.590 42.272 -22.981 536 HG2 PRO 73 2HG PRO 73 0.302 41.124 -22.131 537 HG3 PRO 73 3HG PRO 73 0.296 42.009 -23.692 538 HD2 PRO 73 2HD PRO 73 0.457 39.027 -23.224 539 HD3 PRO 73 3HD PRO 73 -0.506 39.946 -24.419 540 H LYS 74 H LYS 74 4.703 41.852 -25.343 541 HA LYS 74 HA LYS 74 6.694 39.914 -24.340 542 HB2 LYS 74 2HB LYS 74 5.766 39.316 -26.737 543 HB3 LYS 74 3HB LYS 74 6.760 40.665 -27.287 544 HG2 LYS 74 2HG LYS 74 8.776 39.531 -26.358 545 HG3 LYS 74 3HG LYS 74 7.747 38.242 -25.702 546 HD2 LYS 74 2HD LYS 74 6.979 37.754 -28.059 547 HD3 LYS 74 3HD LYS 74 8.181 38.901 -28.653 548 HE2 LYS 74 2HE LYS 74 8.771 36.413 -26.974 549 HE3 LYS 74 3HE LYS 74 8.868 36.478 -28.733 550 HZ1 LYS 74 HZ1 LYS 74 10.613 38.165 -28.521 551 HZ2 LYS 74 HZ2 LYS 74 10.552 38.083 -26.884 552 HZ3 LYS 74 HZ3 LYS 74 11.043 36.796 -27.751 553 H LYS 75 H LYS 75 8.939 40.761 -24.660 554 HA LYS 75 HA LYS 75 10.465 42.369 -24.032 555 HB2 LYS 75 2HB LYS 75 9.131 43.923 -26.283 556 HB3 LYS 75 3HB LYS 75 10.735 44.228 -25.607 557 HG2 LYS 75 2HG LYS 75 11.469 41.959 -26.333 558 HG3 LYS 75 3HG LYS 75 9.885 41.713 -27.100 559 HD2 LYS 75 2HD LYS 75 10.268 43.699 -28.538 560 HD3 LYS 75 3HD LYS 75 11.855 43.942 -27.777 561 HE2 LYS 75 2HE LYS 75 12.567 41.690 -28.562 562 HE3 LYS 75 3HE LYS 75 10.991 41.463 -29.335 563 HZ1 LYS 75 HZ1 LYS 75 11.491 43.381 -30.758 564 HZ2 LYS 75 HZ2 LYS 75 12.946 43.588 -30.044 565 HZ3 LYS 75 HZ3 LYS 75 12.653 42.248 -30.924 566 H VAL 76 H VAL 76 8.417 42.347 -22.286 567 HA VAL 76 HA VAL 76 7.051 43.404 -20.860 568 HB VAL 76 HB VAL 76 8.088 45.002 -19.390 569 HG11 VAL 76 1HG1 VAL 76 8.552 42.596 -19.186 570 HG12 VAL 76 2HG1 VAL 76 9.998 42.787 -20.205 571 HG13 VAL 76 3HG1 VAL 76 9.904 43.594 -18.629 572 HG21 VAL 76 3HG2 VAL 76 10.519 45.010 -21.222 573 HG22 VAL 76 1HG2 VAL 76 9.395 46.373 -21.036 574 HG23 VAL 76 2HG2 VAL 76 10.348 45.815 -19.653 575 H LYS 77 H LYS 77 6.342 44.175 -23.462 576 HA LYS 77 HA LYS 77 4.970 46.768 -22.848 577 HB2 LYS 77 2HB LYS 77 6.761 47.026 -24.514 578 HB3 LYS 77 3HB LYS 77 5.975 45.830 -25.552 579 HG2 LYS 77 2HG LYS 77 3.961 47.294 -25.700 580 HG3 LYS 77 3HG LYS 77 4.736 48.465 -24.616 581 HD2 LYS 77 2HD LYS 77 6.555 48.795 -26.273 582 HD3 LYS 77 3HD LYS 77 5.779 47.617 -27.356 583 HE2 LYS 77 2HE LYS 77 3.747 49.045 -27.449 584 HE3 LYS 77 3HE LYS 77 4.515 50.215 -26.366 585 HZ1 LYS 77 HZ1 LYS 77 6.221 50.574 -28.072 586 HZ2 LYS 77 HZ2 LYS 77 5.513 49.492 -29.072 587 HZ3 LYS 77 HZ3 LYS 77 4.743 50.878 -28.691 588 HA PRO 78 HA PRO 78 3.188 47.045 -21.737 589 HB2 PRO 78 2HB PRO 78 1.162 46.030 -20.199 590 HB3 PRO 78 3HB PRO 78 0.888 47.077 -21.622 591 HG2 PRO 78 2HG PRO 78 0.840 44.034 -21.525 592 HG3 PRO 78 3HG PRO 78 -0.417 45.138 -22.182 593 HD2 PRO 78 2HD PRO 78 1.406 44.028 -23.832 594 HD3 PRO 78 3HD PRO 78 0.950 45.739 -24.032 595 HA PRO 79 HA PRO 79 5.725 44.688 -19.034 596 HB2 PRO 79 2HB PRO 79 4.511 46.046 -16.639 597 HB3 PRO 79 3HB PRO 79 6.231 45.922 -17.118 598 HG2 PRO 79 2HG PRO 79 4.868 48.227 -17.515 599 HG3 PRO 79 3HG PRO 79 5.958 47.602 -18.798 600 HD2 PRO 79 2HD PRO 79 2.943 47.308 -18.587 601 HD3 PRO 79 3HD PRO 79 3.940 47.814 -19.983 602 H ARG 80 H ARG 80 2.330 44.629 -18.102 603 HA ARG 80 HA ARG 80 2.486 41.826 -17.183 604 HB2 ARG 80 2HB ARG 80 2.896 43.250 -15.168 605 HB3 ARG 80 3HB ARG 80 1.349 44.063 -15.443 606 HG2 ARG 80 2HG ARG 80 0.153 41.918 -15.107 607 HG3 ARG 80 3HG ARG 80 1.703 41.073 -14.918 608 HD2 ARG 80 2HD ARG 80 2.220 42.457 -12.936 609 HD3 ARG 80 3HD ARG 80 0.692 43.318 -13.111 610 HE ARG 80 HE ARG 80 1.129 40.582 -12.102 611 HH11 ARG 80 1HH2 ARG 80 -1.336 42.854 -13.133 612 HH12 ARG 80 2HH2 ARG 80 -2.602 41.974 -12.321 613 HH21 ARG 80 1HH1 ARG 80 -0.530 39.525 -11.099 614 HH22 ARG 80 2HH1 ARG 80 -2.154 40.144 -11.204 Start of MODEL 3 1 H1 SER 1 1H SER 1 1.326 44.928 -36.683 2 H2 SER 1 2H SER 1 1.004 45.599 -35.220 3 H3 SER 1 3H SER 1 -0.079 45.737 -36.441 4 HA SER 1 HA SER 1 0.720 43.216 -35.153 5 HB2 SER 1 2HB SER 1 -1.887 44.756 -34.836 6 HB3 SER 1 3HB SER 1 -1.472 43.202 -34.082 7 HG SER 1 HG SER 1 -1.083 44.969 -32.673 8 H MET 2 H MET 2 -0.540 41.356 -35.778 9 HA MET 2 HA MET 2 -1.283 41.301 -38.607 10 HB2 MET 2 2HB MET 2 -1.358 39.189 -36.418 11 HB3 MET 2 3HB MET 2 -1.805 38.900 -38.104 12 HG2 MET 2 2HG MET 2 0.442 39.622 -38.836 13 HG3 MET 2 3HG MET 2 0.938 39.801 -37.153 14 HE1 MET 2 3HE MET 2 1.674 37.870 -35.600 15 HE2 MET 2 1HE MET 2 -0.037 37.395 -35.528 16 HE3 MET 2 2HE MET 2 1.210 36.172 -35.840 17 H ALA 3 H ALA 3 -3.284 40.426 -39.396 18 HA ALA 3 HA ALA 3 -5.715 40.775 -37.728 19 HB1 ALA 3 3HB ALA 3 -5.324 41.888 -40.542 20 HB2 ALA 3 1HB ALA 3 -6.829 41.930 -39.600 21 HB3 ALA 3 2HB ALA 3 -5.417 42.848 -39.048 22 H ASP 4 H ASP 4 -7.624 39.707 -38.768 23 HA ASP 4 HA ASP 4 -8.630 37.743 -39.262 24 HB2 ASP 4 2HB ASP 4 -7.640 38.458 -41.586 25 HB3 ASP 4 3HB ASP 4 -6.587 37.063 -41.367 26 H ARG 5 H ARG 5 -7.734 35.119 -39.852 27 HA ARG 5 HA ARG 5 -6.687 34.286 -37.273 28 HB2 ARG 5 2HB ARG 5 -6.854 32.058 -38.055 29 HB3 ARG 5 3HB ARG 5 -8.246 32.923 -38.703 30 HG2 ARG 5 2HG ARG 5 -6.925 33.183 -40.886 31 HG3 ARG 5 3HG ARG 5 -5.706 32.109 -40.178 32 HD2 ARG 5 2HD ARG 5 -7.480 30.359 -39.890 33 HD3 ARG 5 3HD ARG 5 -8.615 31.445 -40.719 34 HE ARG 5 HE ARG 5 -6.045 30.683 -42.038 35 HH11 ARG 5 2HH1 ARG 5 -9.558 30.203 -42.065 36 HH12 ARG 5 1HH1 ARG 5 -9.483 29.609 -43.716 37 HH21 ARG 5 1HH2 ARG 5 -6.172 30.061 -44.187 38 HH22 ARG 5 2HH2 ARG 5 -7.715 29.530 -44.825 39 H VAL 6 H VAL 6 -4.621 33.590 -36.686 40 HA VAL 6 HA VAL 6 -2.568 34.905 -38.367 41 HB VAL 6 HB VAL 6 -1.135 34.925 -36.392 42 HG11 VAL 6 1HG1 VAL 6 -2.545 36.831 -37.076 43 HG12 VAL 6 2HG1 VAL 6 -3.871 36.227 -36.064 44 HG13 VAL 6 3HG1 VAL 6 -2.353 36.761 -35.316 45 HG21 VAL 6 3HG2 VAL 6 -3.606 34.077 -34.840 46 HG22 VAL 6 1HG2 VAL 6 -2.145 33.081 -35.045 47 HG23 VAL 6 2HG2 VAL 6 -2.059 34.611 -34.166 48 H LEU 7 H LEU 7 -1.235 33.991 -39.546 49 HA LEU 7 HA LEU 7 0.203 32.588 -40.546 50 HB2 LEU 7 2HB LEU 7 0.855 31.762 -37.704 51 HB3 LEU 7 3HB LEU 7 1.919 31.632 -39.099 52 HG LEU 7 HG LEU 7 0.937 34.244 -37.872 53 HD11 LEU 7 1HD1 LEU 7 3.677 32.923 -37.845 54 HD12 LEU 7 2HD1 LEU 7 3.260 34.507 -37.150 55 HD13 LEU 7 3HD1 LEU 7 2.557 33.032 -36.469 56 HD21 LEU 7 3HD2 LEU 7 2.632 35.304 -39.347 57 HD22 LEU 7 1HD2 LEU 7 2.919 33.737 -40.136 58 HD23 LEU 7 2HD2 LEU 7 1.341 34.546 -40.280 59 H ARG 8 H ARG 8 -2.496 31.338 -40.093 60 HA ARG 8 HA ARG 8 -1.772 28.449 -40.432 61 HB2 ARG 8 2HB ARG 8 -3.750 29.681 -38.475 62 HB3 ARG 8 3HB ARG 8 -3.774 27.968 -38.904 63 HG2 ARG 8 2HG ARG 8 -1.575 27.590 -37.987 64 HG3 ARG 8 3HG ARG 8 -1.305 29.320 -37.740 65 HD2 ARG 8 2HD ARG 8 -3.244 29.384 -36.174 66 HD3 ARG 8 3HD ARG 8 -3.412 27.638 -36.351 67 HE ARG 8 HE ARG 8 -1.607 27.319 -34.938 68 HH11 ARG 8 2HH2 ARG 8 -1.439 30.708 -35.938 69 HH12 ARG 8 1HH2 ARG 8 -0.260 31.065 -34.705 70 HH21 ARG 8 1HH1 ARG 8 -0.084 27.886 -33.443 71 HH22 ARG 8 2HH1 ARG 8 0.499 29.521 -33.364 72 H GLY 9 H GLY 9 -3.243 27.134 -41.410 73 HA2 GLY 9 HA2 GLY 9 -5.833 28.042 -42.388 74 HA3 GLY 9 HA3 GLY 9 -4.637 27.846 -43.678 75 H SER 10 H SER 10 -4.235 25.605 -41.054 76 HA SER 10 HA SER 10 -4.986 23.372 -42.781 77 HB2 SER 10 2HB SER 10 -4.005 22.022 -40.903 78 HB3 SER 10 3HB SER 10 -2.908 23.182 -41.670 79 HG SER 10 HG SER 10 -2.777 23.256 -39.381 80 H ARG 11 H ARG 11 -6.170 21.556 -41.966 81 HA ARG 11 HA ARG 11 -8.194 20.644 -41.544 82 HB2 ARG 11 2HB ARG 11 -6.815 20.855 -39.272 83 HB3 ARG 11 3HB ARG 11 -8.184 21.869 -38.810 84 HG2 ARG 11 2HG ARG 11 -9.693 19.886 -39.517 85 HG3 ARG 11 3HG ARG 11 -8.207 18.957 -39.727 86 HD2 ARG 11 2HD ARG 11 -8.973 18.392 -37.558 87 HD3 ARG 11 3HD ARG 11 -7.637 19.507 -37.299 88 HE ARG 11 HE ARG 11 -9.122 21.109 -36.438 89 HH11 ARG 11 1HH2 ARG 11 -11.077 18.520 -37.800 90 HH12 ARG 11 2HH2 ARG 11 -12.539 19.167 -37.107 91 HH21 ARG 11 1HH1 ARG 11 -10.938 21.847 -35.644 92 HH22 ARG 11 2HH1 ARG 11 -12.475 21.026 -35.892 93 H LEU 12 H LEU 12 -10.522 23.306 -42.358 94 HA LEU 12 HA LEU 12 -7.794 23.418 -43.299 95 HB2 LEU 12 2HB LEU 12 -8.318 21.002 -43.740 96 HB3 LEU 12 3HB LEU 12 -9.760 21.490 -44.619 97 HG LEU 12 HG LEU 12 -8.332 22.610 -46.330 98 HD11 LEU 12 1HD1 LEU 12 -5.890 22.135 -46.349 99 HD12 LEU 12 2HD1 LEU 12 -6.337 23.173 -45.001 100 HD13 LEU 12 3HD1 LEU 12 -6.014 21.445 -44.718 101 HD21 LEU 12 3HD2 LEU 12 -9.027 20.260 -46.610 102 HD22 LEU 12 1HD2 LEU 12 -7.435 20.555 -47.326 103 HD23 LEU 12 2HD2 LEU 12 -7.560 19.718 -45.762 104 H GLY 13 H GLY 13 -7.667 25.228 -44.436 105 HA2 GLY 13 HA2 GLY 13 -8.024 26.791 -46.058 106 HA3 GLY 13 HA3 GLY 13 -9.388 25.845 -46.641 107 H ALA 14 H ALA 14 -11.277 25.978 -44.770 108 HA ALA 14 HA ALA 14 -12.198 28.724 -45.117 109 HB1 ALA 14 3HB ALA 14 -13.523 26.760 -45.797 110 HB2 ALA 14 1HB ALA 14 -13.608 26.221 -44.105 111 HB3 ALA 14 2HB ALA 14 -14.391 27.737 -44.602 112 H VAL 15 H VAL 15 -13.610 29.717 -43.535 113 HA VAL 15 HA VAL 15 -14.092 30.838 -41.696 114 HB VAL 15 HB VAL 15 -13.172 28.512 -39.995 115 HG11 VAL 15 1HG1 VAL 15 -15.140 29.283 -38.590 116 HG12 VAL 15 2HG1 VAL 15 -13.812 30.436 -38.654 117 HG13 VAL 15 3HG1 VAL 15 -15.274 30.698 -39.638 118 HG21 VAL 15 3HG2 VAL 15 -15.487 27.649 -40.172 119 HG22 VAL 15 1HG2 VAL 15 -15.837 28.858 -41.431 120 HG23 VAL 15 2HG2 VAL 15 -14.640 27.568 -41.710 121 H SER 16 H SER 16 -13.460 32.337 -40.330 122 HA SER 16 HA SER 16 -10.581 32.550 -39.603 123 HB2 SER 16 2HB SER 16 -10.811 34.983 -39.995 124 HB3 SER 16 3HB SER 16 -10.923 33.998 -41.463 125 HG SER 16 HG SER 16 -12.518 35.646 -41.387 126 H TYR 17 H TYR 17 -10.137 33.124 -37.564 127 HA TYR 17 HA TYR 17 -12.050 34.333 -35.739 128 HB2 TYR 17 2HB TYR 17 -12.241 32.487 -34.205 129 HB3 TYR 17 3HB TYR 17 -12.857 31.999 -35.758 130 HD1 TYR 17 HD2 TYR 17 -11.329 30.560 -37.294 131 HD2 TYR 17 HD1 TYR 17 -10.663 31.139 -33.066 132 HE1 TYR 17 HE2 TYR 17 -9.989 28.480 -37.231 133 HE2 TYR 17 HE1 TYR 17 -9.320 29.028 -33.006 134 HH TYR 17 HH TYR 17 -8.729 27.075 -35.946 135 H GLU 18 H GLU 18 -11.074 34.271 -33.445 136 HA GLU 18 HA GLU 18 -8.595 35.645 -33.571 137 HB2 GLU 18 2HB GLU 18 -8.851 35.800 -31.095 138 HB3 GLU 18 3HB GLU 18 -10.235 36.340 -32.015 139 HG2 GLU 18 2HG GLU 18 -10.311 33.465 -31.142 140 HG3 GLU 18 3HG GLU 18 -10.357 34.670 -29.863 141 H THR 19 H THR 19 -8.662 32.437 -33.882 142 HA THR 19 HA THR 19 -7.138 30.753 -33.658 143 HB THR 19 HB THR 19 -5.061 32.945 -33.658 144 HG1 THR 19 HG1 THR 19 -6.891 33.143 -35.218 145 HG21 THR 19 1HG2 THR 19 -5.207 30.196 -34.982 146 HG22 THR 19 2HG2 THR 19 -3.901 31.380 -35.208 147 HG23 THR 19 3HG2 THR 19 -4.150 30.638 -33.622 148 H ASP 20 H ASP 20 -8.120 30.641 -31.366 149 HA ASP 20 HA ASP 20 -6.630 31.335 -29.065 150 HB2 ASP 20 2HB ASP 20 -8.939 30.763 -28.894 151 HB3 ASP 20 3HB ASP 20 -8.676 29.174 -29.616 152 H ARG 21 H ARG 21 -5.350 30.172 -27.631 153 HA ARG 21 HA ARG 21 -3.297 28.604 -29.014 154 HB2 ARG 21 2HB ARG 21 -3.349 29.871 -26.249 155 HB3 ARG 21 3HB ARG 21 -1.942 29.108 -26.998 156 HG2 ARG 21 2HG ARG 21 -2.074 30.738 -28.889 157 HG3 ARG 21 3HG ARG 21 -3.373 31.592 -28.048 158 HD2 ARG 21 2HD ARG 21 -0.567 31.135 -26.956 159 HD3 ARG 21 3HD ARG 21 -1.128 32.622 -27.737 160 HE ARG 21 HE ARG 21 -2.938 32.142 -25.650 161 HH11 ARG 21 1HH2 ARG 21 0.483 32.863 -25.861 162 HH12 ARG 21 2HH2 ARG 21 0.513 33.621 -24.292 163 HH21 ARG 21 1HH1 ARG 21 -2.827 33.113 -23.653 164 HH22 ARG 21 2HH1 ARG 21 -1.317 33.759 -23.084 165 H ASN 22 H ASN 22 -5.956 27.488 -27.291 166 HA ASN 22 HA ASN 22 -4.663 25.276 -25.916 167 HB2 ASN 22 2HB ASN 22 -7.545 25.628 -26.833 168 HB3 ASN 22 3HB ASN 22 -6.958 24.255 -25.918 169 HD21 ASN 22 2HD2 ASN 22 -7.697 27.696 -25.738 170 HD22 ASN 22 1HD2 ASN 22 -7.565 27.781 -23.978 171 H HIS 23 H HIS 23 -4.997 22.994 -26.514 172 HA HIS 23 HA HIS 23 -3.192 22.743 -28.653 173 HB2 HIS 23 2HB HIS 23 -4.389 20.560 -26.925 174 HB3 HIS 23 3HB HIS 23 -2.882 20.467 -27.838 175 HD2 HIS 23 HD2 HIS 23 -4.059 21.178 -24.433 176 HE1 HIS 23 HE1 HIS 23 -0.352 23.279 -24.653 177 HE2 HIS 23 HE2 HIS 23 -2.168 22.427 -23.084 178 H ASP 24 H ASP 24 -5.971 23.199 -29.702 179 HA ASP 24 HA ASP 24 -5.572 21.506 -32.002 180 HB2 ASP 24 2HB ASP 24 -7.241 20.285 -30.367 181 HB3 ASP 24 3HB ASP 24 -8.419 21.434 -30.986 182 H LEU 25 H LEU 25 -6.945 22.117 -33.806 183 HA LEU 25 HA LEU 25 -7.553 25.063 -33.810 184 HB2 LEU 25 2HB LEU 25 -6.712 23.271 -36.107 185 HB3 LEU 25 3HB LEU 25 -7.163 24.969 -36.244 186 HG LEU 25 HG LEU 25 -4.771 23.880 -34.690 187 HD11 LEU 25 1HD1 LEU 25 -4.535 23.774 -37.141 188 HD12 LEU 25 2HD1 LEU 25 -4.924 25.501 -37.263 189 HD13 LEU 25 3HD1 LEU 25 -3.441 24.970 -36.434 190 HD21 LEU 25 3HD2 LEU 25 -4.079 26.259 -34.488 191 HD22 LEU 25 1HD2 LEU 25 -5.648 26.765 -35.163 192 HD23 LEU 25 2HD2 LEU 25 -5.558 25.930 -33.595 193 H ALA 26 H ALA 26 -9.559 25.495 -33.640 194 HA ALA 26 HA ALA 26 -11.627 24.347 -35.297 195 HB1 ALA 26 3HB ALA 26 -11.576 22.640 -33.507 196 HB2 ALA 26 1HB ALA 26 -11.754 23.904 -32.278 197 HB3 ALA 26 2HB ALA 26 -13.068 23.594 -33.431 198 HA PRO 27 HA PRO 27 -12.446 28.719 -34.740 199 HB2 PRO 27 2HB PRO 27 -15.176 27.951 -35.793 200 HB3 PRO 27 3HB PRO 27 -14.149 29.358 -36.226 201 HG2 PRO 27 2HG PRO 27 -14.195 27.168 -37.810 202 HG3 PRO 27 3HG PRO 27 -12.618 27.927 -37.411 203 HD2 PRO 27 2HD PRO 27 -13.917 25.493 -36.155 204 HD3 PRO 27 3HD PRO 27 -12.222 25.744 -36.689 205 H ARG 28 H ARG 28 -12.448 29.233 -32.677 206 HA ARG 28 HA ARG 28 -14.984 29.199 -31.136 207 HB2 ARG 28 2HB ARG 28 -13.952 28.216 -29.204 208 HB3 ARG 28 3HB ARG 28 -13.713 27.165 -30.602 209 HG2 ARG 28 2HG ARG 28 -11.384 28.143 -30.867 210 HG3 ARG 28 3HG ARG 28 -11.648 29.026 -29.363 211 HD2 ARG 28 2HD ARG 28 -11.922 26.939 -28.125 212 HD3 ARG 28 3HD ARG 28 -11.864 25.994 -29.614 213 HE ARG 28 HE ARG 28 -9.579 27.271 -28.211 214 HH11 ARG 28 2HH1 ARG 28 -10.475 25.692 -31.250 215 HH12 ARG 28 1HH1 ARG 28 -8.829 25.048 -31.384 216 HH21 ARG 28 1HH2 ARG 28 -7.607 26.753 -28.745 217 HH22 ARG 28 2HH2 ARG 28 -7.263 25.689 -30.121 218 H GLN 29 H GLN 29 -14.919 30.340 -29.129 219 HA GLN 29 HA GLN 29 -13.357 32.881 -29.089 220 HB2 GLN 29 2HB GLN 29 -16.366 32.665 -28.683 221 HB3 GLN 29 3HB GLN 29 -15.391 34.130 -28.669 222 HG2 GLN 29 2HG GLN 29 -15.734 34.412 -30.874 223 HG3 GLN 29 3HG GLN 29 -15.043 32.829 -31.230 224 HE21 GLN 29 1HE2 GLN 29 -16.736 31.011 -30.182 225 HE22 GLN 29 2HE2 GLN 29 -18.328 31.174 -30.913 226 H ILE 30 H ILE 30 -12.226 32.332 -27.200 227 HA ILE 30 HA ILE 30 -13.606 31.460 -24.780 228 HB ILE 30 HB ILE 30 -10.752 32.351 -25.298 229 HG12 ILE 30 2HG1 ILE 30 -10.204 29.993 -24.880 230 HG13 ILE 30 3HG1 ILE 30 -11.915 29.612 -24.673 231 HG21 ILE 30 1HG2 ILE 30 -12.049 31.222 -22.768 232 HG22 ILE 30 2HG2 ILE 30 -10.299 31.403 -23.018 233 HG23 ILE 30 3HG2 ILE 30 -11.320 32.834 -22.951 234 HD11 ILE 30 3HD1 ILE 30 -10.765 30.581 -27.300 235 HD12 ILE 30 1HD1 ILE 30 -10.834 28.872 -26.822 236 HD13 ILE 30 2HD1 ILE 30 -12.334 29.777 -27.004 237 H ALA 31 H ALA 31 -14.960 32.828 -23.885 238 HA ALA 31 HA ALA 31 -14.179 35.667 -23.376 239 HB1 ALA 31 3HB ALA 31 -16.539 35.855 -22.577 240 HB2 ALA 31 1HB ALA 31 -16.400 35.424 -24.289 241 HB3 ALA 31 2HB ALA 31 -16.818 34.176 -23.093 242 H ARG 32 H ARG 32 -14.559 36.474 -21.195 243 HA ARG 32 HA ARG 32 -14.099 34.483 -19.004 244 HB2 ARG 32 2HB ARG 32 -12.820 37.151 -19.557 245 HB3 ARG 32 3HB ARG 32 -13.157 36.734 -17.878 246 HG2 ARG 32 2HG ARG 32 -11.777 34.844 -17.863 247 HG3 ARG 32 3HG ARG 32 -11.708 34.756 -19.629 248 HD2 ARG 32 2HD ARG 32 -9.615 35.605 -18.924 249 HD3 ARG 32 3HD ARG 32 -10.504 36.960 -19.646 250 HE ARG 32 HE ARG 32 -11.002 37.092 -16.873 251 HH11 ARG 32 2HH2 ARG 32 -8.141 37.307 -18.895 252 HH12 ARG 32 1HH2 ARG 32 -7.446 38.569 -17.916 253 HH21 ARG 32 1HH1 ARG 32 -10.014 38.587 -15.613 254 HH22 ARG 32 2HH1 ARG 32 -8.417 39.183 -16.034 255 H TYR 33 H TYR 33 -15.187 34.785 -17.094 256 HA TYR 33 HA TYR 33 -17.186 36.960 -16.952 257 HB2 TYR 33 2HB TYR 33 -17.877 34.037 -16.527 258 HB3 TYR 33 3HB TYR 33 -18.911 35.389 -16.161 259 HD1 TYR 33 HD1 TYR 33 -17.185 33.641 -18.990 260 HD2 TYR 33 HD2 TYR 33 -20.353 36.270 -17.761 261 HE1 TYR 33 HE1 TYR 33 -18.219 33.474 -21.254 262 HE2 TYR 33 HE2 TYR 33 -21.352 36.143 -20.039 263 HH TYR 33 HH TYR 33 -21.274 35.191 -22.044 264 H ARG 34 H ARG 34 -17.608 37.675 -14.952 265 HA ARG 34 HA ARG 34 -15.957 36.672 -12.671 266 HB2 ARG 34 2HB ARG 34 -15.537 38.960 -13.613 267 HB3 ARG 34 3HB ARG 34 -17.184 39.416 -13.194 268 HG2 ARG 34 2HG ARG 34 -16.723 39.144 -10.814 269 HG3 ARG 34 3HG ARG 34 -15.124 38.459 -11.150 270 HD2 ARG 34 2HD ARG 34 -14.451 40.606 -12.240 271 HD3 ARG 34 3HD ARG 34 -16.057 41.248 -11.903 272 HE ARG 34 HE ARG 34 -15.574 41.394 -9.600 273 HH11 ARG 34 1HH1 ARG 34 -12.641 40.333 -11.330 274 HH12 ARG 34 2HH1 ARG 34 -11.666 40.676 -9.933 275 HH21 ARG 34 1HH2 ARG 34 -14.196 41.829 -7.943 276 HH22 ARG 34 2HH2 ARG 34 -12.497 41.510 -8.110 277 H THR 35 H THR 35 -16.890 35.850 -10.950 278 HA THR 35 HA THR 35 -19.799 35.538 -10.795 279 HB THR 35 HB THR 35 -19.378 34.095 -8.862 280 HG1 THR 35 HG1 THR 35 -16.664 34.542 -9.334 281 HG21 THR 35 1HG2 THR 35 -18.053 32.365 -9.911 282 HG22 THR 35 2HG2 THR 35 -19.252 33.060 -11.025 283 HG23 THR 35 3HG2 THR 35 -17.535 33.483 -11.189 284 H ASP 36 H ASP 36 -20.625 35.597 -8.330 285 HA ASP 36 HA ASP 36 -20.598 38.394 -7.680 286 HB2 ASP 36 2HB ASP 36 -22.600 36.882 -7.555 287 HB3 ASP 36 3HB ASP 36 -21.859 36.062 -6.178 288 H ASN 37 H ASN 37 -18.564 35.790 -6.563 289 HA ASN 37 HA ASN 37 -17.766 37.397 -4.183 290 HB2 ASN 37 2HB ASN 37 -16.343 34.927 -4.992 291 HB3 ASN 37 3HB ASN 37 -16.498 35.661 -3.434 292 HD21 ASN 37 1HD2 ASN 37 -17.013 32.941 -4.526 293 HD22 ASN 37 2HD2 ASN 37 -18.623 32.546 -3.880 294 H GLY 38 H GLY 38 -17.225 37.804 -7.369 295 HA2 GLY 38 HA2 GLY 38 -15.612 38.973 -8.551 296 HA3 GLY 38 HA3 GLY 38 -14.513 38.949 -7.165 297 H GLU 39 H GLU 39 -15.686 35.807 -7.816 298 HA GLU 39 HA GLU 39 -12.997 34.968 -8.603 299 HB2 GLU 39 2HB GLU 39 -15.395 33.145 -8.757 300 HB3 GLU 39 3HB GLU 39 -13.729 32.770 -8.412 301 HG2 GLU 39 2HG GLU 39 -14.293 34.371 -6.271 302 HG3 GLU 39 3HG GLU 39 -15.931 33.845 -6.712 303 H GLU 40 H GLU 40 -12.278 35.157 -10.651 304 HA GLU 40 HA GLU 40 -14.207 35.251 -12.910 305 HB2 GLU 40 2HB GLU 40 -11.328 36.128 -12.594 306 HB3 GLU 40 3HB GLU 40 -12.080 35.923 -14.188 307 HG2 GLU 40 2HG GLU 40 -13.876 37.459 -13.600 308 HG3 GLU 40 3HG GLU 40 -13.191 37.679 -11.978 309 H PHE 41 H PHE 41 -14.454 33.789 -14.381 310 HA PHE 41 HA PHE 41 -12.456 31.588 -14.749 311 HB2 PHE 41 2HB PHE 41 -15.482 31.397 -14.665 312 HB3 PHE 41 3HB PHE 41 -14.414 30.100 -15.138 313 HD1 PHE 41 HD1 PHE 41 -15.581 32.133 -12.201 314 HD2 PHE 41 HD2 PHE 41 -13.045 28.885 -13.543 315 HE1 PHE 41 HE1 PHE 41 -15.242 31.407 -9.898 316 HE2 PHE 41 HE2 PHE 41 -12.684 28.202 -11.191 317 HZ PHE 41 HZ PHE 41 -13.769 29.475 -9.351 318 H GLU 42 H GLU 42 -12.657 30.476 -16.783 319 HA GLU 42 HA GLU 42 -13.328 32.322 -19.019 320 HB2 GLU 42 2HB GLU 42 -11.411 29.993 -19.236 321 HB3 GLU 42 3HB GLU 42 -11.642 31.363 -20.311 322 HG2 GLU 42 2HG GLU 42 -9.747 32.100 -19.335 323 HG3 GLU 42 3HG GLU 42 -10.855 32.744 -18.135 324 H VAL 43 H VAL 43 -14.691 31.744 -20.567 325 HA VAL 43 HA VAL 43 -15.734 28.926 -20.699 326 HB VAL 43 HB VAL 43 -17.329 31.435 -21.215 327 HG11 VAL 43 1HG1 VAL 43 -19.227 29.946 -21.311 328 HG12 VAL 43 2HG1 VAL 43 -18.055 29.427 -22.507 329 HG13 VAL 43 3HG1 VAL 43 -18.199 28.530 -20.980 330 HG21 VAL 43 3HG2 VAL 43 -16.781 31.159 -18.771 331 HG22 VAL 43 1HG2 VAL 43 -18.479 31.052 -19.171 332 HG23 VAL 43 2HG2 VAL 43 -17.557 29.561 -18.835 333 HA PRO 44 HA PRO 44 -14.448 29.527 -25.040 334 HB2 PRO 44 2HB PRO 44 -14.610 26.564 -25.100 335 HB3 PRO 44 3HB PRO 44 -13.276 27.634 -25.602 336 HG2 PRO 44 2HG PRO 44 -13.155 26.131 -23.308 337 HG3 PRO 44 3HG PRO 44 -12.440 27.771 -23.393 338 HD2 PRO 44 2HD PRO 44 -15.124 26.957 -22.246 339 HD3 PRO 44 3HD PRO 44 -13.881 28.071 -21.587 340 H PHE 45 H PHE 45 -15.991 30.110 -26.332 341 HA PHE 45 HA PHE 45 -18.487 28.505 -26.763 342 HB2 PHE 45 2HB PHE 45 -17.722 31.378 -27.344 343 HB3 PHE 45 3HB PHE 45 -19.103 30.643 -28.094 344 HD1 PHE 45 HD1 PHE 45 -17.616 31.732 -24.859 345 HD2 PHE 45 HD2 PHE 45 -21.151 30.204 -26.812 346 HE1 PHE 45 HE1 PHE 45 -18.963 32.255 -22.854 347 HE2 PHE 45 HE2 PHE 45 -22.490 30.733 -24.781 348 HZ PHE 45 HZ PHE 45 -21.375 31.750 -22.789 349 H ALA 46 H ALA 46 -19.011 27.772 -28.823 350 HA ALA 46 HA ALA 46 -16.794 27.571 -30.795 351 HB1 ALA 46 3HB ALA 46 -18.257 25.938 -31.906 352 HB2 ALA 46 1HB ALA 46 -18.045 25.525 -30.195 353 HB3 ALA 46 2HB ALA 46 -19.559 26.282 -30.746 354 H ASP 47 H ASP 47 -17.173 28.151 -33.059 355 HA ASP 47 HA ASP 47 -18.284 30.713 -33.481 356 HB2 ASP 47 2HB ASP 47 -16.506 29.712 -34.819 357 HB3 ASP 47 3HB ASP 47 -17.625 28.502 -35.459 358 H ASP 48 H ASP 48 -19.942 27.667 -33.479 359 HA ASP 48 HA ASP 48 -22.314 28.474 -34.967 360 HB2 ASP 48 2HB ASP 48 -21.513 26.126 -34.623 361 HB3 ASP 48 3HB ASP 48 -21.908 26.275 -32.912 362 H ALA 49 H ALA 49 -21.119 29.339 -31.909 363 HA ALA 49 HA ALA 49 -23.769 30.297 -30.909 364 HB1 ALA 49 3HB ALA 49 -22.805 28.461 -29.531 365 HB2 ALA 49 1HB ALA 49 -21.329 29.430 -29.304 366 HB3 ALA 49 2HB ALA 49 -22.878 29.999 -28.651 367 H GLU 50 H GLU 50 -23.574 32.242 -29.496 368 HA GLU 50 HA GLU 50 -21.163 33.901 -29.875 369 HB2 GLU 50 2HB GLU 50 -22.343 35.864 -30.465 370 HB3 GLU 50 3HB GLU 50 -22.826 34.589 -31.588 371 HG2 GLU 50 2HG GLU 50 -24.911 34.254 -30.185 372 HG3 GLU 50 3HG GLU 50 -24.444 35.669 -29.241 373 H ILE 51 H ILE 51 -20.740 35.306 -28.226 374 HA ILE 51 HA ILE 51 -21.154 34.390 -25.655 375 HB ILE 51 HB ILE 51 -20.209 37.191 -26.275 376 HG12 ILE 51 2HG1 ILE 51 -19.033 35.752 -27.867 377 HG13 ILE 51 3HG1 ILE 51 -17.955 36.402 -26.637 378 HG21 ILE 51 1HG2 ILE 51 -19.390 35.190 -24.124 379 HG22 ILE 51 2HG2 ILE 51 -18.766 36.820 -24.338 380 HG23 ILE 51 3HG2 ILE 51 -20.453 36.580 -23.859 381 HD11 ILE 51 3HD1 ILE 51 -19.058 33.571 -26.764 382 HD12 ILE 51 1HD1 ILE 51 -17.411 34.088 -27.166 383 HD13 ILE 51 2HD1 ILE 51 -17.964 34.182 -25.496 384 HA PRO 52 HA PRO 52 -24.917 36.774 -24.610 385 HB2 PRO 52 2HB PRO 52 -25.576 35.302 -22.419 386 HB3 PRO 52 3HB PRO 52 -25.937 34.759 -24.088 387 HG2 PRO 52 2HG PRO 52 -23.672 33.919 -22.274 388 HG3 PRO 52 3HG PRO 52 -24.686 32.905 -23.361 389 HD2 PRO 52 2HD PRO 52 -22.140 33.906 -23.976 390 HD3 PRO 52 3HD PRO 52 -23.330 33.426 -25.188 391 H GLY 53 H GLY 53 -25.167 38.324 -23.022 392 HA2 GLY 53 HA2 GLY 53 -23.057 39.650 -21.852 393 HA3 GLY 53 HA3 GLY 53 -24.727 39.762 -21.284 394 H THR 54 H THR 54 -24.812 36.927 -20.344 395 HA THR 54 HA THR 54 -22.633 36.786 -18.396 396 HB THR 54 HB THR 54 -24.270 36.201 -16.548 397 HG1 THR 54 HG1 THR 54 -26.487 36.550 -16.930 398 HG21 THR 54 1HG2 THR 54 -25.191 38.840 -17.757 399 HG22 THR 54 2HG2 THR 54 -25.262 38.333 -16.052 400 HG23 THR 54 3HG2 THR 54 -23.707 38.635 -16.824 401 H TRP 55 H TRP 55 -22.454 34.673 -17.283 402 HA TRP 55 HA TRP 55 -23.788 32.353 -18.457 403 HB2 TRP 55 2HB TRP 55 -21.989 33.049 -20.119 404 HB3 TRP 55 3HB TRP 55 -20.803 32.694 -18.875 405 HD1 TRP 55 HD1 TRP 55 -20.268 30.193 -18.367 406 HE1 TRP 55 HE1 TRP 55 -20.611 28.029 -19.665 407 HE3 TRP 55 HE3 TRP 55 -23.898 31.782 -21.563 408 HZ2 TRP 55 HZ2 TRP 55 -22.406 27.034 -21.725 409 HZ3 TRP 55 HZ3 TRP 55 -24.952 30.200 -23.176 410 HH2 TRP 55 HH2 TRP 55 -24.206 27.830 -23.268 411 H LEU 56 H LEU 56 -23.415 30.406 -17.253 412 HA LEU 56 HA LEU 56 -22.750 30.814 -14.483 413 HB2 LEU 56 2HB LEU 56 -24.300 29.023 -15.936 414 HB3 LEU 56 3HB LEU 56 -22.930 28.031 -15.434 415 HG LEU 56 HG LEU 56 -24.602 29.712 -13.525 416 HD11 LEU 56 1HD1 LEU 56 -24.796 26.736 -14.161 417 HD12 LEU 56 2HD1 LEU 56 -25.697 27.596 -12.891 418 HD13 LEU 56 3HD1 LEU 56 -25.993 27.979 -14.593 419 HD21 LEU 56 3HD2 LEU 56 -23.636 28.207 -11.804 420 HD22 LEU 56 1HD2 LEU 56 -22.636 27.423 -13.051 421 HD23 LEU 56 2HD2 LEU 56 -22.378 29.125 -12.635 422 H CYS 57 H CYS 57 -20.892 30.583 -13.441 423 HA CYS 57 HA CYS 57 -18.461 29.778 -14.934 424 HB2 CYS 57 2HB CYS 57 -18.964 31.304 -12.357 425 HB3 CYS 57 3HB CYS 57 -17.351 30.798 -12.869 426 HG CYS 57 HG CYS 57 -19.513 32.443 -14.744 427 H ARG 58 H ARG 58 -16.754 28.640 -13.753 428 HA ARG 58 HA ARG 58 -17.711 26.056 -13.018 429 HB2 ARG 58 2HB ARG 58 -14.859 27.022 -12.628 430 HB3 ARG 58 3HB ARG 58 -15.418 25.382 -12.945 431 HG2 ARG 58 2HG ARG 58 -16.152 26.118 -15.244 432 HG3 ARG 58 3HG ARG 58 -15.475 27.723 -14.905 433 HD2 ARG 58 2HD ARG 58 -13.250 26.573 -14.444 434 HD3 ARG 58 3HD ARG 58 -13.977 25.099 -15.116 435 HE ARG 58 HE ARG 58 -14.312 27.363 -16.904 436 HH11 ARG 58 1HH2 ARG 58 -11.891 25.004 -15.968 437 HH12 ARG 58 2HH2 ARG 58 -11.000 25.210 -17.451 438 HH21 ARG 58 1HH1 ARG 58 -13.107 27.642 -18.696 439 HH22 ARG 58 2HH1 ARG 58 -11.691 26.649 -18.978 440 H ASN 59 H ASN 59 -17.062 28.761 -11.012 441 HA ASN 59 HA ASN 59 -16.783 27.429 -8.486 442 HB2 ASN 59 2HB ASN 59 -16.159 29.722 -8.844 443 HB3 ASN 59 3HB ASN 59 -17.807 30.168 -9.310 444 HD21 ASN 59 1HD2 ASN 59 -17.866 31.838 -7.740 445 HD22 ASN 59 2HD2 ASN 59 -17.870 31.469 -6.029 446 H GLY 60 H GLY 60 -19.497 27.785 -10.600 447 HA2 GLY 60 HA2 GLY 60 -21.601 26.760 -10.397 448 HA3 GLY 60 HA3 GLY 60 -21.407 26.622 -8.648 449 H MET 61 H MET 61 -20.598 29.744 -9.929 450 HA MET 61 HA MET 61 -23.258 30.843 -9.178 451 HB2 MET 61 2HB MET 61 -21.262 31.401 -7.685 452 HB3 MET 61 3HB MET 61 -20.580 32.285 -9.026 453 HG2 MET 61 2HG MET 61 -21.777 33.756 -7.454 454 HG3 MET 61 3HG MET 61 -22.456 33.828 -9.078 455 HE1 MET 61 3HE MET 61 -25.652 34.496 -6.964 456 HE2 MET 61 1HE MET 61 -24.019 35.049 -6.546 457 HE3 MET 61 2HE MET 61 -24.560 35.074 -8.243 458 H GLU 62 H GLU 62 -24.136 32.487 -10.453 459 HA GLU 62 HA GLU 62 -23.561 32.442 -13.291 460 HB2 GLU 62 2HB GLU 62 -25.325 34.248 -11.598 461 HB3 GLU 62 3HB GLU 62 -25.210 34.318 -13.365 462 HG2 GLU 62 2HG GLU 62 -25.941 31.951 -13.516 463 HG3 GLU 62 3HG GLU 62 -26.093 31.878 -11.759 464 H GLY 63 H GLY 63 -21.788 33.280 -14.136 465 HA2 GLY 63 HA2 GLY 63 -20.413 35.580 -12.940 466 HA3 GLY 63 HA3 GLY 63 -19.812 34.597 -14.251 467 H THR 64 H THR 64 -20.081 37.552 -14.026 468 HA THR 64 HA THR 64 -21.747 38.035 -16.462 469 HB THR 64 HB THR 64 -20.594 40.052 -14.504 470 HG1 THR 64 HG1 THR 64 -22.304 38.872 -13.621 471 HG21 THR 64 1HG2 THR 64 -22.428 40.403 -16.923 472 HG22 THR 64 2HG2 THR 64 -22.270 41.615 -15.632 473 HG23 THR 64 3HG2 THR 64 -20.866 41.183 -16.610 474 H LEU 65 H LEU 65 -20.909 38.889 -18.300 475 HA LEU 65 HA LEU 65 -18.263 38.197 -18.972 476 HB2 LEU 65 2HB LEU 65 -20.299 38.336 -20.437 477 HB3 LEU 65 3HB LEU 65 -20.230 40.087 -20.329 478 HG LEU 65 HG LEU 65 -17.839 39.835 -21.402 479 HD11 LEU 65 1HD1 LEU 65 -17.509 37.851 -22.726 480 HD12 LEU 65 2HD1 LEU 65 -17.568 37.446 -21.010 481 HD13 LEU 65 3HD1 LEU 65 -18.970 37.105 -22.015 482 HD21 LEU 65 3HD2 LEU 65 -18.813 39.646 -23.665 483 HD22 LEU 65 1HD2 LEU 65 -20.320 39.002 -22.971 484 HD23 LEU 65 2HD2 LEU 65 -19.820 40.673 -22.632 485 H ILE 66 H ILE 66 -16.384 39.179 -18.632 486 HA ILE 66 HA ILE 66 -16.228 42.148 -18.374 487 HB ILE 66 HB ILE 66 -14.528 42.043 -16.729 488 HG12 ILE 66 2HG1 ILE 66 -13.323 40.019 -17.087 489 HG13 ILE 66 3HG1 ILE 66 -13.939 40.002 -15.437 490 HG21 ILE 66 1HG2 ILE 66 -16.857 42.183 -15.989 491 HG22 ILE 66 2HG2 ILE 66 -16.897 40.425 -15.762 492 HG23 ILE 66 3HG2 ILE 66 -15.805 41.418 -14.785 493 HD11 ILE 66 3HD1 ILE 66 -14.772 38.383 -17.769 494 HD12 ILE 66 1HD1 ILE 66 -14.188 37.835 -16.191 495 HD13 ILE 66 2HD1 ILE 66 -15.820 38.528 -16.335 496 H GLU 67 H GLU 67 -14.277 43.142 -19.008 497 HA GLU 67 HA GLU 67 -13.030 41.894 -21.348 498 HB2 GLU 67 2HB GLU 67 -12.602 44.572 -19.982 499 HB3 GLU 67 3HB GLU 67 -11.762 44.048 -21.446 500 HG2 GLU 67 2HG GLU 67 -13.777 43.992 -22.733 501 HG3 GLU 67 3HG GLU 67 -14.800 44.131 -21.304 502 H GLY 68 H GLY 68 -11.148 40.851 -21.439 503 HA2 GLY 68 HA2 GLY 68 -9.939 40.015 -18.939 504 HA3 GLY 68 HA3 GLY 68 -9.565 39.432 -20.561 505 H ASP 69 H ASP 69 -8.883 42.264 -21.441 506 HA ASP 69 HA ASP 69 -6.274 42.638 -20.036 507 HB2 ASP 69 2HB ASP 69 -6.141 41.007 -21.977 508 HB3 ASP 69 3HB ASP 69 -6.573 42.339 -23.046 509 H LEU 70 H LEU 70 -8.828 44.267 -20.298 510 HA LEU 70 HA LEU 70 -7.573 46.847 -21.121 511 HB2 LEU 70 2HB LEU 70 -10.472 45.969 -21.464 512 HB3 LEU 70 3HB LEU 70 -9.932 47.620 -21.580 513 HG LEU 70 HG LEU 70 -10.308 46.863 -23.749 514 HD11 LEU 70 1HD1 LEU 70 -8.339 48.323 -23.437 515 HD12 LEU 70 2HD1 LEU 70 -7.293 46.884 -23.384 516 HD13 LEU 70 3HD1 LEU 70 -8.201 47.272 -24.857 517 HD21 LEU 70 3HD2 LEU 70 -8.294 44.613 -23.479 518 HD22 LEU 70 1HD2 LEU 70 -10.060 44.405 -23.368 519 HD23 LEU 70 2HD2 LEU 70 -9.326 45.010 -24.858 520 HA PRO 71 HA PRO 71 -8.721 48.020 -16.932 521 HB2 PRO 71 2HB PRO 71 -8.387 50.709 -16.981 522 HB3 PRO 71 3HB PRO 71 -7.025 49.591 -17.261 523 HG2 PRO 71 2HG PRO 71 -8.747 50.953 -19.369 524 HG3 PRO 71 3HG PRO 71 -6.958 50.964 -19.236 525 HD2 PRO 71 2HD PRO 71 -8.284 49.182 -20.827 526 HD3 PRO 71 3HD PRO 71 -6.792 48.731 -19.952 527 H GLU 72 H GLU 72 -10.907 47.304 -18.492 528 HA GLU 72 HA GLU 72 -12.966 47.768 -19.399 529 HB2 GLU 72 2HB GLU 72 -13.149 48.244 -16.430 530 HB3 GLU 72 3HB GLU 72 -14.566 47.982 -17.473 531 HG2 GLU 72 2HG GLU 72 -13.645 45.783 -18.157 532 HG3 GLU 72 3HG GLU 72 -12.276 46.012 -17.066 533 HA PRO 73 HA PRO 73 -13.130 52.419 -19.682 534 HB2 PRO 73 2HB PRO 73 -12.230 52.844 -22.197 535 HB3 PRO 73 3HB PRO 73 -11.097 52.590 -20.832 536 HG2 PRO 73 2HG PRO 73 -12.046 50.545 -22.869 537 HG3 PRO 73 3HG PRO 73 -10.370 50.880 -22.337 538 HD2 PRO 73 2HD PRO 73 -11.923 48.861 -21.272 539 HD3 PRO 73 3HD PRO 73 -10.670 49.729 -20.340 540 H LYS 74 H LYS 74 -14.833 53.510 -20.705 541 HA LYS 74 HA LYS 74 -16.933 53.730 -21.575 542 HB2 LYS 74 2HB LYS 74 -17.015 53.701 -23.955 543 HB3 LYS 74 3HB LYS 74 -15.468 54.296 -23.392 544 HG2 LYS 74 2HG LYS 74 -14.377 52.181 -23.990 545 HG3 LYS 74 3HG LYS 74 -15.940 51.489 -24.490 546 HD2 LYS 74 2HD LYS 74 -16.135 53.213 -26.251 547 HD3 LYS 74 3HD LYS 74 -14.625 53.969 -25.697 548 HE2 LYS 74 2HE LYS 74 -13.405 51.847 -26.193 549 HE3 LYS 74 3HE LYS 74 -14.904 51.141 -26.806 550 HZ1 LYS 74 HZ1 LYS 74 -14.949 52.899 -28.511 551 HZ2 LYS 74 HZ2 LYS 74 -13.559 53.541 -27.941 552 HZ3 LYS 74 HZ3 LYS 74 -13.554 52.057 -28.615 553 H LYS 75 H LYS 75 -18.507 52.456 -23.443 554 HA LYS 75 HA LYS 75 -19.775 50.413 -21.816 555 HB2 LYS 75 2HB LYS 75 -20.991 52.070 -23.238 556 HB3 LYS 75 3HB LYS 75 -20.358 51.274 -24.673 557 HG2 LYS 75 2HG LYS 75 -22.589 50.511 -24.359 558 HG3 LYS 75 3HG LYS 75 -21.551 49.149 -23.942 559 HD2 LYS 75 2HD LYS 75 -21.875 49.641 -21.525 560 HD3 LYS 75 3HD LYS 75 -22.855 51.064 -21.946 561 HE2 LYS 75 2HE LYS 75 -24.472 49.580 -23.123 562 HE3 LYS 75 3HE LYS 75 -23.498 48.171 -22.686 563 HZ1 LYS 75 HZ1 LYS 75 -23.930 48.688 -20.339 564 HZ2 LYS 75 HZ2 LYS 75 -24.828 49.992 -20.747 565 HZ3 LYS 75 HZ3 LYS 75 -25.340 48.493 -21.135 566 H VAL 76 H VAL 76 -17.990 49.032 -21.576 567 HA VAL 76 HA VAL 76 -16.861 47.136 -21.792 568 HB VAL 76 HB VAL 76 -18.156 45.173 -22.294 569 HG11 VAL 76 1HG1 VAL 76 -19.895 45.498 -20.649 570 HG12 VAL 76 2HG1 VAL 76 -18.428 46.351 -20.150 571 HG13 VAL 76 3HG1 VAL 76 -19.801 47.260 -20.822 572 HG21 VAL 76 3HG2 VAL 76 -20.416 46.996 -23.220 573 HG22 VAL 76 1HG2 VAL 76 -19.430 45.994 -24.305 574 HG23 VAL 76 2HG2 VAL 76 -20.442 45.232 -23.071 575 H LYS 77 H LYS 77 -15.993 48.783 -23.892 576 HA LYS 77 HA LYS 77 -15.027 46.768 -25.852 577 HB2 LYS 77 2HB LYS 77 -16.480 49.363 -26.504 578 HB3 LYS 77 3HB LYS 77 -15.436 48.557 -27.674 579 HG2 LYS 77 2HG LYS 77 -16.802 46.471 -27.442 580 HG3 LYS 77 3HG LYS 77 -17.915 47.326 -26.385 581 HD2 LYS 77 2HD LYS 77 -17.292 48.053 -29.277 582 HD3 LYS 77 3HD LYS 77 -18.712 47.168 -28.737 583 HE2 LYS 77 2HE LYS 77 -18.027 50.043 -27.964 584 HE3 LYS 77 3HE LYS 77 -19.168 49.560 -29.217 585 HZ1 LYS 77 HZ1 LYS 77 -19.453 48.977 -26.313 586 HZ2 LYS 77 HZ2 LYS 77 -20.352 50.024 -27.190 587 HZ3 LYS 77 HZ3 LYS 77 -20.475 48.424 -27.475 588 HA PRO 78 HA PRO 78 -13.699 47.255 -27.980 589 HB2 PRO 78 2HB PRO 78 -11.190 46.499 -28.670 590 HB3 PRO 78 3HB PRO 78 -11.820 48.154 -28.932 591 HG2 PRO 78 2HG PRO 78 -10.129 47.158 -26.611 592 HG3 PRO 78 3HG PRO 78 -9.854 48.603 -27.637 593 HD2 PRO 78 2HD PRO 78 -11.117 48.766 -25.221 594 HD3 PRO 78 3HD PRO 78 -11.605 49.790 -26.600 595 HA PRO 79 HA PRO 79 -13.730 43.175 -26.102 596 HB2 PRO 79 2HB PRO 79 -13.876 42.090 -28.894 597 HB3 PRO 79 3HB PRO 79 -14.965 41.790 -27.504 598 HG2 PRO 79 2HG PRO 79 -15.736 43.419 -29.530 599 HG3 PRO 79 3HG PRO 79 -16.092 43.853 -27.824 600 HD2 PRO 79 2HD PRO 79 -13.798 44.824 -29.560 601 HD3 PRO 79 3HD PRO 79 -14.946 45.769 -28.566 602 H ARG 80 H ARG 80 -10.628 41.325 -26.696 603 HA ARG 80 HA ARG 80 -13.041 41.565 -25.003 604 HB2 ARG 80 2HB ARG 80 -13.582 40.015 -26.967 605 HB3 ARG 80 3HB ARG 80 -12.287 38.965 -26.398 606 HG2 ARG 80 2HG ARG 80 -13.480 38.663 -24.233 607 HG3 ARG 80 3HG ARG 80 -14.731 39.799 -24.761 608 HD2 ARG 80 2HD ARG 80 -15.534 37.529 -25.028 609 HD3 ARG 80 3HD ARG 80 -15.348 38.277 -26.612 610 HE ARG 80 HE ARG 80 -13.420 36.305 -25.391 611 HH11 ARG 80 1HH2 ARG 80 -14.843 37.542 -28.411 612 HH12 ARG 80 2HH2 ARG 80 -13.828 36.408 -29.314 613 HH21 ARG 80 2HH1 ARG 80 -12.256 35.055 -26.702 614 HH22 ARG 80 1HH1 ARG 80 -12.507 35.181 -28.469 Start of MODEL 4 1 H1 SER 1 1H SER 1 8.342 11.331 -31.357 2 H2 SER 1 2H SER 1 7.011 11.959 -32.077 3 H3 SER 1 3H SER 1 8.379 12.855 -31.968 4 HA SER 1 HA SER 1 9.564 11.400 -33.424 5 HB2 SER 1 2HB SER 1 6.954 9.846 -33.609 6 HB3 SER 1 3HB SER 1 8.460 9.502 -34.485 7 HG SER 1 HG SER 1 8.259 8.226 -32.589 8 H MET 2 H MET 2 9.471 11.554 -35.768 9 HA MET 2 HA MET 2 7.213 13.080 -36.957 10 HB2 MET 2 2HB MET 2 10.149 13.867 -37.187 11 HB3 MET 2 3HB MET 2 8.838 14.530 -38.166 12 HG2 MET 2 2HG MET 2 7.760 15.421 -36.131 13 HG3 MET 2 3HG MET 2 9.092 14.792 -35.151 14 HE1 MET 2 3HE MET 2 8.069 17.803 -35.076 15 HE2 MET 2 1HE MET 2 9.398 17.185 -34.068 16 HE3 MET 2 2HE MET 2 9.615 18.675 -35.011 17 H ALA 3 H ALA 3 6.884 12.675 -39.153 18 HA ALA 3 HA ALA 3 8.200 10.327 -40.346 19 HB1 ALA 3 3HB ALA 3 6.571 10.689 -42.152 20 HB2 ALA 3 1HB ALA 3 5.772 10.687 -40.568 21 HB3 ALA 3 2HB ALA 3 6.065 12.224 -41.417 22 H ASP 4 H ASP 4 8.239 13.833 -40.744 23 HA ASP 4 HA ASP 4 10.380 13.822 -42.787 24 HB2 ASP 4 2HB ASP 4 8.560 15.484 -42.873 25 HB3 ASP 4 3HB ASP 4 8.969 16.037 -41.249 26 H ARG 5 H ARG 5 12.240 15.381 -42.156 27 HA ARG 5 HA ARG 5 14.195 14.411 -40.568 28 HB2 ARG 5 2HB ARG 5 13.426 17.329 -40.950 29 HB3 ARG 5 3HB ARG 5 14.995 16.813 -40.345 30 HG2 ARG 5 2HG ARG 5 15.700 15.938 -42.382 31 HG3 ARG 5 3HG ARG 5 14.071 15.678 -43.000 32 HD2 ARG 5 2HD ARG 5 15.321 18.418 -42.586 33 HD3 ARG 5 3HD ARG 5 15.260 17.547 -44.131 34 HE ARG 5 HE ARG 5 12.623 17.544 -43.371 35 HH11 ARG 5 1HH1 ARG 5 14.875 20.123 -44.106 36 HH12 ARG 5 2HH1 ARG 5 13.591 21.270 -44.378 37 HH21 ARG 5 1HH2 ARG 5 11.104 19.036 -43.486 38 HH22 ARG 5 2HH2 ARG 5 11.459 20.647 -44.098 39 H VAL 6 H VAL 6 14.381 13.794 -38.535 40 HA VAL 6 HA VAL 6 12.566 14.672 -36.464 41 HB VAL 6 HB VAL 6 13.724 13.012 -35.054 42 HG11 VAL 6 1HG1 VAL 6 12.972 11.024 -36.259 43 HG12 VAL 6 2HG1 VAL 6 11.812 12.347 -36.440 44 HG13 VAL 6 3HG1 VAL 6 12.901 11.935 -37.781 45 HG21 VAL 6 3HG2 VAL 6 15.378 11.479 -35.972 46 HG22 VAL 6 1HG2 VAL 6 15.411 12.354 -37.511 47 HG23 VAL 6 2HG2 VAL 6 16.011 13.127 -36.027 48 H LEU 7 H LEU 7 13.174 15.306 -34.429 49 HA LEU 7 HA LEU 7 13.907 16.872 -32.968 50 HB2 LEU 7 2HB LEU 7 16.686 16.212 -33.980 51 HB3 LEU 7 3HB LEU 7 16.273 16.929 -32.429 52 HG LEU 7 HG LEU 7 15.574 14.094 -33.313 53 HD11 LEU 7 1HD1 LEU 7 17.208 13.423 -31.615 54 HD12 LEU 7 2HD1 LEU 7 17.968 14.446 -32.845 55 HD13 LEU 7 3HD1 LEU 7 17.563 15.129 -31.254 56 HD21 LEU 7 3HD2 LEU 7 14.905 13.760 -30.944 57 HD22 LEU 7 1HD2 LEU 7 15.120 15.498 -30.641 58 HD23 LEU 7 2HD2 LEU 7 13.858 14.925 -31.756 59 H ARG 8 H ARG 8 13.483 17.741 -35.875 60 HA ARG 8 HA ARG 8 14.889 20.367 -35.891 61 HB2 ARG 8 2HB ARG 8 14.868 18.837 -37.916 62 HB3 ARG 8 3HB ARG 8 13.120 19.071 -38.005 63 HG2 ARG 8 2HG ARG 8 13.611 21.597 -38.157 64 HG3 ARG 8 3HG ARG 8 15.312 21.166 -38.342 65 HD2 ARG 8 2HD ARG 8 14.802 19.891 -40.382 66 HD3 ARG 8 3HD ARG 8 13.071 20.119 -40.130 67 HE ARG 8 HE ARG 8 13.221 22.415 -40.704 68 HH11 ARG 8 1HH2 ARG 8 16.415 20.982 -41.051 69 HH12 ARG 8 2HH2 ARG 8 16.984 22.337 -41.984 70 HH21 ARG 8 1HH1 ARG 8 13.998 24.053 -41.764 71 HH22 ARG 8 2HH1 ARG 8 15.631 24.057 -42.405 72 H GLY 9 H GLY 9 13.875 22.092 -35.075 73 HA2 GLY 9 HA2 GLY 9 10.871 22.186 -34.947 74 HA3 GLY 9 HA3 GLY 9 11.902 22.539 -33.565 75 H SER 10 H SER 10 13.435 23.880 -36.244 76 HA SER 10 HA SER 10 13.103 26.513 -35.400 77 HB2 SER 10 2HB SER 10 13.951 25.677 -38.189 78 HB3 SER 10 3HB SER 10 14.373 27.161 -37.320 79 HG SER 10 HG SER 10 16.053 25.620 -37.187 80 H ARG 11 H ARG 11 10.155 26.499 -38.237 81 HA ARG 11 HA ARG 11 12.177 24.272 -38.290 82 HB2 ARG 11 2HB ARG 11 9.902 23.802 -37.193 83 HB3 ARG 11 3HB ARG 11 9.192 23.971 -38.804 84 HG2 ARG 11 2HG ARG 11 10.654 22.148 -39.636 85 HG3 ARG 11 3HG ARG 11 11.443 22.061 -38.054 86 HD2 ARG 11 2HD ARG 11 9.305 21.384 -37.009 87 HD3 ARG 11 3HD ARG 11 8.521 21.403 -38.594 88 HE ARG 11 HE ARG 11 10.445 19.436 -37.532 89 HH11 ARG 11 1HH1 ARG 11 8.860 20.525 -40.501 90 HH12 ARG 11 2HH1 ARG 11 9.521 19.156 -41.397 91 HH21 ARG 11 1HH2 ARG 11 11.162 17.677 -38.880 92 HH22 ARG 11 2HH2 ARG 11 10.690 17.768 -40.573 93 H LEU 12 H LEU 12 9.970 26.180 -40.313 94 HA LEU 12 HA LEU 12 11.403 25.149 -42.733 95 HB2 LEU 12 2HB LEU 12 8.604 26.299 -42.487 96 HB3 LEU 12 3HB LEU 12 9.345 25.683 -43.959 97 HG LEU 12 HG LEU 12 8.657 24.018 -41.498 98 HD11 LEU 12 1HD1 LEU 12 7.420 24.111 -44.278 99 HD12 LEU 12 2HD1 LEU 12 6.948 23.027 -42.949 100 HD13 LEU 12 3HD1 LEU 12 6.700 24.773 -42.794 101 HD21 LEU 12 3HD2 LEU 12 10.602 23.032 -42.624 102 HD22 LEU 12 1HD2 LEU 12 9.162 22.067 -42.959 103 HD23 LEU 12 2HD2 LEU 12 9.789 23.174 -44.201 104 H GLY 13 H GLY 13 11.638 27.777 -40.842 105 HA2 GLY 13 HA2 GLY 13 12.720 29.790 -41.147 106 HA3 GLY 13 HA3 GLY 13 12.899 29.419 -42.861 107 H ALA 14 H ALA 14 10.526 29.402 -43.957 108 HA ALA 14 HA ALA 14 9.560 32.152 -43.789 109 HB1 ALA 14 3HB ALA 14 10.091 31.063 -45.933 110 HB2 ALA 14 1HB ALA 14 8.807 29.864 -45.650 111 HB3 ALA 14 2HB ALA 14 8.397 31.581 -45.868 112 H VAL 15 H VAL 15 8.919 30.967 -41.413 113 HA VAL 15 HA VAL 15 6.068 30.105 -41.478 114 HB VAL 15 HB VAL 15 8.010 30.120 -39.135 115 HG11 VAL 15 1HG1 VAL 15 5.630 30.104 -38.438 116 HG12 VAL 15 2HG1 VAL 15 5.316 28.729 -39.518 117 HG13 VAL 15 3HG1 VAL 15 6.391 28.550 -38.115 118 HG21 VAL 15 3HG2 VAL 15 7.198 27.832 -40.984 119 HG22 VAL 15 1HG2 VAL 15 8.824 28.537 -40.830 120 HG23 VAL 15 2HG2 VAL 15 8.117 27.656 -39.472 121 H SER 16 H SER 16 4.436 31.242 -40.697 122 HA SER 16 HA SER 16 4.951 34.084 -40.032 123 HB2 SER 16 2HB SER 16 2.456 32.712 -41.096 124 HB3 SER 16 3HB SER 16 2.674 34.453 -40.846 125 HG SER 16 HG SER 16 3.076 33.823 -43.023 126 H TYR 17 H TYR 17 5.517 33.038 -37.865 127 HA TYR 17 HA TYR 17 3.145 32.718 -36.086 128 HB2 TYR 17 2HB TYR 17 4.436 31.327 -34.728 129 HB3 TYR 17 3HB TYR 17 4.721 30.797 -36.367 130 HD1 TYR 17 HD2 TYR 17 6.942 32.094 -37.491 131 HD2 TYR 17 HD1 TYR 17 6.278 31.248 -33.313 132 HE1 TYR 17 HE2 TYR 17 9.358 32.252 -37.092 133 HE2 TYR 17 HE1 TYR 17 8.731 31.318 -32.924 134 HH TYR 17 HH TYR 17 10.805 31.668 -33.849 135 H GLU 18 H GLU 18 5.378 35.044 -36.825 136 HA GLU 18 HA GLU 18 6.208 36.908 -35.852 137 HB2 GLU 18 2HB GLU 18 3.609 37.088 -35.913 138 HB3 GLU 18 3HB GLU 18 3.714 37.034 -34.153 139 HG2 GLU 18 2HG GLU 18 5.330 39.016 -34.307 140 HG3 GLU 18 3HG GLU 18 5.020 39.052 -36.039 141 H THR 19 H THR 19 7.240 34.605 -34.605 142 HA THR 19 HA THR 19 8.410 33.858 -32.839 143 HB THR 19 HB THR 19 8.759 36.642 -31.762 144 HG1 THR 19 HG1 THR 19 10.293 36.981 -33.347 145 HG21 THR 19 1HG2 THR 19 10.683 34.303 -32.218 146 HG22 THR 19 2HG2 THR 19 11.096 35.868 -31.480 147 HG23 THR 19 3HG2 THR 19 9.997 34.766 -30.649 148 H ASP 20 H ASP 20 5.562 33.856 -32.480 149 HA ASP 20 HA ASP 20 5.425 33.575 -29.527 150 HB2 ASP 20 2HB ASP 20 4.568 35.842 -30.272 151 HB3 ASP 20 3HB ASP 20 3.327 35.006 -31.205 152 H ARG 21 H ARG 21 3.318 32.444 -28.896 153 HA ARG 21 HA ARG 21 2.644 30.255 -30.842 154 HB2 ARG 21 2HB ARG 21 4.270 29.480 -29.173 155 HB3 ARG 21 3HB ARG 21 3.199 29.989 -27.863 156 HG2 ARG 21 2HG ARG 21 1.497 28.338 -28.596 157 HG3 ARG 21 3HG ARG 21 2.541 27.853 -29.949 158 HD2 ARG 21 2HD ARG 21 4.255 27.077 -28.370 159 HD3 ARG 21 3HD ARG 21 3.288 27.667 -27.003 160 HE ARG 21 HE ARG 21 1.758 25.811 -28.595 161 HH11 ARG 21 1HH1 ARG 21 4.356 25.781 -26.241 162 HH12 ARG 21 2HH1 ARG 21 3.931 24.194 -25.662 163 HH21 ARG 21 1HH2 ARG 21 1.248 23.823 -27.791 164 HH22 ARG 21 2HH2 ARG 21 2.220 23.111 -26.527 165 H ASN 22 H ASN 22 0.626 29.741 -31.111 166 HA ASN 22 HA ASN 22 -1.378 30.143 -28.980 167 HB2 ASN 22 2HB ASN 22 -1.644 32.051 -30.550 168 HB3 ASN 22 3HB ASN 22 -1.851 30.930 -31.894 169 HD21 ASN 22 2HD2 ASN 22 -3.721 32.950 -31.092 170 HD22 ASN 22 1HD2 ASN 22 -5.186 32.092 -30.597 171 H HIS 23 H HIS 23 -2.319 28.225 -28.588 172 HA HIS 23 HA HIS 23 -1.578 25.957 -30.353 173 HB2 HIS 23 2HB HIS 23 -0.878 26.196 -27.909 174 HB3 HIS 23 3HB HIS 23 -2.553 25.839 -27.490 175 HD2 HIS 23 HD2 HIS 23 -3.165 23.288 -27.359 176 HE1 HIS 23 HE1 HIS 23 0.247 21.634 -29.313 177 HE2 HIS 23 HE2 HIS 23 -1.890 21.084 -28.045 178 H ASP 24 H ASP 24 -4.403 27.758 -29.874 179 HA ASP 24 HA ASP 24 -6.299 25.527 -29.963 180 HB2 ASP 24 2HB ASP 24 -6.659 28.522 -30.263 181 HB3 ASP 24 3HB ASP 24 -7.974 27.361 -30.391 182 H LEU 25 H LEU 25 -7.765 25.074 -31.598 183 HA LEU 25 HA LEU 25 -7.082 25.826 -34.394 184 HB2 LEU 25 2HB LEU 25 -7.571 23.018 -33.322 185 HB3 LEU 25 3HB LEU 25 -7.526 23.429 -35.031 186 HG LEU 25 HG LEU 25 -5.165 23.754 -33.122 187 HD11 LEU 25 1HD1 LEU 25 -4.242 21.792 -34.274 188 HD12 LEU 25 2HD1 LEU 25 -5.771 21.393 -33.475 189 HD13 LEU 25 3HD1 LEU 25 -5.731 21.636 -35.237 190 HD21 LEU 25 3HD2 LEU 25 -5.009 25.297 -35.045 191 HD22 LEU 25 1HD2 LEU 25 -3.843 23.985 -35.212 192 HD23 LEU 25 2HD2 LEU 25 -5.344 23.958 -36.166 193 H ALA 26 H ALA 26 -8.764 25.792 -35.810 194 HA ALA 26 HA ALA 26 -10.781 26.290 -36.596 195 HB1 ALA 26 3HB ALA 26 -11.361 23.982 -35.923 196 HB2 ALA 26 1HB ALA 26 -11.985 24.600 -34.379 197 HB3 ALA 26 2HB ALA 26 -12.759 25.066 -35.893 198 HA PRO 27 HA PRO 27 -11.937 30.017 -34.658 199 HB2 PRO 27 2HB PRO 27 -14.405 30.645 -35.685 200 HB3 PRO 27 3HB PRO 27 -12.884 30.692 -36.623 201 HG2 PRO 27 2HG PRO 27 -14.918 28.440 -36.505 202 HG3 PRO 27 3HG PRO 27 -14.177 29.192 -37.955 203 HD2 PRO 27 2HD PRO 27 -13.211 26.892 -36.930 204 HD3 PRO 27 3HD PRO 27 -12.089 28.145 -37.539 205 H ARG 28 H ARG 28 -12.100 29.847 -32.564 206 HA ARG 28 HA ARG 28 -14.755 29.476 -31.295 207 HB2 ARG 28 2HB ARG 28 -13.924 28.022 -29.610 208 HB3 ARG 28 3HB ARG 28 -13.550 27.338 -31.197 209 HG2 ARG 28 2HG ARG 28 -11.192 28.234 -30.989 210 HG3 ARG 28 3HG ARG 28 -11.605 28.799 -29.369 211 HD2 ARG 28 2HD ARG 28 -10.468 26.746 -29.105 212 HD3 ARG 28 3HD ARG 28 -12.160 26.433 -28.732 213 HE ARG 28 HE ARG 28 -10.837 25.777 -31.373 214 HH11 ARG 28 2HH2 ARG 28 -13.126 24.748 -28.902 215 HH12 ARG 28 1HH2 ARG 28 -13.444 23.253 -29.738 216 HH21 ARG 28 1HH1 ARG 28 -11.215 23.918 -32.282 217 HH22 ARG 28 2HH1 ARG 28 -12.389 22.780 -31.637 218 H GLN 29 H GLN 29 -14.963 30.388 -29.232 219 HA GLN 29 HA GLN 29 -13.339 32.882 -28.853 220 HB2 GLN 29 2HB GLN 29 -16.354 32.613 -28.584 221 HB3 GLN 29 3HB GLN 29 -15.389 34.080 -28.489 222 HG2 GLN 29 2HG GLN 29 -15.637 34.423 -30.683 223 HG3 GLN 29 3HG GLN 29 -14.882 32.871 -31.057 224 HE21 GLN 29 1HE2 GLN 29 -16.776 31.066 -30.010 225 HE22 GLN 29 2HE2 GLN 29 -18.239 31.229 -30.971 226 H ILE 30 H ILE 30 -12.244 32.261 -26.999 227 HA ILE 30 HA ILE 30 -13.717 31.241 -24.668 228 HB ILE 30 HB ILE 30 -10.797 32.011 -24.941 229 HG12 ILE 30 2HG1 ILE 30 -10.369 29.581 -24.845 230 HG13 ILE 30 3HG1 ILE 30 -12.103 29.267 -24.923 231 HG21 ILE 30 1HG2 ILE 30 -11.624 32.119 -22.604 232 HG22 ILE 30 2HG2 ILE 30 -12.359 30.512 -22.770 233 HG23 ILE 30 3HG2 ILE 30 -10.595 30.703 -22.808 234 HD11 ILE 30 3HD1 ILE 30 -12.220 29.824 -27.206 235 HD12 ILE 30 1HD1 ILE 30 -10.622 30.638 -27.176 236 HD13 ILE 30 2HD1 ILE 30 -10.748 28.872 -27.023 237 H ALA 31 H ALA 31 -15.046 32.676 -23.801 238 HA ALA 31 HA ALA 31 -14.167 35.493 -23.337 239 HB1 ALA 31 3HB ALA 31 -16.576 35.894 -22.869 240 HB2 ALA 31 1HB ALA 31 -16.267 35.303 -24.512 241 HB3 ALA 31 2HB ALA 31 -16.914 34.195 -23.272 242 H ARG 32 H ARG 32 -14.212 36.372 -21.290 243 HA ARG 32 HA ARG 32 -14.169 34.427 -19.018 244 HB2 ARG 32 2HB ARG 32 -12.820 37.074 -19.488 245 HB3 ARG 32 3HB ARG 32 -13.201 36.595 -17.828 246 HG2 ARG 32 2HG ARG 32 -11.952 34.568 -17.977 247 HG3 ARG 32 3HG ARG 32 -11.736 34.725 -19.720 248 HD2 ARG 32 2HD ARG 32 -9.672 35.386 -18.852 249 HD3 ARG 32 3HD ARG 32 -10.466 36.908 -19.219 250 HE ARG 32 HE ARG 32 -10.882 37.275 -16.855 251 HH11 ARG 32 2HH1 ARG 32 -8.714 34.555 -17.392 252 HH12 ARG 32 1HH1 ARG 32 -8.035 34.698 -15.796 253 HH21 ARG 32 2HH2 ARG 32 -10.011 37.374 -14.893 254 HH22 ARG 32 1HH2 ARG 32 -8.730 36.269 -14.416 255 H TYR 33 H TYR 33 -15.238 34.760 -17.133 256 HA TYR 33 HA TYR 33 -17.264 36.912 -17.021 257 HB2 TYR 33 2HB TYR 33 -17.942 33.987 -16.564 258 HB3 TYR 33 3HB TYR 33 -18.975 35.338 -16.218 259 HD1 TYR 33 HD1 TYR 33 -17.252 33.571 -19.049 260 HD2 TYR 33 HD2 TYR 33 -20.402 36.222 -17.813 261 HE1 TYR 33 HE1 TYR 33 -18.305 33.387 -21.305 262 HE2 TYR 33 HE2 TYR 33 -21.430 36.067 -20.071 263 HH TYR 33 HH TYR 33 -21.394 35.068 -22.050 264 H ARG 34 H ARG 34 -17.676 37.663 -15.018 265 HA ARG 34 HA ARG 34 -15.983 36.692 -12.756 266 HB2 ARG 34 2HB ARG 34 -15.598 38.984 -13.721 267 HB3 ARG 34 3HB ARG 34 -17.239 39.427 -13.271 268 HG2 ARG 34 2HG ARG 34 -16.728 39.135 -10.895 269 HG3 ARG 34 3HG ARG 34 -15.122 38.491 -11.273 270 HD2 ARG 34 2HD ARG 34 -14.514 40.668 -12.332 271 HD3 ARG 34 3HD ARG 34 -16.128 41.273 -11.969 272 HE ARG 34 HE ARG 34 -15.633 41.365 -9.661 273 HH11 ARG 34 1HH2 ARG 34 -12.694 40.439 -11.448 274 HH12 ARG 34 2HH2 ARG 34 -11.708 40.788 -10.058 275 HH21 ARG 34 2HH1 ARG 34 -14.246 41.820 -8.013 276 HH22 ARG 34 1HH1 ARG 34 -12.541 41.554 -8.206 277 H THR 35 H THR 35 -16.880 35.881 -11.016 278 HA THR 35 HA THR 35 -19.778 35.578 -10.770 279 HB THR 35 HB THR 35 -19.263 34.216 -8.765 280 HG1 THR 35 HG1 THR 35 -16.589 34.604 -9.405 281 HG21 THR 35 1HG2 THR 35 -17.551 33.509 -11.182 282 HG22 THR 35 2HG2 THR 35 -18.037 32.425 -9.866 283 HG23 THR 35 3HG2 THR 35 -19.264 33.121 -10.946 284 H ASP 36 H ASP 36 -20.502 35.722 -8.267 285 HA ASP 36 HA ASP 36 -20.456 38.602 -7.737 286 HB2 ASP 36 2HB ASP 36 -22.560 37.229 -7.726 287 HB3 ASP 36 3HB ASP 36 -21.951 36.350 -6.323 288 H ASN 37 H ASN 37 -18.600 35.984 -6.762 289 HA ASN 37 HA ASN 37 -17.747 37.164 -4.177 290 HB2 ASN 37 2HB ASN 37 -18.570 34.844 -4.277 291 HB3 ASN 37 3HB ASN 37 -17.365 34.443 -5.473 292 HD21 ASN 37 1HD2 ASN 37 -16.006 33.033 -4.429 293 HD22 ASN 37 2HD2 ASN 37 -15.391 33.282 -2.832 294 H GLY 38 H GLY 38 -17.112 37.913 -7.183 295 HA2 GLY 38 HA2 GLY 38 -15.381 39.144 -8.119 296 HA3 GLY 38 HA3 GLY 38 -14.298 38.687 -6.793 297 H GLU 39 H GLU 39 -15.644 35.876 -7.942 298 HA GLU 39 HA GLU 39 -12.962 35.124 -8.795 299 HB2 GLU 39 2HB GLU 39 -15.294 33.217 -8.772 300 HB3 GLU 39 3HB GLU 39 -13.586 32.912 -8.539 301 HG2 GLU 39 2HG GLU 39 -14.078 34.557 -6.401 302 HG3 GLU 39 3HG GLU 39 -15.719 33.945 -6.709 303 H GLU 40 H GLU 40 -12.284 35.272 -10.799 304 HA GLU 40 HA GLU 40 -14.220 35.302 -13.049 305 HB2 GLU 40 2HB GLU 40 -11.324 36.156 -12.813 306 HB3 GLU 40 3HB GLU 40 -12.180 36.025 -14.363 307 HG2 GLU 40 2HG GLU 40 -13.885 37.584 -13.617 308 HG3 GLU 40 3HG GLU 40 -13.113 37.724 -12.028 309 H PHE 41 H PHE 41 -14.513 33.769 -14.428 310 HA PHE 41 HA PHE 41 -12.511 31.571 -14.789 311 HB2 PHE 41 2HB PHE 41 -15.532 31.378 -14.683 312 HB3 PHE 41 3HB PHE 41 -14.468 30.080 -15.135 313 HD1 PHE 41 HD2 PHE 41 -15.579 32.179 -12.214 314 HD2 PHE 41 HD1 PHE 41 -13.224 28.794 -13.528 315 HE1 PHE 41 HE2 PHE 41 -15.284 31.461 -9.905 316 HE2 PHE 41 HE1 PHE 41 -12.889 28.119 -11.169 317 HZ PHE 41 HZ PHE 41 -13.910 29.457 -9.339 318 H GLU 42 H GLU 42 -12.660 30.476 -16.785 319 HA GLU 42 HA GLU 42 -13.377 32.249 -19.054 320 HB2 GLU 42 2HB GLU 42 -11.430 29.950 -19.262 321 HB3 GLU 42 3HB GLU 42 -11.603 31.382 -20.258 322 HG2 GLU 42 2HG GLU 42 -9.761 32.055 -19.167 323 HG3 GLU 42 3HG GLU 42 -10.892 32.604 -17.944 324 H VAL 43 H VAL 43 -14.802 31.640 -20.527 325 HA VAL 43 HA VAL 43 -15.796 28.810 -20.631 326 HB VAL 43 HB VAL 43 -17.378 31.329 -21.155 327 HG11 VAL 43 1HG1 VAL 43 -18.136 29.297 -22.408 328 HG12 VAL 43 2HG1 VAL 43 -18.285 28.439 -20.859 329 HG13 VAL 43 3HG1 VAL 43 -19.289 29.866 -21.218 330 HG21 VAL 43 3HG2 VAL 43 -18.502 30.971 -19.088 331 HG22 VAL 43 1HG2 VAL 43 -17.577 29.485 -18.749 332 HG23 VAL 43 2HG2 VAL 43 -16.796 31.084 -18.722 333 HA PRO 44 HA PRO 44 -14.506 29.314 -24.977 334 HB2 PRO 44 2HB PRO 44 -14.839 26.353 -24.931 335 HB3 PRO 44 3HB PRO 44 -13.489 27.327 -25.571 336 HG2 PRO 44 2HG PRO 44 -13.268 25.961 -23.216 337 HG3 PRO 44 3HG PRO 44 -12.554 27.595 -23.394 338 HD2 PRO 44 2HD PRO 44 -15.188 26.834 -22.105 339 HD3 PRO 44 3HD PRO 44 -13.920 27.979 -21.550 340 H PHE 45 H PHE 45 -15.883 29.831 -26.442 341 HA PHE 45 HA PHE 45 -18.456 28.354 -26.910 342 HB2 PHE 45 2HB PHE 45 -17.651 31.241 -27.351 343 HB3 PHE 45 3HB PHE 45 -19.039 30.563 -28.125 344 HD1 PHE 45 HD1 PHE 45 -17.549 31.606 -24.887 345 HD2 PHE 45 HD2 PHE 45 -21.071 30.012 -26.816 346 HE1 PHE 45 HE1 PHE 45 -18.888 32.080 -22.869 347 HE2 PHE 45 HE2 PHE 45 -22.403 30.497 -24.769 348 HZ PHE 45 HZ PHE 45 -21.292 31.526 -22.783 349 H ALA 46 H ALA 46 -18.954 27.713 -28.989 350 HA ALA 46 HA ALA 46 -16.748 27.604 -30.980 351 HB1 ALA 46 3HB ALA 46 -19.504 26.298 -30.956 352 HB2 ALA 46 1HB ALA 46 -18.209 25.999 -32.136 353 HB3 ALA 46 2HB ALA 46 -17.984 25.531 -30.440 354 H ASP 47 H ASP 47 -17.242 28.173 -33.271 355 HA ASP 47 HA ASP 47 -18.308 30.772 -33.611 356 HB2 ASP 47 2HB ASP 47 -16.643 29.769 -35.089 357 HB3 ASP 47 3HB ASP 47 -17.800 28.550 -35.631 358 H ASP 48 H ASP 48 -19.997 27.740 -33.542 359 HA ASP 48 HA ASP 48 -22.426 28.558 -34.915 360 HB2 ASP 48 2HB ASP 48 -21.601 26.210 -34.581 361 HB3 ASP 48 3HB ASP 48 -21.957 26.370 -32.863 362 H ALA 49 H ALA 49 -21.103 29.474 -31.933 363 HA ALA 49 HA ALA 49 -23.717 30.459 -30.873 364 HB1 ALA 49 3HB ALA 49 -22.840 30.075 -28.615 365 HB2 ALA 49 1HB ALA 49 -22.874 28.560 -29.534 366 HB3 ALA 49 2HB ALA 49 -21.334 29.416 -29.292 367 H GLU 50 H GLU 50 -23.569 32.383 -29.554 368 HA GLU 50 HA GLU 50 -21.127 34.058 -29.856 369 HB2 GLU 50 2HB GLU 50 -23.973 34.909 -30.487 370 HB3 GLU 50 3HB GLU 50 -22.702 36.060 -30.052 371 HG2 GLU 50 2HG GLU 50 -21.313 35.334 -31.928 372 HG3 GLU 50 3HG GLU 50 -22.498 34.107 -32.367 373 H ILE 51 H ILE 51 -20.585 35.161 -28.148 374 HA ILE 51 HA ILE 51 -21.099 34.307 -25.604 375 HB ILE 51 HB ILE 51 -20.132 37.116 -26.163 376 HG12 ILE 51 2HG1 ILE 51 -18.920 35.685 -27.735 377 HG13 ILE 51 3HG1 ILE 51 -17.866 36.294 -26.461 378 HG21 ILE 51 1HG2 ILE 51 -18.746 36.738 -24.167 379 HG22 ILE 51 2HG2 ILE 51 -20.447 36.479 -23.765 380 HG23 ILE 51 3HG2 ILE 51 -19.375 35.099 -24.013 381 HD11 ILE 51 3HD1 ILE 51 -19.000 33.482 -26.726 382 HD12 ILE 51 1HD1 ILE 51 -17.321 33.996 -26.973 383 HD13 ILE 51 2HD1 ILE 51 -18.007 34.035 -25.356 384 HA PRO 52 HA PRO 52 -24.898 36.643 -24.634 385 HB2 PRO 52 2HB PRO 52 -25.608 35.146 -22.469 386 HB3 PRO 52 3HB PRO 52 -25.923 34.624 -24.154 387 HG2 PRO 52 2HG PRO 52 -23.692 33.786 -22.298 388 HG3 PRO 52 3HG PRO 52 -24.680 32.766 -23.400 389 HD2 PRO 52 2HD PRO 52 -22.140 33.739 -23.982 390 HD3 PRO 52 3HD PRO 52 -23.321 33.338 -25.233 391 H GLY 53 H GLY 53 -25.210 38.194 -23.061 392 HA2 GLY 53 HA2 GLY 53 -23.138 39.552 -21.878 393 HA3 GLY 53 HA3 GLY 53 -24.812 39.651 -21.322 394 H THR 54 H THR 54 -24.872 36.834 -20.335 395 HA THR 54 HA THR 54 -22.691 36.732 -18.378 396 HB THR 54 HB THR 54 -24.304 36.157 -16.530 397 HG1 THR 54 HG1 THR 54 -26.530 36.488 -16.896 398 HG21 THR 54 1HG2 THR 54 -23.755 38.589 -16.852 399 HG22 THR 54 2HG2 THR 54 -25.258 38.772 -17.759 400 HG23 THR 54 3HG2 THR 54 -25.293 38.288 -16.047 401 H TRP 55 H TRP 55 -22.501 34.615 -17.278 402 HA TRP 55 HA TRP 55 -23.826 32.278 -18.426 403 HB2 TRP 55 2HB TRP 55 -22.050 32.940 -20.108 404 HB3 TRP 55 3HB TRP 55 -20.845 32.637 -18.862 405 HD1 TRP 55 HD1 TRP 55 -20.310 30.136 -18.273 406 HE1 TRP 55 HE1 TRP 55 -20.640 27.943 -19.526 407 HE3 TRP 55 HE3 TRP 55 -23.881 31.666 -21.548 408 HZ2 TRP 55 HZ2 TRP 55 -22.402 26.910 -21.601 409 HZ3 TRP 55 HZ3 TRP 55 -24.913 30.054 -23.157 410 HH2 TRP 55 HH2 TRP 55 -24.172 27.682 -23.191 411 H LEU 56 H LEU 56 -23.412 30.337 -17.202 412 HA LEU 56 HA LEU 56 -22.776 30.818 -14.430 413 HB2 LEU 56 2HB LEU 56 -24.303 28.979 -15.854 414 HB3 LEU 56 3HB LEU 56 -22.936 28.011 -15.306 415 HG LEU 56 HG LEU 56 -24.637 29.742 -13.469 416 HD11 LEU 56 1HD1 LEU 56 -24.812 26.747 -14.015 417 HD12 LEU 56 2HD1 LEU 56 -25.731 27.640 -12.780 418 HD13 LEU 56 3HD1 LEU 56 -26.009 27.971 -14.498 419 HD21 LEU 56 3HD2 LEU 56 -22.419 29.192 -12.540 420 HD22 LEU 56 1HD2 LEU 56 -23.684 28.300 -11.689 421 HD23 LEU 56 2HD2 LEU 56 -22.671 27.477 -12.901 422 H CYS 57 H CYS 57 -20.924 30.623 -13.371 423 HA CYS 57 HA CYS 57 -18.483 29.742 -14.804 424 HB2 CYS 57 2HB CYS 57 -18.992 31.355 -12.280 425 HB3 CYS 57 3HB CYS 57 -17.384 30.808 -12.765 426 HG CYS 57 HG CYS 57 -17.547 33.286 -13.458 427 H ARG 58 H ARG 58 -16.809 28.555 -13.594 428 HA ARG 58 HA ARG 58 -17.871 26.067 -12.655 429 HB2 ARG 58 2HB ARG 58 -14.982 27.004 -12.492 430 HB3 ARG 58 3HB ARG 58 -15.568 25.348 -12.408 431 HG2 ARG 58 2HG ARG 58 -16.436 25.573 -14.763 432 HG3 ARG 58 3HG ARG 58 -15.725 27.194 -14.830 433 HD2 ARG 58 2HD ARG 58 -14.193 25.693 -15.907 434 HD3 ARG 58 3HD ARG 58 -13.479 26.241 -14.398 435 HE ARG 58 HE ARG 58 -13.552 24.080 -13.545 436 HH11 ARG 58 1HH2 ARG 58 -15.421 24.057 -16.515 437 HH12 ARG 58 2HH2 ARG 58 -15.529 22.318 -16.532 438 HH21 ARG 58 2HH1 ARG 58 -13.739 21.876 -13.632 439 HH22 ARG 58 1HH1 ARG 58 -14.601 21.124 -14.941 440 H ASN 59 H ASN 59 -17.126 28.891 -10.816 441 HA ASN 59 HA ASN 59 -16.835 27.626 -8.258 442 HB2 ASN 59 2HB ASN 59 -16.200 29.916 -8.646 443 HB3 ASN 59 3HB ASN 59 -17.857 30.354 -9.089 444 HD21 ASN 59 1HD2 ASN 59 -17.663 32.061 -7.487 445 HD22 ASN 59 2HD2 ASN 59 -17.788 31.667 -5.804 446 H GLY 60 H GLY 60 -19.546 28.024 -10.355 447 HA2 GLY 60 HA2 GLY 60 -21.642 26.933 -10.165 448 HA3 GLY 60 HA3 GLY 60 -21.476 26.850 -8.410 449 H MET 61 H MET 61 -20.674 29.917 -9.762 450 HA MET 61 HA MET 61 -23.320 31.086 -9.068 451 HB2 MET 61 2HB MET 61 -21.354 31.705 -7.618 452 HB3 MET 61 3HB MET 61 -20.584 32.398 -9.029 453 HG2 MET 61 2HG MET 61 -21.686 34.094 -7.607 454 HG3 MET 61 3HG MET 61 -22.315 34.074 -9.247 455 HE1 MET 61 3HE MET 61 -24.583 32.691 -5.446 456 HE2 MET 61 1HE MET 61 -23.167 31.800 -6.043 457 HE3 MET 61 2HE MET 61 -22.989 33.475 -5.466 458 H GLU 62 H GLU 62 -24.198 32.645 -10.452 459 HA GLU 62 HA GLU 62 -23.579 32.462 -13.286 460 HB2 GLU 62 2HB GLU 62 -25.404 34.310 -11.710 461 HB3 GLU 62 3HB GLU 62 -25.247 34.314 -13.475 462 HG2 GLU 62 2HG GLU 62 -25.948 31.938 -13.557 463 HG3 GLU 62 3HG GLU 62 -26.135 31.922 -11.802 464 H GLY 63 H GLY 63 -21.789 33.285 -14.120 465 HA2 GLY 63 HA2 GLY 63 -20.440 35.618 -12.979 466 HA3 GLY 63 HA3 GLY 63 -19.850 34.602 -14.276 467 H THR 64 H THR 64 -20.134 37.584 -14.074 468 HA THR 64 HA THR 64 -21.782 38.022 -16.525 469 HB THR 64 HB THR 64 -20.622 40.062 -14.594 470 HG1 THR 64 HG1 THR 64 -22.746 40.277 -13.901 471 HG21 THR 64 1HG2 THR 64 -20.915 41.154 -16.732 472 HG22 THR 64 2HG2 THR 64 -22.492 40.386 -16.993 473 HG23 THR 64 3HG2 THR 64 -22.289 41.623 -15.729 474 H LEU 65 H LEU 65 -20.949 38.850 -18.385 475 HA LEU 65 HA LEU 65 -18.337 38.064 -19.077 476 HB2 LEU 65 2HB LEU 65 -20.414 38.217 -20.449 477 HB3 LEU 65 3HB LEU 65 -20.273 39.958 -20.451 478 HG LEU 65 HG LEU 65 -18.591 37.847 -21.849 479 HD11 LEU 65 1HD1 LEU 65 -20.727 38.637 -22.858 480 HD12 LEU 65 2HD1 LEU 65 -20.109 40.301 -22.844 481 HD13 LEU 65 3HD1 LEU 65 -19.327 39.070 -23.854 482 HD21 LEU 65 3HD2 LEU 65 -17.879 40.795 -21.623 483 HD22 LEU 65 1HD2 LEU 65 -16.871 39.374 -21.210 484 HD23 LEU 65 2HD2 LEU 65 -17.260 39.708 -22.888 485 H ILE 66 H ILE 66 -16.417 39.005 -18.722 486 HA ILE 66 HA ILE 66 -16.148 41.966 -18.673 487 HB ILE 66 HB ILE 66 -14.477 41.939 -16.996 488 HG12 ILE 66 2HG1 ILE 66 -13.335 39.852 -17.203 489 HG13 ILE 66 3HG1 ILE 66 -13.950 39.984 -15.559 490 HG21 ILE 66 1HG2 ILE 66 -15.781 41.481 -15.013 491 HG22 ILE 66 2HG2 ILE 66 -16.797 42.206 -16.274 492 HG23 ILE 66 3HG2 ILE 66 -16.906 40.471 -15.935 493 HD11 ILE 66 3HD1 ILE 66 -14.274 37.769 -16.158 494 HD12 ILE 66 1HD1 ILE 66 -15.879 38.517 -16.301 495 HD13 ILE 66 2HD1 ILE 66 -14.896 38.232 -17.752 496 H GLU 67 H GLU 67 -14.102 42.790 -19.338 497 HA GLU 67 HA GLU 67 -12.720 41.028 -21.319 498 HB2 GLU 67 2HB GLU 67 -12.981 44.050 -21.197 499 HB3 GLU 67 3HB GLU 67 -12.004 43.153 -22.368 500 HG2 GLU 67 2HG GLU 67 -14.042 41.980 -23.176 501 HG3 GLU 67 3HG GLU 67 -15.029 42.913 -22.047 502 H GLY 68 H GLY 68 -10.603 40.662 -21.236 503 HA2 GLY 68 HA2 GLY 68 -8.567 42.312 -20.292 504 HA3 GLY 68 HA3 GLY 68 -8.986 41.286 -18.913 505 H ASP 69 H ASP 69 -9.658 38.949 -20.606 506 HA ASP 69 HA ASP 69 -7.392 38.188 -22.231 507 HB2 ASP 69 2HB ASP 69 -7.953 36.919 -19.509 508 HB3 ASP 69 3HB ASP 69 -7.299 35.963 -20.829 509 H LEU 70 H LEU 70 -9.695 36.273 -23.814 510 HA LEU 70 HA LEU 70 -6.836 36.034 -23.101 511 HB2 LEU 70 2HB LEU 70 -8.660 34.804 -25.190 512 HB3 LEU 70 3HB LEU 70 -6.922 34.738 -25.379 513 HG LEU 70 HG LEU 70 -6.742 33.582 -23.153 514 HD11 LEU 70 1HD1 LEU 70 -8.804 34.184 -22.051 515 HD12 LEU 70 2HD1 LEU 70 -9.771 33.599 -23.421 516 HD13 LEU 70 3HD1 LEU 70 -8.885 32.454 -22.373 517 HD21 LEU 70 3HD2 LEU 70 -7.563 31.417 -24.041 518 HD22 LEU 70 1HD2 LEU 70 -8.482 32.281 -25.295 519 HD23 LEU 70 2HD2 LEU 70 -6.708 32.349 -25.277 520 HA PRO 71 HA PRO 71 -5.523 39.158 -26.088 521 HB2 PRO 71 2HB PRO 71 -3.242 38.098 -27.179 522 HB3 PRO 71 3HB PRO 71 -3.334 38.727 -25.507 523 HG2 PRO 71 2HG PRO 71 -3.583 35.845 -26.430 524 HG3 PRO 71 3HG PRO 71 -2.559 36.501 -25.114 525 HD2 PRO 71 2HD PRO 71 -4.967 35.383 -24.590 526 HD3 PRO 71 3HD PRO 71 -4.420 36.827 -23.697 527 H GLU 72 H GLU 72 -5.831 35.782 -27.248 528 HA GLU 72 HA GLU 72 -6.894 36.798 -29.849 529 HB2 GLU 72 2HB GLU 72 -4.938 34.503 -29.528 530 HB3 GLU 72 3HB GLU 72 -5.661 35.088 -31.040 531 HG2 GLU 72 2HG GLU 72 -4.516 37.305 -30.596 532 HG3 GLU 72 3HG GLU 72 -3.628 36.512 -29.291 533 HA PRO 73 HA PRO 73 -9.866 33.428 -28.785 534 HB2 PRO 73 2HB PRO 73 -12.044 34.796 -27.942 535 HB3 PRO 73 3HB PRO 73 -10.762 34.259 -26.810 536 HG2 PRO 73 2HG PRO 73 -11.144 37.005 -28.033 537 HG3 PRO 73 3HG PRO 73 -10.771 36.559 -26.341 538 HD2 PRO 73 2HD PRO 73 -8.847 37.332 -28.176 539 HD3 PRO 73 3HD PRO 73 -8.521 36.243 -26.819 540 H LYS 74 H LYS 74 -10.956 32.908 -30.560 541 HA LYS 74 HA LYS 74 -11.336 32.871 -32.789 542 HB2 LYS 74 2HB LYS 74 -13.219 34.526 -31.745 543 HB3 LYS 74 3HB LYS 74 -12.502 35.633 -32.911 544 HG2 LYS 74 2HG LYS 74 -12.896 33.931 -34.715 545 HG3 LYS 74 3HG LYS 74 -13.545 32.822 -33.494 546 HD2 LYS 74 2HD LYS 74 -15.289 34.627 -32.964 547 HD3 LYS 74 3HD LYS 74 -14.747 35.467 -34.423 548 HE2 LYS 74 2HE LYS 74 -15.373 33.602 -35.826 549 HE3 LYS 74 3HE LYS 74 -15.569 32.533 -34.433 550 HZ1 LYS 74 HZ1 LYS 74 -17.482 33.831 -33.733 551 HZ2 LYS 74 HZ2 LYS 74 -17.329 34.842 -35.029 552 HZ3 LYS 74 HZ3 LYS 74 -17.682 33.252 -35.260 553 H LYS 75 H LYS 75 -11.249 34.661 -34.880 554 HA LYS 75 HA LYS 75 -8.370 34.843 -35.277 555 HB2 LYS 75 2HB LYS 75 -10.057 33.927 -36.914 556 HB3 LYS 75 3HB LYS 75 -10.590 35.584 -37.217 557 HG2 LYS 75 2HG LYS 75 -8.257 36.159 -37.953 558 HG3 LYS 75 3HG LYS 75 -7.760 34.490 -37.618 559 HD2 LYS 75 2HD LYS 75 -9.376 33.668 -39.315 560 HD3 LYS 75 3HD LYS 75 -9.883 35.341 -39.641 561 HE2 LYS 75 2HE LYS 75 -7.559 35.909 -40.316 562 HE3 LYS 75 3HE LYS 75 -7.055 34.244 -39.994 563 HZ1 LYS 75 HZ1 LYS 75 -7.527 34.586 -42.351 564 HZ2 LYS 75 HZ2 LYS 75 -8.592 33.512 -41.740 565 HZ3 LYS 75 HZ3 LYS 75 -9.058 35.050 -42.038 566 H VAL 76 H VAL 76 -8.323 36.428 -33.447 567 HA VAL 76 HA VAL 76 -8.188 39.224 -34.523 568 HB VAL 76 HB VAL 76 -8.829 40.168 -32.458 569 HG11 VAL 76 1HG1 VAL 76 -10.689 39.387 -33.923 570 HG12 VAL 76 2HG1 VAL 76 -10.809 37.911 -32.932 571 HG13 VAL 76 3HG1 VAL 76 -11.123 39.498 -32.208 572 HG21 VAL 76 3HG2 VAL 76 -7.824 38.772 -30.798 573 HG22 VAL 76 1HG2 VAL 76 -9.562 38.753 -30.496 574 HG23 VAL 76 2HG2 VAL 76 -8.789 37.368 -31.296 575 H LYS 77 H LYS 77 -6.667 40.630 -33.327 576 HA LYS 77 HA LYS 77 -4.415 39.287 -31.964 577 HB2 LYS 77 2HB LYS 77 -3.852 39.344 -34.356 578 HB3 LYS 77 3HB LYS 77 -4.071 41.094 -34.389 579 HG2 LYS 77 2HG LYS 77 -2.197 41.380 -32.806 580 HG3 LYS 77 3HG LYS 77 -2.003 39.625 -32.690 581 HD2 LYS 77 2HD LYS 77 -1.648 41.256 -35.242 582 HD3 LYS 77 3HD LYS 77 -0.337 40.738 -34.171 583 HE2 LYS 77 2HE LYS 77 -0.962 38.360 -34.547 584 HE3 LYS 77 3HE LYS 77 -2.237 38.873 -35.661 585 HZ1 LYS 77 HZ1 LYS 77 0.675 39.369 -36.037 586 HZ2 LYS 77 HZ2 LYS 77 -0.217 38.277 -36.858 587 HZ3 LYS 77 HZ3 LYS 77 -0.498 39.873 -37.064 588 HA PRO 78 HA PRO 78 -4.940 42.748 -29.217 589 HB2 PRO 78 2HB PRO 78 -1.921 42.611 -28.953 590 HB3 PRO 78 3HB PRO 78 -3.146 42.780 -27.656 591 HG2 PRO 78 2HG PRO 78 -2.082 40.367 -28.124 592 HG3 PRO 78 3HG PRO 78 -3.863 40.513 -27.932 593 HD2 PRO 78 2HD PRO 78 -2.253 40.329 -30.489 594 HD3 PRO 78 3HD PRO 78 -3.741 39.453 -30.020 595 HA PRO 79 HA PRO 79 -3.898 46.589 -31.305 596 HB2 PRO 79 2HB PRO 79 -3.652 48.410 -29.259 597 HB3 PRO 79 3HB PRO 79 -5.215 47.733 -29.809 598 HG2 PRO 79 2HG PRO 79 -3.491 46.788 -27.493 599 HG3 PRO 79 3HG PRO 79 -5.250 47.145 -27.490 600 HD2 PRO 79 2HD PRO 79 -4.344 44.620 -27.759 601 HD3 PRO 79 3HD PRO 79 -5.740 45.177 -28.723 602 H ARG 80 H ARG 80 -2.196 48.042 -31.736 603 HA ARG 80 HA ARG 80 0.498 46.912 -31.147 604 HB2 ARG 80 2HB ARG 80 -0.585 48.619 -33.427 605 HB3 ARG 80 3HB ARG 80 1.121 48.283 -33.179 606 HG2 ARG 80 2HG ARG 80 0.354 46.790 -34.833 607 HG3 ARG 80 3HG ARG 80 0.691 45.829 -33.391 608 HD2 ARG 80 2HD ARG 80 -1.607 45.475 -32.959 609 HD3 ARG 80 3HD ARG 80 -2.114 46.822 -33.993 610 HE ARG 80 HE ARG 80 -0.951 45.185 -35.805 611 HH11 ARG 80 2HH1 ARG 80 -3.272 44.282 -33.328 612 HH12 ARG 80 1HH1 ARG 80 -4.289 43.451 -34.471 613 HH21 ARG 80 2HH2 ARG 80 -2.188 43.938 -37.149 614 HH22 ARG 80 1HH2 ARG 80 -3.616 43.152 -36.546 Start of MODEL 5 1 H1 SER 1 1H SER 1 -13.124 4.808 -47.249 2 H2 SER 1 2H SER 1 -14.327 5.168 -46.197 3 H3 SER 1 3H SER 1 -14.393 3.781 -47.068 4 HA SER 1 HA SER 1 -12.492 2.883 -45.962 5 HB2 SER 1 2HB SER 1 -12.509 5.465 -44.348 6 HB3 SER 1 3HB SER 1 -11.416 4.081 -44.130 7 HG SER 1 HG SER 1 -10.470 5.727 -45.418 8 H MET 2 H MET 2 -12.642 1.708 -43.955 9 HA MET 2 HA MET 2 -15.367 1.407 -42.940 10 HB2 MET 2 2HB MET 2 -12.742 0.076 -42.155 11 HB3 MET 2 3HB MET 2 -14.330 -0.353 -41.505 12 HG2 MET 2 2HG MET 2 -15.129 -0.898 -43.783 13 HG3 MET 2 3HG MET 2 -13.529 -0.524 -44.433 14 HE1 MET 2 3HE MET 2 -15.075 -3.240 -44.996 15 HE2 MET 2 1HE MET 2 -13.464 -2.860 -45.650 16 HE3 MET 2 2HE MET 2 -13.749 -4.412 -44.831 17 H ALA 3 H ALA 3 -16.022 1.576 -40.736 18 HA ALA 3 HA ALA 3 -15.120 3.999 -39.448 19 HB1 ALA 3 3HB ALA 3 -16.963 3.503 -37.887 20 HB2 ALA 3 1HB ALA 3 -17.483 3.308 -39.571 21 HB3 ALA 3 2HB ALA 3 -17.127 1.876 -38.573 22 H ASP 4 H ASP 4 -14.228 0.693 -39.004 23 HA ASP 4 HA ASP 4 -12.936 -0.499 -37.638 24 HB2 ASP 4 2HB ASP 4 -11.332 1.288 -38.232 25 HB3 ASP 4 3HB ASP 4 -11.746 2.137 -36.744 26 H ARG 5 H ARG 5 -14.759 1.943 -35.965 27 HA ARG 5 HA ARG 5 -15.164 0.140 -33.606 28 HB2 ARG 5 2HB ARG 5 -14.830 3.177 -33.629 29 HB3 ARG 5 3HB ARG 5 -15.352 2.234 -32.230 30 HG2 ARG 5 2HG ARG 5 -13.177 1.005 -32.247 31 HG3 ARG 5 3HG ARG 5 -12.656 1.973 -33.633 32 HD2 ARG 5 2HD ARG 5 -11.674 2.931 -31.682 33 HD3 ARG 5 3HD ARG 5 -12.916 4.043 -32.280 34 HE ARG 5 HE ARG 5 -13.966 2.241 -30.260 35 HH11 ARG 5 1HH2 ARG 5 -12.024 5.146 -30.516 36 HH12 ARG 5 2HH2 ARG 5 -12.452 5.683 -28.914 37 HH21 ARG 5 1HH1 ARG 5 -14.481 2.991 -28.232 38 HH22 ARG 5 2HH1 ARG 5 -13.803 4.485 -27.659 39 H VAL 6 H VAL 6 -17.197 0.774 -32.407 40 HA VAL 6 HA VAL 6 -19.442 0.982 -34.298 41 HB VAL 6 HB VAL 6 -19.557 0.681 -31.281 42 HG11 VAL 6 1HG1 VAL 6 -21.821 -0.226 -31.756 43 HG12 VAL 6 2HG1 VAL 6 -21.697 1.445 -32.306 44 HG13 VAL 6 3HG1 VAL 6 -21.606 0.118 -33.486 45 HG21 VAL 6 3HG2 VAL 6 -18.348 -1.242 -32.225 46 HG22 VAL 6 1HG2 VAL 6 -19.978 -1.727 -31.760 47 HG23 VAL 6 2HG2 VAL 6 -19.597 -1.443 -33.473 48 H LEU 7 H LEU 7 -18.862 3.076 -35.037 49 HA LEU 7 HA LEU 7 -19.191 5.395 -33.256 50 HB2 LEU 7 2HB LEU 7 -18.566 5.238 -36.226 51 HB3 LEU 7 3HB LEU 7 -18.495 6.690 -35.232 52 HG LEU 7 HG LEU 7 -16.688 4.253 -34.968 53 HD11 LEU 7 1HD1 LEU 7 -16.109 7.114 -35.827 54 HD12 LEU 7 2HD1 LEU 7 -14.936 5.781 -35.710 55 HD13 LEU 7 3HD1 LEU 7 -16.232 5.711 -36.911 56 HD21 LEU 7 3HD2 LEU 7 -15.406 5.647 -33.343 57 HD22 LEU 7 1HD2 LEU 7 -16.722 6.843 -33.361 58 HD23 LEU 7 2HD2 LEU 7 -17.002 5.199 -32.737 59 H ARG 8 H ARG 8 -21.505 3.558 -34.557 60 HA ARG 8 HA ARG 8 -23.213 5.552 -35.811 61 HB2 ARG 8 2HB ARG 8 -23.079 3.121 -36.435 62 HB3 ARG 8 3HB ARG 8 -23.963 2.740 -34.954 63 HG2 ARG 8 2HG ARG 8 -25.845 4.213 -35.745 64 HG3 ARG 8 3HG ARG 8 -24.943 4.555 -37.224 65 HD2 ARG 8 2HD ARG 8 -25.832 1.785 -36.315 66 HD3 ARG 8 3HD ARG 8 -26.719 2.805 -37.461 67 HE ARG 8 HE ARG 8 -24.134 2.608 -38.509 68 HH11 ARG 8 1HH2 ARG 8 -26.712 0.331 -37.844 69 HH12 ARG 8 2HH2 ARG 8 -26.198 -0.758 -39.104 70 HH21 ARG 8 1HH1 ARG 8 -23.527 1.171 -40.092 71 HH22 ARG 8 2HH1 ARG 8 -24.444 -0.285 -40.342 72 H GLY 9 H GLY 9 -22.875 6.969 -33.876 73 HA2 GLY 9 HA2 GLY 9 -24.535 6.690 -31.526 74 HA3 GLY 9 HA3 GLY 9 -23.831 8.179 -32.143 75 H SER 10 H SER 10 -26.175 8.529 -31.063 76 HA SER 10 HA SER 10 -28.519 7.672 -32.121 77 HB2 SER 10 2HB SER 10 -28.085 10.417 -30.891 78 HB3 SER 10 3HB SER 10 -29.596 9.485 -30.914 79 HG SER 10 HG SER 10 -28.472 9.245 -28.925 80 H ARG 11 H ARG 11 -26.692 10.319 -33.537 81 HA ARG 11 HA ARG 11 -28.881 11.141 -35.359 82 HB2 ARG 11 2HB ARG 11 -25.970 12.005 -35.344 83 HB3 ARG 11 3HB ARG 11 -27.290 12.744 -36.256 84 HG2 ARG 11 2HG ARG 11 -28.380 13.418 -34.099 85 HG3 ARG 11 3HG ARG 11 -26.991 12.739 -33.226 86 HD2 ARG 11 2HD ARG 11 -25.582 14.245 -34.860 87 HD3 ARG 11 3HD ARG 11 -27.091 15.136 -35.079 88 HE ARG 11 HE ARG 11 -26.903 15.062 -32.365 89 HH11 ARG 11 1HH2 ARG 11 -24.543 16.063 -34.773 90 HH12 ARG 11 2HH2 ARG 11 -23.640 16.992 -33.588 91 HH21 ARG 11 1HH1 ARG 11 -25.640 16.290 -30.945 92 HH22 ARG 11 2HH1 ARG 11 -24.181 17.045 -31.553 93 H LEU 12 H LEU 12 -28.329 8.422 -35.580 94 HA LEU 12 HA LEU 12 -27.573 6.715 -36.795 95 HB2 LEU 12 2HB LEU 12 -28.172 6.665 -39.138 96 HB3 LEU 12 3HB LEU 12 -29.412 7.277 -38.070 97 HG LEU 12 HG LEU 12 -28.947 9.609 -38.866 98 HD11 LEU 12 1HD1 LEU 12 -26.655 9.395 -39.775 99 HD12 LEU 12 2HD1 LEU 12 -27.224 8.199 -40.958 100 HD13 LEU 12 3HD1 LEU 12 -27.777 9.888 -41.040 101 HD21 LEU 12 3HD2 LEU 12 -29.664 7.559 -40.994 102 HD22 LEU 12 1HD2 LEU 12 -30.765 8.229 -39.770 103 HD23 LEU 12 2HD2 LEU 12 -30.085 9.288 -41.012 104 H GLY 13 H GLY 13 -25.462 8.196 -35.862 105 HA2 GLY 13 HA2 GLY 13 -23.144 7.831 -35.987 106 HA3 GLY 13 HA3 GLY 13 -23.271 7.388 -37.687 107 H ALA 14 H ALA 14 -24.934 10.242 -37.634 108 HA ALA 14 HA ALA 14 -22.609 11.843 -38.433 109 HB1 ALA 14 3HB ALA 14 -24.261 13.420 -39.241 110 HB2 ALA 14 1HB ALA 14 -24.697 11.785 -39.766 111 HB3 ALA 14 2HB ALA 14 -25.565 12.547 -38.414 112 H VAL 15 H VAL 15 -22.481 11.174 -35.697 113 HA VAL 15 HA VAL 15 -23.505 13.414 -34.092 114 HB VAL 15 HB VAL 15 -22.477 12.222 -32.169 115 HG11 VAL 15 1HG1 VAL 15 -24.162 10.478 -32.086 116 HG12 VAL 15 2HG1 VAL 15 -24.834 11.935 -32.820 117 HG13 VAL 15 3HG1 VAL 15 -24.385 10.552 -33.853 118 HG21 VAL 15 3HG2 VAL 15 -21.963 9.947 -34.143 119 HG22 VAL 15 1HG2 VAL 15 -20.705 10.926 -33.357 120 HG23 VAL 15 2HG2 VAL 15 -21.765 9.902 -32.382 121 H SER 16 H SER 16 -22.504 14.966 -33.132 122 HA SER 16 HA SER 16 -19.628 15.312 -32.910 123 HB2 SER 16 2HB SER 16 -21.231 16.845 -34.996 124 HB3 SER 16 3HB SER 16 -19.820 17.563 -34.212 125 HG SER 16 HG SER 16 -19.695 14.999 -35.409 126 H TYR 17 H TYR 17 -19.259 16.583 -31.166 127 HA TYR 17 HA TYR 17 -21.045 18.721 -30.311 128 HB2 TYR 17 2HB TYR 17 -21.537 17.767 -28.109 129 HB3 TYR 17 3HB TYR 17 -22.251 16.818 -29.389 130 HD1 TYR 17 HD2 TYR 17 -21.330 14.563 -29.986 131 HD2 TYR 17 HD1 TYR 17 -19.881 16.818 -26.600 132 HE1 TYR 17 HE2 TYR 17 -20.305 12.495 -29.044 133 HE2 TYR 17 HE1 TYR 17 -18.892 14.741 -25.648 134 HH TYR 17 HH TYR 17 -18.538 12.496 -25.925 135 H GLU 18 H GLU 18 -20.230 19.799 -28.314 136 HA GLU 18 HA GLU 18 -17.396 20.306 -28.574 137 HB2 GLU 18 2HB GLU 18 -19.057 22.063 -28.059 138 HB3 GLU 18 3HB GLU 18 -19.417 21.270 -26.526 139 HG2 GLU 18 2HG GLU 18 -17.979 22.986 -25.912 140 HG3 GLU 18 3HG GLU 18 -16.904 21.599 -25.941 141 H THR 19 H THR 19 -16.021 18.774 -27.986 142 HA THR 19 HA THR 19 -15.723 18.118 -25.146 143 HB THR 19 HB THR 19 -17.220 16.337 -26.071 144 HG1 THR 19 HG1 THR 19 -16.099 15.785 -24.317 145 HG21 THR 19 1HG2 THR 19 -16.321 14.566 -27.459 146 HG22 THR 19 2HG2 THR 19 -16.245 16.097 -28.344 147 HG23 THR 19 3HG2 THR 19 -14.768 15.409 -27.624 148 H ASP 20 H ASP 20 -13.620 17.003 -24.718 149 HA ASP 20 HA ASP 20 -11.502 18.398 -26.150 150 HB2 ASP 20 2HB ASP 20 -11.431 16.391 -23.868 151 HB3 ASP 20 3HB ASP 20 -10.019 17.220 -24.520 152 H ARG 21 H ARG 21 -10.340 17.723 -27.786 153 HA ARG 21 HA ARG 21 -9.567 14.911 -28.168 154 HB2 ARG 21 2HB ARG 21 -11.768 15.085 -29.348 155 HB3 ARG 21 3HB ARG 21 -11.107 16.362 -30.373 156 HG2 ARG 21 2HG ARG 21 -9.418 14.762 -31.274 157 HG3 ARG 21 3HG ARG 21 -10.012 13.519 -30.162 158 HD2 ARG 21 2HD ARG 21 -10.991 13.044 -32.284 159 HD3 ARG 21 3HD ARG 21 -12.268 13.677 -31.261 160 HE ARG 21 HE ARG 21 -12.415 15.607 -32.579 161 HH11 ARG 21 1HH1 ARG 21 -9.670 13.749 -33.724 162 HH12 ARG 21 2HH1 ARG 21 -9.580 14.637 -35.219 163 HH21 ARG 21 2HH2 ARG 21 -12.214 16.723 -34.480 164 HH22 ARG 21 1HH2 ARG 21 -10.980 16.286 -35.623 165 H ASN 22 H ASN 22 -9.581 18.089 -29.787 166 HA ASN 22 HA ASN 22 -6.622 17.906 -30.216 167 HB2 ASN 22 2HB ASN 22 -8.773 19.458 -31.723 168 HB3 ASN 22 3HB ASN 22 -7.044 19.683 -31.960 169 HD21 ASN 22 2HD2 ASN 22 -8.299 19.132 -34.188 170 HD22 ASN 22 1HD2 ASN 22 -8.021 17.463 -34.665 171 H HIS 23 H HIS 23 -5.375 19.798 -29.822 172 HA HIS 23 HA HIS 23 -6.540 21.709 -27.824 173 HB2 HIS 23 2HB HIS 23 -4.424 21.668 -26.671 174 HB3 HIS 23 3HB HIS 23 -5.040 20.032 -26.831 175 HD2 HIS 23 HD2 HIS 23 -3.617 18.296 -28.280 176 HE1 HIS 23 HE1 HIS 23 -0.341 20.856 -29.233 177 HE2 HIS 23 HE2 HIS 23 -1.193 18.458 -29.302 178 H ASP 24 H ASP 24 -5.606 21.759 -30.956 179 HA ASP 24 HA ASP 24 -3.821 24.062 -30.932 180 HB2 ASP 24 2HB ASP 24 -4.168 22.025 -32.666 181 HB3 ASP 24 3HB ASP 24 -5.245 23.205 -33.420 182 H LEU 25 H LEU 25 -4.430 25.848 -32.610 183 HA LEU 25 HA LEU 25 -6.690 27.412 -31.665 184 HB2 LEU 25 2HB LEU 25 -4.907 27.748 -34.111 185 HB3 LEU 25 3HB LEU 25 -6.041 28.947 -33.495 186 HG LEU 25 HG LEU 25 -3.546 27.945 -32.046 187 HD11 LEU 25 1HD1 LEU 25 -4.186 30.620 -33.356 188 HD12 LEU 25 2HD1 LEU 25 -2.699 30.198 -32.485 189 HD13 LEU 25 3HD1 LEU 25 -3.087 29.377 -34.002 190 HD21 LEU 25 3HD2 LEU 25 -5.228 28.588 -30.387 191 HD22 LEU 25 1HD2 LEU 25 -3.984 29.836 -30.477 192 HD23 LEU 25 2HD2 LEU 25 -5.559 30.100 -31.264 193 H ALA 26 H ALA 26 -8.671 27.472 -32.392 194 HA ALA 26 HA ALA 26 -9.535 26.153 -34.893 195 HB1 ALA 26 3HB ALA 26 -10.424 25.364 -32.076 196 HB2 ALA 26 1HB ALA 26 -11.030 24.656 -33.592 197 HB3 ALA 26 2HB ALA 26 -9.336 24.423 -33.115 198 HA PRO 27 HA PRO 27 -12.711 29.219 -34.923 199 HB2 PRO 27 2HB PRO 27 -14.810 27.132 -35.523 200 HB3 PRO 27 3HB PRO 27 -14.394 28.627 -36.414 201 HG2 PRO 27 2HG PRO 27 -13.560 26.223 -37.313 202 HG3 PRO 27 3HG PRO 27 -12.409 27.604 -37.301 203 HD2 PRO 27 2HD PRO 27 -12.732 25.421 -35.205 204 HD3 PRO 27 3HD PRO 27 -11.250 25.947 -36.054 205 H ARG 28 H ARG 28 -12.349 29.314 -32.495 206 HA ARG 28 HA ARG 28 -14.984 29.381 -31.148 207 HB2 ARG 28 2HB ARG 28 -14.099 28.393 -29.134 208 HB3 ARG 28 3HB ARG 28 -13.958 27.310 -30.525 209 HG2 ARG 28 2HG ARG 28 -11.570 27.656 -30.679 210 HG3 ARG 28 3HG ARG 28 -11.638 28.963 -29.487 211 HD2 ARG 28 2HD ARG 28 -10.810 27.032 -28.380 212 HD3 ARG 28 3HD ARG 28 -12.421 27.329 -27.757 213 HE ARG 28 HE ARG 28 -11.500 25.082 -29.474 214 HH11 ARG 28 1HH2 ARG 28 -14.320 26.513 -27.932 215 HH12 ARG 28 2HH2 ARG 28 -15.236 25.025 -28.061 216 HH21 ARG 28 2HH1 ARG 28 -12.753 23.225 -29.545 217 HH22 ARG 28 1HH1 ARG 28 -14.358 23.247 -28.842 218 H GLN 29 H GLN 29 -14.953 30.493 -29.093 219 HA GLN 29 HA GLN 29 -13.418 33.062 -29.112 220 HB2 GLN 29 2HB GLN 29 -16.408 32.724 -28.678 221 HB3 GLN 29 3HB GLN 29 -15.513 34.239 -28.662 222 HG2 GLN 29 2HG GLN 29 -15.739 34.498 -30.891 223 HG3 GLN 29 3HG GLN 29 -15.124 32.878 -31.222 224 HE21 GLN 29 1HE2 GLN 29 -16.849 31.165 -30.146 225 HE22 GLN 29 2HE2 GLN 29 -18.445 31.352 -30.879 226 H ILE 30 H ILE 30 -12.259 32.684 -27.273 227 HA ILE 30 HA ILE 30 -13.468 31.732 -24.794 228 HB ILE 30 HB ILE 30 -10.716 32.847 -25.420 229 HG12 ILE 30 2HG1 ILE 30 -9.920 30.589 -25.117 230 HG13 ILE 30 3HG1 ILE 30 -11.535 30.008 -24.712 231 HG21 ILE 30 1HG2 ILE 30 -11.229 33.267 -23.053 232 HG22 ILE 30 2HG2 ILE 30 -11.851 31.614 -22.863 233 HG23 ILE 30 3HG2 ILE 30 -10.120 31.904 -23.155 234 HD11 ILE 30 3HD1 ILE 30 -12.236 30.102 -26.993 235 HD12 ILE 30 1HD1 ILE 30 -10.770 31.016 -27.468 236 HD13 ILE 30 2HD1 ILE 30 -10.653 29.324 -26.951 237 H ALA 31 H ALA 31 -14.911 32.972 -23.905 238 HA ALA 31 HA ALA 31 -14.364 35.860 -23.381 239 HB1 ALA 31 3HB ALA 31 -16.736 35.873 -22.592 240 HB2 ALA 31 1HB ALA 31 -16.554 35.431 -24.299 241 HB3 ALA 31 2HB ALA 31 -16.878 34.169 -23.086 242 H ARG 32 H ARG 32 -14.748 36.589 -21.154 243 HA ARG 32 HA ARG 32 -14.215 34.537 -19.047 244 HB2 ARG 32 2HB ARG 32 -12.949 37.226 -19.503 245 HB3 ARG 32 3HB ARG 32 -13.319 36.774 -17.837 246 HG2 ARG 32 2HG ARG 32 -12.010 34.823 -17.916 247 HG3 ARG 32 3HG ARG 32 -11.790 34.913 -19.672 248 HD2 ARG 32 2HD ARG 32 -10.502 37.035 -19.361 249 HD3 ARG 32 3HD ARG 32 -10.715 36.887 -17.604 250 HE ARG 32 HE ARG 32 -9.554 34.473 -18.615 251 HH11 ARG 32 1HH2 ARG 32 -8.544 37.785 -18.080 252 HH12 ARG 32 2HH2 ARG 32 -6.875 37.321 -17.880 253 HH21 ARG 32 1HH1 ARG 32 -7.493 33.942 -18.322 254 HH22 ARG 32 2HH1 ARG 32 -6.283 35.179 -18.022 255 H TYR 33 H TYR 33 -15.261 34.842 -17.077 256 HA TYR 33 HA TYR 33 -17.351 36.928 -16.909 257 HB2 TYR 33 2HB TYR 33 -17.973 33.996 -16.514 258 HB3 TYR 33 3HB TYR 33 -19.022 35.327 -16.128 259 HD1 TYR 33 HD1 TYR 33 -17.326 33.610 -18.985 260 HD2 TYR 33 HD2 TYR 33 -20.439 36.287 -17.716 261 HE1 TYR 33 HE1 TYR 33 -18.386 33.472 -21.245 262 HE2 TYR 33 HE2 TYR 33 -21.480 36.158 -19.978 263 HH TYR 33 HH TYR 33 -21.449 35.193 -21.970 264 H ARG 34 H ARG 34 -17.659 37.728 -14.936 265 HA ARG 34 HA ARG 34 -16.003 36.742 -12.664 266 HB2 ARG 34 2HB ARG 34 -15.637 39.048 -13.507 267 HB3 ARG 34 3HB ARG 34 -17.323 39.439 -13.179 268 HG2 ARG 34 2HG ARG 34 -16.954 39.131 -10.767 269 HG3 ARG 34 3HG ARG 34 -15.290 38.589 -11.060 270 HD2 ARG 34 2HD ARG 34 -14.767 40.800 -12.083 271 HD3 ARG 34 3HD ARG 34 -16.435 41.300 -11.813 272 HE ARG 34 HE ARG 34 -16.069 41.477 -9.498 273 HH11 ARG 34 1HH1 ARG 34 -13.004 40.564 -11.059 274 HH12 ARG 34 2HH1 ARG 34 -12.114 40.996 -9.628 275 HH21 ARG 34 1HH2 ARG 34 -14.806 42.017 -7.779 276 HH22 ARG 34 2HH2 ARG 34 -13.084 41.803 -7.857 277 H THR 35 H THR 35 -16.911 35.856 -10.936 278 HA THR 35 HA THR 35 -19.815 35.495 -10.750 279 HB THR 35 HB THR 35 -19.358 34.052 -8.827 280 HG1 THR 35 HG1 THR 35 -16.653 34.523 -9.335 281 HG21 THR 35 1HG2 THR 35 -19.244 33.047 -11.011 282 HG22 THR 35 2HG2 THR 35 -17.522 33.462 -11.163 283 HG23 THR 35 3HG2 THR 35 -18.053 32.335 -9.899 284 H ASP 36 H ASP 36 -20.615 35.525 -8.277 285 HA ASP 36 HA ASP 36 -20.623 38.320 -7.607 286 HB2 ASP 36 2HB ASP 36 -22.605 36.783 -7.485 287 HB3 ASP 36 3HB ASP 36 -21.847 35.961 -6.118 288 H ASN 37 H ASN 37 -18.555 35.730 -6.522 289 HA ASN 37 HA ASN 37 -17.756 37.317 -4.132 290 HB2 ASN 37 2HB ASN 37 -16.311 34.878 -4.994 291 HB3 ASN 37 3HB ASN 37 -16.451 35.587 -3.423 292 HD21 ASN 37 1HD2 ASN 37 -16.944 32.876 -4.532 293 HD22 ASN 37 2HD2 ASN 37 -18.542 32.453 -3.875 294 H GLY 38 H GLY 38 -17.248 37.748 -7.327 295 HA2 GLY 38 HA2 GLY 38 -15.665 38.942 -8.518 296 HA3 GLY 38 HA3 GLY 38 -14.558 38.943 -7.140 297 H GLU 39 H GLU 39 -15.693 35.777 -7.821 298 HA GLU 39 HA GLU 39 -12.990 34.989 -8.627 299 HB2 GLU 39 2HB GLU 39 -15.360 33.128 -8.776 300 HB3 GLU 39 3HB GLU 39 -13.685 32.778 -8.442 301 HG2 GLU 39 2HG GLU 39 -14.257 34.353 -6.288 302 HG3 GLU 39 3HG GLU 39 -15.891 33.807 -6.719 303 H GLU 40 H GLU 40 -12.294 35.218 -10.668 304 HA GLU 40 HA GLU 40 -14.228 35.340 -12.922 305 HB2 GLU 40 2HB GLU 40 -11.361 36.244 -12.573 306 HB3 GLU 40 3HB GLU 40 -12.140 36.146 -14.166 307 HG2 GLU 40 2HG GLU 40 -13.894 37.649 -13.503 308 HG3 GLU 40 3HG GLU 40 -13.322 37.682 -11.832 309 H PHE 41 H PHE 41 -14.504 33.842 -14.367 310 HA PHE 41 HA PHE 41 -12.452 31.692 -14.780 311 HB2 PHE 41 2HB PHE 41 -15.473 31.440 -14.690 312 HB3 PHE 41 3HB PHE 41 -14.378 30.168 -15.178 313 HD1 PHE 41 HD2 PHE 41 -15.563 32.153 -12.212 314 HD2 PHE 41 HD1 PHE 41 -13.010 28.942 -13.609 315 HE1 PHE 41 HE2 PHE 41 -15.223 31.388 -9.920 316 HE2 PHE 41 HE1 PHE 41 -12.641 28.225 -11.269 317 HZ PHE 41 HZ PHE 41 -13.733 29.459 -9.408 318 H GLU 42 H GLU 42 -12.704 30.560 -16.887 319 HA GLU 42 HA GLU 42 -13.410 32.485 -19.044 320 HB2 GLU 42 2HB GLU 42 -11.363 30.257 -19.162 321 HB3 GLU 42 3HB GLU 42 -11.765 31.408 -20.431 322 HG2 GLU 42 2HG GLU 42 -10.403 32.978 -19.658 323 HG3 GLU 42 3HG GLU 42 -11.020 32.861 -18.023 324 H VAL 43 H VAL 43 -14.767 31.880 -20.583 325 HA VAL 43 HA VAL 43 -15.753 29.051 -20.661 326 HB VAL 43 HB VAL 43 -17.433 31.500 -21.156 327 HG11 VAL 43 1HG1 VAL 43 -18.197 28.562 -20.935 328 HG12 VAL 43 2HG1 VAL 43 -19.277 29.941 -21.257 329 HG13 VAL 43 3HG1 VAL 43 -18.090 29.467 -22.459 330 HG21 VAL 43 3HG2 VAL 43 -17.583 29.587 -18.800 331 HG22 VAL 43 1HG2 VAL 43 -16.843 31.200 -18.715 332 HG23 VAL 43 2HG2 VAL 43 -18.543 31.057 -19.100 333 HA PRO 44 HA PRO 44 -14.457 29.771 -24.985 334 HB2 PRO 44 2HB PRO 44 -14.026 27.170 -25.678 335 HB3 PRO 44 3HB PRO 44 -12.856 28.136 -24.736 336 HG2 PRO 44 2HG PRO 44 -14.860 26.119 -23.718 337 HG3 PRO 44 3HG PRO 44 -13.149 26.331 -23.239 338 HD2 PRO 44 2HD PRO 44 -15.296 27.342 -21.829 339 HD3 PRO 44 3HD PRO 44 -13.687 28.128 -21.808 340 H PHE 45 H PHE 45 -15.958 30.203 -26.411 341 HA PHE 45 HA PHE 45 -18.410 28.513 -26.766 342 HB2 PHE 45 2HB PHE 45 -17.760 31.416 -27.324 343 HB3 PHE 45 3HB PHE 45 -19.127 30.645 -28.065 344 HD1 PHE 45 HD2 PHE 45 -17.631 31.688 -24.811 345 HD2 PHE 45 HD1 PHE 45 -21.151 30.174 -26.803 346 HE1 PHE 45 HE2 PHE 45 -18.999 32.191 -22.812 347 HE2 PHE 45 HE1 PHE 45 -22.507 30.673 -24.773 348 HZ PHE 45 HZ PHE 45 -21.414 31.688 -22.772 349 H ALA 46 H ALA 46 -18.966 27.773 -28.805 350 HA ALA 46 HA ALA 46 -16.803 27.579 -30.813 351 HB1 ALA 46 3HB ALA 46 -18.101 25.569 -30.203 352 HB2 ALA 46 1HB ALA 46 -19.599 26.364 -30.744 353 HB3 ALA 46 2HB ALA 46 -18.315 25.986 -31.914 354 H ASP 47 H ASP 47 -17.157 28.169 -33.055 355 HA ASP 47 HA ASP 47 -18.155 30.753 -33.530 356 HB2 ASP 47 2HB ASP 47 -16.433 29.589 -34.851 357 HB3 ASP 47 3HB ASP 47 -17.646 28.472 -35.478 358 H ASP 48 H ASP 48 -19.968 27.799 -33.459 359 HA ASP 48 HA ASP 48 -22.293 28.690 -34.975 360 HB2 ASP 48 2HB ASP 48 -21.599 26.313 -34.590 361 HB3 ASP 48 3HB ASP 48 -22.003 26.505 -32.886 362 H ALA 49 H ALA 49 -21.073 29.535 -31.909 363 HA ALA 49 HA ALA 49 -23.705 30.559 -30.921 364 HB1 ALA 49 3HB ALA 49 -22.896 28.615 -29.614 365 HB2 ALA 49 1HB ALA 49 -21.367 29.474 -29.302 366 HB3 ALA 49 2HB ALA 49 -22.895 30.107 -28.654 367 H GLU 50 H GLU 50 -23.584 32.450 -29.549 368 HA GLU 50 HA GLU 50 -21.141 34.140 -29.783 369 HB2 GLU 50 2HB GLU 50 -23.984 34.982 -30.444 370 HB3 GLU 50 3HB GLU 50 -22.715 36.133 -30.002 371 HG2 GLU 50 2HG GLU 50 -21.313 35.400 -31.869 372 HG3 GLU 50 3HG GLU 50 -22.506 34.183 -32.319 373 H ILE 51 H ILE 51 -20.679 35.337 -28.093 374 HA ILE 51 HA ILE 51 -21.181 34.426 -25.554 375 HB ILE 51 HB ILE 51 -20.194 37.230 -26.078 376 HG12 ILE 51 2HG1 ILE 51 -19.009 35.851 -27.690 377 HG13 ILE 51 3HG1 ILE 51 -17.931 36.376 -26.402 378 HG21 ILE 51 1HG2 ILE 51 -18.796 36.818 -24.105 379 HG22 ILE 51 2HG2 ILE 51 -20.491 36.546 -23.688 380 HG23 ILE 51 3HG2 ILE 51 -19.412 35.173 -23.971 381 HD11 ILE 51 3HD1 ILE 51 -17.469 34.077 -27.051 382 HD12 ILE 51 1HD1 ILE 51 -18.089 34.083 -25.401 383 HD13 ILE 51 2HD1 ILE 51 -19.149 33.604 -26.747 384 HA PRO 52 HA PRO 52 -24.960 36.786 -24.549 385 HB2 PRO 52 2HB PRO 52 -25.679 35.269 -22.404 386 HB3 PRO 52 3HB PRO 52 -25.991 34.762 -24.094 387 HG2 PRO 52 2HG PRO 52 -23.767 33.902 -22.239 388 HG3 PRO 52 3HG PRO 52 -24.756 32.894 -23.353 389 HD2 PRO 52 2HD PRO 52 -22.210 33.875 -23.921 390 HD3 PRO 52 3HD PRO 52 -23.386 33.471 -25.172 391 H GLY 53 H GLY 53 -25.257 38.316 -22.960 392 HA2 GLY 53 HA2 GLY 53 -23.187 39.656 -21.762 393 HA3 GLY 53 HA3 GLY 53 -24.859 39.754 -21.208 394 H THR 54 H THR 54 -24.922 36.931 -20.238 395 HA THR 54 HA THR 54 -22.733 36.800 -18.298 396 HB THR 54 HB THR 54 -24.325 36.217 -16.440 397 HG1 THR 54 HG1 THR 54 -26.556 36.562 -16.776 398 HG21 THR 54 1HG2 THR 54 -25.269 38.855 -17.626 399 HG22 THR 54 2HG2 THR 54 -25.317 38.342 -15.923 400 HG23 THR 54 3HG2 THR 54 -23.771 38.642 -16.714 401 H TRP 55 H TRP 55 -22.544 34.670 -17.223 402 HA TRP 55 HA TRP 55 -23.882 32.349 -18.392 403 HB2 TRP 55 2HB TRP 55 -22.130 33.034 -20.086 404 HB3 TRP 55 3HB TRP 55 -20.909 32.726 -18.859 405 HD1 TRP 55 HD1 TRP 55 -20.344 30.223 -18.315 406 HE1 TRP 55 HE1 TRP 55 -20.663 28.050 -19.603 407 HE3 TRP 55 HE3 TRP 55 -23.974 31.771 -21.517 408 HZ2 TRP 55 HZ2 TRP 55 -22.438 27.034 -21.677 409 HZ3 TRP 55 HZ3 TRP 55 -25.009 30.175 -23.141 410 HH2 TRP 55 HH2 TRP 55 -24.238 27.813 -23.229 411 H LEU 56 H LEU 56 -23.460 30.399 -17.199 412 HA LEU 56 HA LEU 56 -22.768 30.818 -14.433 413 HB2 LEU 56 2HB LEU 56 -24.308 29.001 -15.873 414 HB3 LEU 56 3HB LEU 56 -22.919 28.032 -15.380 415 HG LEU 56 HG LEU 56 -24.590 29.697 -13.456 416 HD11 LEU 56 1HD1 LEU 56 -25.659 27.571 -12.808 417 HD12 LEU 56 2HD1 LEU 56 -25.979 27.952 -14.507 418 HD13 LEU 56 3HD1 LEU 56 -24.765 26.721 -14.092 419 HD21 LEU 56 3HD2 LEU 56 -23.592 28.201 -11.749 420 HD22 LEU 56 1HD2 LEU 56 -22.604 27.422 -13.007 421 HD23 LEU 56 2HD2 LEU 56 -22.348 29.125 -12.598 422 H CYS 57 H CYS 57 -20.887 30.614 -13.419 423 HA CYS 57 HA CYS 57 -18.466 29.857 -14.940 424 HB2 CYS 57 2HB CYS 57 -18.950 31.279 -12.300 425 HB3 CYS 57 3HB CYS 57 -17.344 30.778 -12.835 426 HG CYS 57 HG CYS 57 -17.519 33.291 -13.359 427 H ARG 58 H ARG 58 -16.751 28.675 -13.812 428 HA ARG 58 HA ARG 58 -17.691 26.076 -13.115 429 HB2 ARG 58 2HB ARG 58 -14.842 27.055 -12.718 430 HB3 ARG 58 3HB ARG 58 -15.387 25.416 -13.054 431 HG2 ARG 58 2HG ARG 58 -16.135 26.179 -15.342 432 HG3 ARG 58 3HG ARG 58 -15.466 27.782 -14.981 433 HD2 ARG 58 2HD ARG 58 -13.234 26.636 -14.541 434 HD3 ARG 58 3HD ARG 58 -13.956 25.170 -15.237 435 HE ARG 58 HE ARG 58 -14.297 27.470 -16.981 436 HH11 ARG 58 2HH2 ARG 58 -11.883 25.083 -16.102 437 HH12 ARG 58 1HH2 ARG 58 -10.996 25.316 -17.584 438 HH21 ARG 58 2HH1 ARG 58 -13.093 27.787 -18.765 439 HH22 ARG 58 1HH1 ARG 58 -11.681 26.797 -19.073 440 H ASN 59 H ASN 59 -17.032 28.752 -11.069 441 HA ASN 59 HA ASN 59 -16.736 27.387 -8.565 442 HB2 ASN 59 2HB ASN 59 -16.112 29.681 -8.896 443 HB3 ASN 59 3HB ASN 59 -17.762 30.138 -9.345 444 HD21 ASN 59 1HD2 ASN 59 -17.808 31.788 -7.754 445 HD22 ASN 59 2HD2 ASN 59 -17.796 31.399 -6.048 446 H GLY 60 H GLY 60 -19.473 27.772 -10.648 447 HA2 GLY 60 HA2 GLY 60 -21.575 26.746 -10.432 448 HA3 GLY 60 HA3 GLY 60 -21.357 26.582 -8.689 449 H MET 61 H MET 61 -20.584 29.724 -9.968 450 HA MET 61 HA MET 61 -23.241 30.800 -9.166 451 HB2 MET 61 2HB MET 61 -21.233 31.342 -7.676 452 HB3 MET 61 3HB MET 61 -20.574 32.255 -9.010 453 HG2 MET 61 2HG MET 61 -21.767 33.689 -7.398 454 HG3 MET 61 3HG MET 61 -22.467 33.781 -9.012 455 HE1 MET 61 3HE MET 61 -24.007 34.938 -6.433 456 HE2 MET 61 1HE MET 61 -24.573 34.993 -8.122 457 HE3 MET 61 2HE MET 61 -25.640 34.378 -6.841 458 H GLU 62 H GLU 62 -24.136 32.461 -10.414 459 HA GLU 62 HA GLU 62 -23.574 32.442 -13.254 460 HB2 GLU 62 2HB GLU 62 -25.356 34.212 -11.547 461 HB3 GLU 62 3HB GLU 62 -25.250 34.293 -13.312 462 HG2 GLU 62 2HG GLU 62 -25.942 31.915 -13.472 463 HG3 GLU 62 3HG GLU 62 -26.090 31.831 -11.716 464 H GLY 63 H GLY 63 -21.812 33.302 -14.101 465 HA2 GLY 63 HA2 GLY 63 -20.458 35.608 -12.910 466 HA3 GLY 63 HA3 GLY 63 -19.860 34.618 -14.217 467 H THR 64 H THR 64 -20.072 37.572 -14.027 468 HA THR 64 HA THR 64 -21.773 38.064 -16.436 469 HB THR 64 HB THR 64 -20.657 40.084 -14.455 470 HG1 THR 64 HG1 THR 64 -22.330 38.862 -13.584 471 HG21 THR 64 1HG2 THR 64 -22.350 41.627 -15.560 472 HG22 THR 64 2HG2 THR 64 -20.950 41.224 -16.560 473 HG23 THR 64 3HG2 THR 64 -22.505 40.427 -16.863 474 H LEU 65 H LEU 65 -20.980 38.926 -18.271 475 HA LEU 65 HA LEU 65 -18.440 38.082 -19.041 476 HB2 LEU 65 2HB LEU 65 -20.525 38.311 -20.355 477 HB3 LEU 65 3HB LEU 65 -20.344 40.049 -20.348 478 HG LEU 65 HG LEU 65 -18.736 37.929 -21.820 479 HD11 LEU 65 1HD1 LEU 65 -20.324 40.368 -22.747 480 HD12 LEU 65 2HD1 LEU 65 -19.574 39.145 -23.793 481 HD13 LEU 65 3HD1 LEU 65 -20.921 38.696 -22.737 482 HD21 LEU 65 3HD2 LEU 65 -17.493 39.817 -22.939 483 HD22 LEU 65 1HD2 LEU 65 -18.048 40.887 -21.632 484 HD23 LEU 65 2HD2 LEU 65 -17.001 39.478 -21.292 485 H ILE 66 H ILE 66 -16.487 38.879 -18.738 486 HA ILE 66 HA ILE 66 -15.942 41.761 -19.099 487 HB ILE 66 HB ILE 66 -14.139 41.758 -17.545 488 HG12 ILE 66 2HG1 ILE 66 -13.398 39.417 -17.589 489 HG13 ILE 66 3HG1 ILE 66 -13.589 40.042 -15.969 490 HG21 ILE 66 1HG2 ILE 66 -16.290 42.486 -16.697 491 HG22 ILE 66 2HG2 ILE 66 -16.696 40.845 -16.168 492 HG23 ILE 66 3HG2 ILE 66 -15.352 41.709 -15.406 493 HD11 ILE 66 3HD1 ILE 66 -15.729 38.884 -15.708 494 HD12 ILE 66 1HD1 ILE 66 -15.485 38.171 -17.293 495 HD13 ILE 66 2HD1 ILE 66 -14.355 37.798 -15.986 496 H GLU 67 H GLU 67 -13.794 42.152 -20.082 497 HA GLU 67 HA GLU 67 -13.397 40.321 -22.255 498 HB2 GLU 67 2HB GLU 67 -12.017 42.838 -21.356 499 HB3 GLU 67 3HB GLU 67 -11.319 41.856 -22.661 500 HG2 GLU 67 2HG GLU 67 -13.172 42.098 -24.066 501 HG3 GLU 67 3HG GLU 67 -14.243 42.477 -22.739 502 H GLY 68 H GLY 68 -10.800 38.196 -21.408 503 HA2 GLY 68 HA2 GLY 68 -12.241 37.026 -22.728 504 HA3 GLY 68 HA3 GLY 68 -13.505 38.212 -22.446 505 H ASP 69 H ASP 69 -10.304 39.006 -23.787 506 HA ASP 69 HA ASP 69 -11.223 38.993 -26.557 507 HB2 ASP 69 2HB ASP 69 -11.895 41.237 -25.849 508 HB3 ASP 69 3HB ASP 69 -10.291 41.541 -25.173 509 H LEU 70 H LEU 70 -9.635 38.455 -27.857 510 HA LEU 70 HA LEU 70 -6.772 38.460 -26.965 511 HB2 LEU 70 2HB LEU 70 -8.335 36.243 -28.320 512 HB3 LEU 70 3HB LEU 70 -6.578 36.279 -28.195 513 HG LEU 70 HG LEU 70 -8.414 36.276 -25.762 514 HD11 LEU 70 1HD1 LEU 70 -8.708 34.213 -27.079 515 HD12 LEU 70 2HD1 LEU 70 -6.948 33.961 -27.092 516 HD13 LEU 70 3HD1 LEU 70 -7.853 33.894 -25.562 517 HD21 LEU 70 3HD2 LEU 70 -6.337 35.528 -24.605 518 HD22 LEU 70 1HD2 LEU 70 -5.428 35.741 -26.119 519 HD23 LEU 70 2HD2 LEU 70 -6.152 37.142 -25.296 520 HA PRO 71 HA PRO 71 -6.648 40.530 -31.026 521 HB2 PRO 71 2HB PRO 71 -3.892 41.195 -30.012 522 HB3 PRO 71 3HB PRO 71 -5.087 42.253 -30.822 523 HG2 PRO 71 2HG PRO 71 -4.705 42.425 -28.145 524 HG3 PRO 71 3HG PRO 71 -6.372 42.457 -28.812 525 HD2 PRO 71 2HD PRO 71 -4.873 40.091 -27.636 526 HD3 PRO 71 3HD PRO 71 -6.532 40.664 -27.286 527 H GLU 72 H GLU 72 -4.088 38.526 -29.563 528 HA GLU 72 HA GLU 72 -3.548 37.174 -32.164 529 HB2 GLU 72 2HB GLU 72 -1.463 38.193 -30.185 530 HB3 GLU 72 3HB GLU 72 -1.161 37.194 -31.616 531 HG2 GLU 72 2HG GLU 72 -2.199 39.052 -32.997 532 HG3 GLU 72 3HG GLU 72 -2.189 40.052 -31.548 533 HA PRO 73 HA PRO 73 -4.028 33.599 -29.230 534 HB2 PRO 73 2HB PRO 73 -5.523 32.729 -31.678 535 HB3 PRO 73 3HB PRO 73 -5.877 32.397 -29.956 536 HG2 PRO 73 2HG PRO 73 -7.291 34.190 -31.415 537 HG3 PRO 73 3HG PRO 73 -6.937 34.478 -29.685 538 HD2 PRO 73 2HD PRO 73 -5.587 35.676 -32.118 539 HD3 PRO 73 3HD PRO 73 -6.015 36.441 -30.563 540 H LYS 74 H LYS 74 -2.406 32.213 -29.512 541 HA LYS 74 HA LYS 74 -1.059 31.787 -32.130 542 HB2 LYS 74 2HB LYS 74 -0.412 34.039 -31.136 543 HB3 LYS 74 3HB LYS 74 0.419 33.168 -29.853 544 HG2 LYS 74 2HG LYS 74 1.911 32.107 -31.483 545 HG3 LYS 74 3HG LYS 74 0.991 32.781 -32.837 546 HD2 LYS 74 2HD LYS 74 2.434 34.479 -30.746 547 HD3 LYS 74 3HD LYS 74 3.132 34.010 -32.307 548 HE2 LYS 74 2HE LYS 74 1.287 35.146 -33.511 549 HE3 LYS 74 3HE LYS 74 0.549 35.598 -31.973 550 HZ1 LYS 74 HZ1 LYS 74 3.142 36.582 -33.006 551 HZ2 LYS 74 HZ2 LYS 74 1.765 37.449 -32.751 552 HZ3 LYS 74 HZ3 LYS 74 2.609 36.869 -31.484 553 H LYS 75 H LYS 75 -0.239 29.852 -32.265 554 HA LYS 75 HA LYS 75 1.131 28.513 -30.027 555 HB2 LYS 75 2HB LYS 75 -1.177 27.197 -31.544 556 HB3 LYS 75 3HB LYS 75 0.006 26.333 -30.558 557 HG2 LYS 75 2HG LYS 75 -0.678 27.820 -28.597 558 HG3 LYS 75 3HG LYS 75 -1.999 28.417 -29.607 559 HD2 LYS 75 2HD LYS 75 -2.819 26.736 -28.105 560 HD3 LYS 75 3HD LYS 75 -2.923 26.117 -29.760 561 HE2 LYS 75 2HE LYS 75 -1.059 24.658 -29.450 562 HE3 LYS 75 3HE LYS 75 -0.519 25.507 -27.994 563 HZ1 LYS 75 HZ1 LYS 75 -2.348 24.615 -26.779 564 HZ2 LYS 75 HZ2 LYS 75 -3.093 24.038 -28.114 565 HZ3 LYS 75 HZ3 LYS 75 -1.720 23.341 -27.601 566 H VAL 76 H VAL 76 2.562 26.891 -30.696 567 HA VAL 76 HA VAL 76 4.050 27.485 -33.040 568 HB VAL 76 HB VAL 76 5.395 25.491 -32.508 569 HG11 VAL 76 1HG1 VAL 76 5.813 27.649 -31.382 570 HG12 VAL 76 2HG1 VAL 76 4.739 27.165 -30.050 571 HG13 VAL 76 3HG1 VAL 76 6.234 26.263 -30.364 572 HG21 VAL 76 3HG2 VAL 76 3.429 24.991 -30.227 573 HG22 VAL 76 1HG2 VAL 76 3.622 23.967 -31.667 574 HG23 VAL 76 2HG2 VAL 76 4.957 24.142 -30.522 575 H LYS 77 H LYS 77 4.677 26.134 -34.798 576 HA LYS 77 HA LYS 77 2.721 24.125 -35.777 577 HB2 LYS 77 2HB LYS 77 3.636 26.618 -37.278 578 HB3 LYS 77 3HB LYS 77 2.833 25.270 -38.069 579 HG2 LYS 77 2HG LYS 77 1.554 26.786 -35.750 580 HG3 LYS 77 3HG LYS 77 1.405 27.304 -37.413 581 HD2 LYS 77 2HD LYS 77 0.105 25.520 -38.077 582 HD3 LYS 77 3HD LYS 77 0.675 24.435 -36.806 583 HE2 LYS 77 2HE LYS 77 -0.915 26.931 -36.128 584 HE3 LYS 77 3HE LYS 77 -1.730 25.445 -36.630 585 HZ1 LYS 77 HZ1 LYS 77 -1.466 25.597 -34.188 586 HZ2 LYS 77 HZ2 LYS 77 -0.828 24.278 -34.796 587 HZ3 LYS 77 HZ3 LYS 77 0.186 25.496 -34.354 588 HA PRO 78 HA PRO 78 6.397 22.007 -36.912 589 HB2 PRO 78 2HB PRO 78 5.621 20.360 -38.964 590 HB3 PRO 78 3HB PRO 78 5.077 20.152 -37.270 591 HG2 PRO 78 2HG PRO 78 3.627 21.579 -39.527 592 HG3 PRO 78 3HG PRO 78 2.979 20.326 -38.418 593 HD2 PRO 78 2HD PRO 78 2.572 22.966 -37.951 594 HD3 PRO 78 3HD PRO 78 2.905 21.841 -36.600 595 HA PRO 79 HA PRO 79 8.374 24.211 -40.254 596 HB2 PRO 79 2HB PRO 79 10.567 22.675 -40.787 597 HB3 PRO 79 3HB PRO 79 10.369 23.588 -39.260 598 HG2 PRO 79 2HG PRO 79 9.745 20.658 -39.767 599 HG3 PRO 79 3HG PRO 79 10.705 21.367 -38.429 600 HD2 PRO 79 2HD PRO 79 8.074 20.734 -38.132 601 HD3 PRO 79 3HD PRO 79 8.771 22.185 -37.350 602 H ARG 80 H ARG 80 8.654 24.246 -42.486 603 HA ARG 80 HA ARG 80 7.854 21.928 -44.169 604 HB2 ARG 80 2HB ARG 80 6.517 24.669 -44.202 605 HB3 ARG 80 3HB ARG 80 6.365 23.465 -45.487 606 HG2 ARG 80 2HG ARG 80 5.355 21.856 -43.898 607 HG3 ARG 80 3HG ARG 80 5.477 23.057 -42.597 608 HD2 ARG 80 2HD ARG 80 4.004 24.596 -43.856 609 HD3 ARG 80 3HD ARG 80 3.916 23.434 -45.180 610 HE ARG 80 HE ARG 80 2.395 22.159 -44.013 611 HH11 ARG 80 1HH1 ARG 80 3.746 24.412 -41.685 612 HH12 ARG 80 2HH1 ARG 80 2.481 24.104 -40.533 613 HH21 ARG 80 2HH2 ARG 80 0.867 21.777 -42.475 614 HH22 ARG 80 1HH2 ARG 80 0.909 22.627 -40.960 Start of MODEL 6 1 H1 SER 1 1H SER 1 -6.068 14.035 -42.158 2 H2 SER 1 2H SER 1 -7.687 14.105 -42.397 3 H3 SER 1 3H SER 1 -7.096 14.088 -40.875 4 HA SER 1 HA SER 1 -6.766 16.244 -42.848 5 HB2 SER 1 2HB SER 1 -8.067 17.589 -41.160 6 HB3 SER 1 3HB SER 1 -8.987 16.314 -41.975 7 HG SER 1 HG SER 1 -9.353 16.297 -39.719 8 H MET 2 H MET 2 -6.449 15.941 -39.263 9 HA MET 2 HA MET 2 -4.065 17.612 -39.237 10 HB2 MET 2 2HB MET 2 -5.721 17.703 -37.452 11 HB3 MET 2 3HB MET 2 -5.455 15.997 -37.067 12 HG2 MET 2 2HG MET 2 -3.151 16.477 -36.396 13 HG3 MET 2 3HG MET 2 -3.334 18.172 -36.867 14 HE1 MET 2 3HE MET 2 -2.191 17.043 -34.103 15 HE2 MET 2 1HE MET 2 -2.283 18.777 -34.479 16 HE3 MET 2 2HE MET 2 -2.931 18.166 -32.941 17 H ALA 3 H ALA 3 -1.960 17.042 -39.214 18 HA ALA 3 HA ALA 3 -1.135 14.214 -39.323 19 HB1 ALA 3 3HB ALA 3 0.476 16.796 -39.440 20 HB2 ALA 3 1HB ALA 3 1.100 15.157 -39.718 21 HB3 ALA 3 2HB ALA 3 -0.093 15.848 -40.835 22 H ASP 4 H ASP 4 0.030 13.154 -37.737 23 HA ASP 4 HA ASP 4 0.337 12.446 -35.618 24 HB2 ASP 4 2HB ASP 4 2.345 13.844 -36.038 25 HB3 ASP 4 3HB ASP 4 1.567 15.187 -35.199 26 H ARG 5 H ARG 5 -2.220 13.063 -35.943 27 HA ARG 5 HA ARG 5 -3.436 14.921 -34.223 28 HB2 ARG 5 2HB ARG 5 -4.412 13.612 -36.199 29 HB3 ARG 5 3HB ARG 5 -4.693 12.282 -35.071 30 HG2 ARG 5 2HG ARG 5 -6.145 13.780 -33.703 31 HG3 ARG 5 3HG ARG 5 -5.800 15.124 -34.806 32 HD2 ARG 5 2HD ARG 5 -6.809 13.815 -36.675 33 HD3 ARG 5 3HD ARG 5 -7.190 12.513 -35.527 34 HE ARG 5 HE ARG 5 -8.274 14.988 -34.568 35 HH11 ARG 5 2HH2 ARG 5 -8.928 12.640 -37.085 36 HH12 ARG 5 1HH2 ARG 5 -10.624 13.031 -37.135 37 HH21 ARG 5 1HH1 ARG 5 -10.450 15.434 -34.681 38 HH22 ARG 5 2HH1 ARG 5 -11.455 14.570 -35.805 39 H VAL 6 H VAL 6 -4.171 14.979 -32.210 40 HA VAL 6 HA VAL 6 -4.081 12.572 -30.461 41 HB VAL 6 HB VAL 6 -3.634 14.098 -28.568 42 HG11 VAL 6 1HG1 VAL 6 -1.850 12.725 -29.590 43 HG12 VAL 6 2HG1 VAL 6 -1.439 14.071 -30.676 44 HG13 VAL 6 3HG1 VAL 6 -1.224 14.240 -28.922 45 HG21 VAL 6 3HG2 VAL 6 -2.863 16.174 -30.663 46 HG22 VAL 6 1HG2 VAL 6 -4.247 16.286 -29.549 47 HG23 VAL 6 2HG2 VAL 6 -2.599 16.284 -28.915 48 H LEU 7 H LEU 7 -5.783 12.279 -29.083 49 HA LEU 7 HA LEU 7 -8.177 14.037 -29.465 50 HB2 LEU 7 2HB LEU 7 -8.069 11.010 -29.217 51 HB3 LEU 7 3HB LEU 7 -9.537 11.977 -29.297 52 HG LEU 7 HG LEU 7 -7.468 11.730 -31.531 53 HD11 LEU 7 1HD1 LEU 7 -10.277 10.582 -31.268 54 HD12 LEU 7 2HD1 LEU 7 -9.203 10.428 -32.676 55 HD13 LEU 7 3HD1 LEU 7 -8.759 9.664 -31.142 56 HD21 LEU 7 3HD2 LEU 7 -9.213 12.818 -32.933 57 HD22 LEU 7 1HD2 LEU 7 -10.187 13.118 -31.477 58 HD23 LEU 7 2HD2 LEU 7 -8.602 13.903 -31.681 59 H ARG 8 H ARG 8 -9.448 14.451 -27.754 60 HA ARG 8 HA ARG 8 -9.780 15.193 -25.628 61 HB2 ARG 8 2HB ARG 8 -10.626 12.744 -25.787 62 HB3 ARG 8 3HB ARG 8 -9.275 12.347 -24.723 63 HG2 ARG 8 2HG ARG 8 -10.187 14.041 -23.068 64 HG3 ARG 8 3HG ARG 8 -11.541 14.325 -24.175 65 HD2 ARG 8 2HD ARG 8 -12.178 11.935 -24.000 66 HD3 ARG 8 3HD ARG 8 -10.849 11.650 -22.877 67 HE ARG 8 HE ARG 8 -13.417 12.953 -22.335 68 HH11 ARG 8 2HH1 ARG 8 -10.160 12.611 -21.077 69 HH12 ARG 8 1HH1 ARG 8 -10.645 13.055 -19.464 70 HH21 ARG 8 1HH2 ARG 8 -13.957 13.514 -20.262 71 HH22 ARG 8 2HH2 ARG 8 -12.738 13.555 -19.023 72 H GLY 9 H GLY 9 -7.251 15.788 -26.408 73 HA2 GLY 9 HA2 GLY 9 -5.341 15.330 -24.193 74 HA3 GLY 9 HA3 GLY 9 -5.052 16.206 -25.691 75 H SER 10 H SER 10 -3.988 17.744 -24.246 76 HA SER 10 HA SER 10 -5.499 19.386 -22.409 77 HB2 SER 10 2HB SER 10 -3.375 20.661 -22.229 78 HB3 SER 10 3HB SER 10 -3.220 18.926 -21.940 79 HG SER 10 HG SER 10 -2.466 20.382 -24.264 80 H ARG 11 H ARG 11 -6.866 19.446 -24.723 81 HA ARG 11 HA ARG 11 -7.027 22.331 -25.306 82 HB2 ARG 11 2HB ARG 11 -7.097 22.076 -27.722 83 HB3 ARG 11 3HB ARG 11 -5.548 21.564 -27.071 84 HG2 ARG 11 2HG ARG 11 -6.192 19.183 -27.313 85 HG3 ARG 11 3HG ARG 11 -7.790 19.668 -27.925 86 HD2 ARG 11 2HD ARG 11 -6.714 20.852 -29.804 87 HD3 ARG 11 3HD ARG 11 -5.114 20.377 -29.202 88 HE ARG 11 HE ARG 11 -6.540 17.982 -29.531 89 HH11 ARG 11 1HH2 ARG 11 -5.511 20.562 -31.668 90 HH12 ARG 11 2HH2 ARG 11 -5.415 19.505 -33.050 91 HH21 ARG 11 1HH1 ARG 11 -6.329 16.663 -31.347 92 HH22 ARG 11 2HH1 ARG 11 -5.888 17.398 -32.869 93 H LEU 12 H LEU 12 -8.597 20.023 -23.992 94 HA LEU 12 HA LEU 12 -10.970 19.614 -25.598 95 HB2 LEU 12 2HB LEU 12 -9.980 17.970 -23.998 96 HB3 LEU 12 3HB LEU 12 -10.359 19.057 -22.665 97 HG LEU 12 HG LEU 12 -12.803 18.800 -23.178 98 HD11 LEU 12 1HD1 LEU 12 -12.709 18.167 -25.554 99 HD12 LEU 12 2HD1 LEU 12 -11.806 16.689 -25.147 100 HD13 LEU 12 3HD1 LEU 12 -13.491 16.891 -24.618 101 HD21 LEU 12 3HD2 LEU 12 -11.227 16.250 -22.661 102 HD22 LEU 12 1HD2 LEU 12 -11.735 17.446 -21.454 103 HD23 LEU 12 2HD2 LEU 12 -12.955 16.488 -22.305 104 H GLY 13 H GLY 13 -10.161 21.759 -22.877 105 HA2 GLY 13 HA2 GLY 13 -12.124 23.742 -23.404 106 HA3 GLY 13 HA3 GLY 13 -12.779 22.635 -22.196 107 H ALA 14 H ALA 14 -12.659 24.892 -21.074 108 HA ALA 14 HA ALA 14 -10.064 25.682 -20.058 109 HB1 ALA 14 3HB ALA 14 -11.810 27.311 -20.615 110 HB2 ALA 14 1HB ALA 14 -12.851 26.649 -19.331 111 HB3 ALA 14 2HB ALA 14 -11.312 27.441 -18.922 112 H VAL 15 H VAL 15 -10.528 22.985 -19.374 113 HA VAL 15 HA VAL 15 -11.786 22.739 -16.772 114 HB VAL 15 HB VAL 15 -11.231 20.362 -16.923 115 HG11 VAL 15 1HG1 VAL 15 -12.355 21.456 -19.538 116 HG12 VAL 15 2HG1 VAL 15 -12.626 19.845 -18.847 117 HG13 VAL 15 3HG1 VAL 15 -13.259 21.276 -18.018 118 HG21 VAL 15 3HG2 VAL 15 -10.213 19.415 -18.951 119 HG22 VAL 15 1HG2 VAL 15 -9.845 21.037 -19.560 120 HG23 VAL 15 2HG2 VAL 15 -9.055 20.426 -18.086 121 H SER 16 H SER 16 -8.437 22.917 -17.759 122 HA SER 16 HA SER 16 -7.605 23.344 -14.956 123 HB2 SER 16 2HB SER 16 -7.625 20.887 -15.332 124 HB3 SER 16 3HB SER 16 -6.486 21.088 -16.654 125 HG SER 16 HG SER 16 -5.490 20.501 -14.641 126 H TYR 17 H TYR 17 -7.519 24.429 -17.994 127 HA TYR 17 HA TYR 17 -5.004 25.899 -17.896 128 HB2 TYR 17 2HB TYR 17 -4.269 24.924 -20.124 129 HB3 TYR 17 3HB TYR 17 -4.098 23.860 -18.746 130 HD1 TYR 17 HD1 TYR 17 -5.942 24.428 -21.897 131 HD2 TYR 17 HD2 TYR 17 -5.443 21.847 -18.489 132 HE1 TYR 17 HE1 TYR 17 -7.410 22.716 -22.968 133 HE2 TYR 17 HE2 TYR 17 -6.919 20.150 -19.543 134 HH TYR 17 HH TYR 17 -8.175 19.607 -21.383 135 H GLU 18 H GLU 18 -4.836 27.217 -20.006 136 HA GLU 18 HA GLU 18 -7.287 28.698 -20.258 137 HB2 GLU 18 2HB GLU 18 -5.938 30.307 -21.481 138 HB3 GLU 18 3HB GLU 18 -5.124 29.759 -20.021 139 HG2 GLU 18 2HG GLU 18 -3.717 28.206 -21.395 140 HG3 GLU 18 3HG GLU 18 -4.507 28.795 -22.855 141 H THR 19 H THR 19 -7.549 26.055 -21.489 142 HA THR 19 HA THR 19 -8.118 24.920 -23.347 143 HB THR 19 HB THR 19 -9.262 27.415 -24.595 144 HG1 THR 19 HG1 THR 19 -9.771 27.408 -22.390 145 HG21 THR 19 1HG2 THR 19 -11.178 25.823 -25.021 146 HG22 THR 19 2HG2 THR 19 -9.703 25.358 -25.862 147 HG23 THR 19 3HG2 THR 19 -10.165 24.504 -24.389 148 H ASP 20 H ASP 20 -5.465 26.293 -23.379 149 HA ASP 20 HA ASP 20 -3.635 26.597 -24.649 150 HB2 ASP 20 2HB ASP 20 -3.908 24.206 -24.853 151 HB3 ASP 20 3HB ASP 20 -4.918 24.393 -26.288 152 H ARG 21 H ARG 21 -3.958 28.756 -25.219 153 HA ARG 21 HA ARG 21 -5.148 29.361 -27.876 154 HB2 ARG 21 2HB ARG 21 -4.201 31.319 -25.760 155 HB3 ARG 21 3HB ARG 21 -5.122 31.667 -27.216 156 HG2 ARG 21 2HG ARG 21 -6.828 29.872 -26.070 157 HG3 ARG 21 3HG ARG 21 -6.003 30.460 -24.622 158 HD2 ARG 21 2HD ARG 21 -7.911 31.835 -24.891 159 HD3 ARG 21 3HD ARG 21 -6.542 32.833 -25.422 160 HE ARG 21 HE ARG 21 -7.525 31.496 -27.725 161 HH11 ARG 21 1HH1 ARG 21 -8.831 33.977 -25.565 162 HH12 ARG 21 2HH1 ARG 21 -10.141 34.255 -26.731 163 HH21 ARG 21 1HH2 ARG 21 -9.143 32.048 -29.012 164 HH22 ARG 21 2HH2 ARG 21 -10.243 33.384 -28.554 165 H ASN 22 H ASN 22 -4.224 30.629 -29.395 166 HA ASN 22 HA ASN 22 -1.401 31.422 -29.152 167 HB2 ASN 22 2HB ASN 22 -0.692 30.511 -31.261 168 HB3 ASN 22 3HB ASN 22 -1.256 29.221 -30.217 169 HD21 ASN 22 1HD2 ASN 22 -1.039 28.294 -32.563 170 HD22 ASN 22 2HD2 ASN 22 -2.548 28.287 -33.464 171 H HIS 23 H HIS 23 -4.564 31.968 -30.592 172 HA HIS 23 HA HIS 23 -3.914 34.734 -31.147 173 HB2 HIS 23 2HB HIS 23 -2.845 33.772 -33.130 174 HB3 HIS 23 3HB HIS 23 -4.309 32.909 -33.557 175 HD2 HIS 23 HD2 HIS 23 -3.205 36.617 -32.963 176 HE1 HIS 23 HE1 HIS 23 -6.157 36.634 -36.040 177 HE2 HIS 23 HE2 HIS 23 -4.564 38.090 -34.677 178 H ASP 24 H ASP 24 -7.762 33.441 -31.801 179 HA ASP 24 HA ASP 24 -5.532 31.510 -32.269 180 HB2 ASP 24 2HB ASP 24 -8.463 30.971 -31.780 181 HB3 ASP 24 3HB ASP 24 -7.194 29.768 -32.008 182 H LEU 25 H LEU 25 -5.430 30.277 -34.063 183 HA LEU 25 HA LEU 25 -7.129 31.020 -36.414 184 HB2 LEU 25 2HB LEU 25 -4.636 29.307 -36.236 185 HB3 LEU 25 3HB LEU 25 -5.535 29.697 -37.704 186 HG LEU 25 HG LEU 25 -4.045 31.709 -35.950 187 HD11 LEU 25 1HD1 LEU 25 -3.400 30.605 -38.714 188 HD12 LEU 25 2HD1 LEU 25 -2.481 31.849 -37.835 189 HD13 LEU 25 3HD1 LEU 25 -2.556 30.197 -37.203 190 HD21 LEU 25 3HD2 LEU 25 -4.427 33.287 -37.832 191 HD22 LEU 25 1HD2 LEU 25 -5.477 32.086 -38.621 192 HD23 LEU 25 2HD2 LEU 25 -5.936 32.809 -37.059 193 H ALA 26 H ALA 26 -8.833 30.164 -35.094 194 HA ALA 26 HA ALA 26 -9.648 27.488 -35.894 195 HB1 ALA 26 3HB ALA 26 -10.069 26.698 -33.557 196 HB2 ALA 26 1HB ALA 26 -8.341 26.944 -33.857 197 HB3 ALA 26 2HB ALA 26 -9.259 28.148 -32.927 198 HA PRO 27 HA PRO 27 -13.462 29.837 -35.475 199 HB2 PRO 27 2HB PRO 27 -15.361 27.985 -36.029 200 HB3 PRO 27 3HB PRO 27 -14.126 28.451 -37.229 201 HG2 PRO 27 2HG PRO 27 -14.081 26.047 -35.367 202 HG3 PRO 27 3HG PRO 27 -13.828 26.075 -37.142 203 HD2 PRO 27 2HD PRO 27 -11.751 26.120 -35.341 204 HD3 PRO 27 3HD PRO 27 -11.671 26.960 -36.919 205 H ARG 28 H ARG 28 -12.639 29.979 -33.132 206 HA ARG 28 HA ARG 28 -14.920 29.310 -31.372 207 HB2 ARG 28 2HB ARG 28 -13.642 28.392 -29.634 208 HB3 ARG 28 3HB ARG 28 -13.143 27.555 -31.108 209 HG2 ARG 28 2HG ARG 28 -11.151 29.163 -31.229 210 HG3 ARG 28 3HG ARG 28 -11.637 29.736 -29.619 211 HD2 ARG 28 2HD ARG 28 -11.454 27.357 -28.798 212 HD3 ARG 28 3HD ARG 28 -10.790 26.914 -30.385 213 HE ARG 28 HE ARG 28 -9.293 29.132 -29.393 214 HH11 ARG 28 2HH1 ARG 28 -9.616 25.723 -28.521 215 HH12 ARG 28 1HH1 ARG 28 -8.116 25.811 -27.607 216 HH21 ARG 28 1HH2 ARG 28 -7.440 29.031 -28.475 217 HH22 ARG 28 2HH2 ARG 28 -6.783 27.519 -27.822 218 H GLN 29 H GLN 29 -14.784 30.380 -29.270 219 HA GLN 29 HA GLN 29 -13.261 32.899 -29.054 220 HB2 GLN 29 2HB GLN 29 -16.223 32.725 -28.351 221 HB3 GLN 29 3HB GLN 29 -15.185 34.138 -28.227 222 HG2 GLN 29 2HG GLN 29 -15.932 34.785 -30.237 223 HG3 GLN 29 3HG GLN 29 -15.114 33.394 -30.960 224 HE21 GLN 29 1HE2 GLN 29 -16.580 31.230 -30.135 225 HE22 GLN 29 2HE2 GLN 29 -18.201 31.359 -30.789 226 H ILE 30 H ILE 30 -12.238 32.723 -27.098 227 HA ILE 30 HA ILE 30 -13.502 31.095 -24.914 228 HB ILE 30 HB ILE 30 -10.683 32.168 -24.813 229 HG12 ILE 30 2HG1 ILE 30 -10.602 30.771 -26.765 230 HG13 ILE 30 3HG1 ILE 30 -9.816 29.969 -25.419 231 HG21 ILE 30 1HG2 ILE 30 -11.739 31.563 -22.702 232 HG22 ILE 30 2HG2 ILE 30 -12.182 29.970 -23.330 233 HG23 ILE 30 3HG2 ILE 30 -10.471 30.393 -23.099 234 HD11 ILE 30 3HD1 ILE 30 -11.103 28.383 -26.735 235 HD12 ILE 30 1HD1 ILE 30 -11.810 28.525 -25.126 236 HD13 ILE 30 2HD1 ILE 30 -12.586 29.330 -26.521 237 H ALA 31 H ALA 31 -14.952 32.463 -23.904 238 HA ALA 31 HA ALA 31 -14.208 35.317 -23.476 239 HB1 ALA 31 3HB ALA 31 -16.850 33.823 -23.245 240 HB2 ALA 31 1HB ALA 31 -16.617 35.559 -22.943 241 HB3 ALA 31 2HB ALA 31 -16.341 34.906 -24.564 242 H ARG 32 H ARG 32 -14.914 36.207 -21.310 243 HA ARG 32 HA ARG 32 -14.429 34.281 -19.078 244 HB2 ARG 32 2HB ARG 32 -13.046 36.909 -19.631 245 HB3 ARG 32 3HB ARG 32 -13.281 36.363 -17.965 246 HG2 ARG 32 2HG ARG 32 -12.074 34.366 -18.272 247 HG3 ARG 32 3HG ARG 32 -12.016 34.526 -20.015 248 HD2 ARG 32 2HD ARG 32 -9.932 35.330 -19.624 249 HD3 ARG 32 3HD ARG 32 -10.764 36.856 -19.333 250 HE ARG 32 HE ARG 32 -9.521 35.039 -17.354 251 HH11 ARG 32 1HH2 ARG 32 -11.394 38.023 -17.708 252 HH12 ARG 32 2HH2 ARG 32 -11.162 38.375 -15.988 253 HH21 ARG 32 1HH1 ARG 32 -9.229 35.769 -15.232 254 HH22 ARG 32 2HH1 ARG 32 -10.055 37.261 -14.766 255 H TYR 33 H TYR 33 -15.314 34.715 -17.149 256 HA TYR 33 HA TYR 33 -17.358 36.860 -16.965 257 HB2 TYR 33 2HB TYR 33 -17.982 33.939 -16.493 258 HB3 TYR 33 3HB TYR 33 -19.022 35.282 -16.115 259 HD1 TYR 33 HD1 TYR 33 -17.404 33.478 -18.970 260 HD2 TYR 33 HD2 TYR 33 -20.448 36.231 -17.698 261 HE1 TYR 33 HE1 TYR 33 -18.519 33.295 -21.204 262 HE2 TYR 33 HE2 TYR 33 -21.551 36.055 -19.916 263 HH TYR 33 HH TYR 33 -21.603 35.006 -21.875 264 H ARG 34 H ARG 34 -17.587 37.738 -15.011 265 HA ARG 34 HA ARG 34 -15.972 36.758 -12.702 266 HB2 ARG 34 2HB ARG 34 -15.583 39.048 -13.619 267 HB3 ARG 34 3HB ARG 34 -17.255 39.467 -13.270 268 HG2 ARG 34 2HG ARG 34 -16.852 39.206 -10.860 269 HG3 ARG 34 3HG ARG 34 -15.202 38.625 -11.166 270 HD2 ARG 34 2HD ARG 34 -14.647 40.800 -12.238 271 HD3 ARG 34 3HD ARG 34 -16.303 41.340 -11.973 272 HE ARG 34 HE ARG 34 -15.923 41.562 -9.662 273 HH11 ARG 34 1HH2 ARG 34 -12.876 40.591 -11.226 274 HH12 ARG 34 2HH2 ARG 34 -11.971 41.051 -9.814 275 HH21 ARG 34 1HH1 ARG 34 -14.642 42.133 -7.968 276 HH22 ARG 34 2HH1 ARG 34 -12.922 41.905 -8.054 277 H THR 35 H THR 35 -16.882 35.928 -10.960 278 HA THR 35 HA THR 35 -19.789 35.612 -10.747 279 HB THR 35 HB THR 35 -19.335 34.218 -8.787 280 HG1 THR 35 HG1 THR 35 -16.628 34.653 -9.313 281 HG21 THR 35 1HG2 THR 35 -17.514 33.544 -11.111 282 HG22 THR 35 2HG2 THR 35 -18.039 32.460 -9.807 283 HG23 THR 35 3HG2 THR 35 -19.235 33.141 -10.935 284 H ASP 36 H ASP 36 -20.582 35.724 -8.283 285 HA ASP 36 HA ASP 36 -20.558 38.535 -7.697 286 HB2 ASP 36 2HB ASP 36 -22.554 37.022 -7.521 287 HB3 ASP 36 3HB ASP 36 -21.799 36.235 -6.133 288 H ASN 37 H ASN 37 -18.512 35.962 -6.532 289 HA ASN 37 HA ASN 37 -17.701 37.621 -4.194 290 HB2 ASN 37 2HB ASN 37 -16.278 35.135 -4.950 291 HB3 ASN 37 3HB ASN 37 -16.437 35.902 -3.407 292 HD21 ASN 37 1HD2 ASN 37 -16.950 33.159 -4.459 293 HD22 ASN 37 2HD2 ASN 37 -18.558 32.774 -3.805 294 H GLY 38 H GLY 38 -17.184 37.950 -7.392 295 HA2 GLY 38 HA2 GLY 38 -15.587 39.087 -8.616 296 HA3 GLY 38 HA3 GLY 38 -14.479 39.115 -7.238 297 H GLU 39 H GLU 39 -15.652 35.948 -7.828 298 HA GLU 39 HA GLU 39 -12.958 35.105 -8.614 299 HB2 GLU 39 2HB GLU 39 -15.349 33.268 -8.685 300 HB3 GLU 39 3HB GLU 39 -13.675 32.912 -8.340 301 HG2 GLU 39 2HG GLU 39 -14.237 34.568 -6.242 302 HG3 GLU 39 3HG GLU 39 -15.875 34.023 -6.658 303 H GLU 40 H GLU 40 -12.276 35.268 -10.681 304 HA GLU 40 HA GLU 40 -14.241 35.323 -12.905 305 HB2 GLU 40 2HB GLU 40 -11.340 36.165 -12.691 306 HB3 GLU 40 3HB GLU 40 -12.237 36.092 -14.223 307 HG2 GLU 40 2HG GLU 40 -13.881 37.649 -13.442 308 HG3 GLU 40 3HG GLU 40 -13.177 37.688 -11.820 309 H PHE 41 H PHE 41 -14.514 33.839 -14.361 310 HA PHE 41 HA PHE 41 -12.565 31.593 -14.706 311 HB2 PHE 41 2HB PHE 41 -15.595 31.473 -14.619 312 HB3 PHE 41 3HB PHE 41 -14.564 30.148 -15.088 313 HD1 PHE 41 HD1 PHE 41 -15.493 32.306 -12.131 314 HD2 PHE 41 HD2 PHE 41 -13.540 28.715 -13.539 315 HE1 PHE 41 HE1 PHE 41 -15.155 31.546 -9.826 316 HE2 PHE 41 HE2 PHE 41 -13.095 28.035 -11.195 317 HZ PHE 41 HZ PHE 41 -13.880 29.469 -9.326 318 H GLU 42 H GLU 42 -12.759 30.490 -16.704 319 HA GLU 42 HA GLU 42 -13.467 32.237 -18.983 320 HB2 GLU 42 2HB GLU 42 -11.632 29.853 -19.216 321 HB3 GLU 42 3HB GLU 42 -11.779 31.273 -20.230 322 HG2 GLU 42 2HG GLU 42 -9.857 31.834 -19.196 323 HG3 GLU 42 3HG GLU 42 -10.956 32.543 -18.020 324 H VAL 43 H VAL 43 -14.823 31.585 -20.530 325 HA VAL 43 HA VAL 43 -15.916 28.791 -20.529 326 HB VAL 43 HB VAL 43 -17.517 31.295 -21.079 327 HG11 VAL 43 1HG1 VAL 43 -19.408 29.795 -21.156 328 HG12 VAL 43 2HG1 VAL 43 -18.235 29.249 -22.340 329 HG13 VAL 43 3HG1 VAL 43 -18.379 28.386 -20.796 330 HG21 VAL 43 3HG2 VAL 43 -16.943 31.010 -18.627 331 HG22 VAL 43 1HG2 VAL 43 -18.644 30.945 -19.029 332 HG23 VAL 43 2HG2 VAL 43 -17.763 29.433 -18.692 333 HA PRO 44 HA PRO 44 -14.509 29.213 -24.851 334 HB2 PRO 44 2HB PRO 44 -15.035 26.276 -24.724 335 HB3 PRO 44 3HB PRO 44 -13.648 27.127 -25.436 336 HG2 PRO 44 2HG PRO 44 -13.411 25.878 -23.038 337 HG3 PRO 44 3HG PRO 44 -12.692 27.506 -23.262 338 HD2 PRO 44 2HD PRO 44 -15.338 26.807 -21.962 339 HD3 PRO 44 3HD PRO 44 -14.046 27.931 -21.418 340 H PHE 45 H PHE 45 -15.800 29.753 -26.402 341 HA PHE 45 HA PHE 45 -18.427 28.377 -26.918 342 HB2 PHE 45 2HB PHE 45 -17.600 31.276 -27.199 343 HB3 PHE 45 3HB PHE 45 -18.956 30.627 -28.075 344 HD1 PHE 45 HD2 PHE 45 -17.633 31.443 -24.703 345 HD2 PHE 45 HD1 PHE 45 -21.088 30.183 -26.949 346 HE1 PHE 45 HE2 PHE 45 -19.071 31.882 -22.746 347 HE2 PHE 45 HE1 PHE 45 -22.527 30.654 -24.981 348 HZ PHE 45 HZ PHE 45 -21.496 31.432 -22.831 349 H ALA 46 H ALA 46 -18.940 27.949 -29.123 350 HA ALA 46 HA ALA 46 -16.629 27.790 -30.990 351 HB1 ALA 46 3HB ALA 46 -17.964 25.748 -30.608 352 HB2 ALA 46 1HB ALA 46 -19.429 26.599 -31.151 353 HB3 ALA 46 2HB ALA 46 -18.093 26.307 -32.286 354 H ASP 47 H ASP 47 -16.870 28.597 -33.206 355 HA ASP 47 HA ASP 47 -17.852 31.259 -33.327 356 HB2 ASP 47 2HB ASP 47 -16.011 30.196 -34.671 357 HB3 ASP 47 3HB ASP 47 -17.247 29.440 -35.680 358 H ASP 48 H ASP 48 -19.587 28.322 -33.838 359 HA ASP 48 HA ASP 48 -21.808 29.420 -35.403 360 HB2 ASP 48 2HB ASP 48 -21.097 27.030 -35.434 361 HB3 ASP 48 3HB ASP 48 -21.582 26.888 -33.745 362 H ALA 49 H ALA 49 -20.868 29.612 -32.113 363 HA ALA 49 HA ALA 49 -23.592 30.311 -31.116 364 HB1 ALA 49 3HB ALA 49 -22.403 28.437 -29.975 365 HB2 ALA 49 1HB ALA 49 -21.079 29.555 -29.572 366 HB3 ALA 49 2HB ALA 49 -22.703 29.817 -28.907 367 H GLU 50 H GLU 50 -23.344 31.961 -29.224 368 HA GLU 50 HA GLU 50 -21.374 34.110 -29.747 369 HB2 GLU 50 2HB GLU 50 -23.029 35.833 -29.622 370 HB3 GLU 50 3HB GLU 50 -23.481 34.710 -30.906 371 HG2 GLU 50 2HG GLU 50 -25.128 33.636 -29.341 372 HG3 GLU 50 3HG GLU 50 -24.705 34.829 -28.111 373 H ILE 51 H ILE 51 -21.239 35.632 -27.893 374 HA ILE 51 HA ILE 51 -21.265 34.252 -25.314 375 HB ILE 51 HB ILE 51 -20.225 37.037 -25.825 376 HG12 ILE 51 2HG1 ILE 51 -19.216 35.713 -27.556 377 HG13 ILE 51 3HG1 ILE 51 -18.016 36.160 -26.342 378 HG21 ILE 51 1HG2 ILE 51 -19.366 34.888 -23.843 379 HG22 ILE 51 2HG2 ILE 51 -18.705 36.517 -23.975 380 HG23 ILE 51 3HG2 ILE 51 -20.385 36.295 -23.463 381 HD11 ILE 51 3HD1 ILE 51 -19.320 33.430 -26.729 382 HD12 ILE 51 1HD1 ILE 51 -17.655 33.890 -27.110 383 HD13 ILE 51 2HD1 ILE 51 -18.177 33.822 -25.425 384 HA PRO 52 HA PRO 52 -25.030 36.702 -24.413 385 HB2 PRO 52 2HB PRO 52 -25.792 35.228 -22.233 386 HB3 PRO 52 3HB PRO 52 -26.145 34.737 -23.921 387 HG2 PRO 52 2HG PRO 52 -23.921 33.801 -22.101 388 HG3 PRO 52 3HG PRO 52 -24.976 32.820 -23.178 389 HD2 PRO 52 2HD PRO 52 -22.432 33.622 -23.849 390 HD3 PRO 52 3HD PRO 52 -23.700 33.419 -25.073 391 H GLY 53 H GLY 53 -25.338 38.241 -22.827 392 HA2 GLY 53 HA2 GLY 53 -23.260 39.577 -21.645 393 HA3 GLY 53 HA3 GLY 53 -24.930 39.684 -21.079 394 H THR 54 H THR 54 -24.973 36.839 -20.120 395 HA THR 54 HA THR 54 -22.767 36.730 -18.203 396 HB THR 54 HB THR 54 -24.307 36.162 -16.310 397 HG1 THR 54 HG1 THR 54 -26.394 37.009 -18.059 398 HG21 THR 54 1HG2 THR 54 -25.246 38.808 -17.480 399 HG22 THR 54 2HG2 THR 54 -25.298 38.287 -15.780 400 HG23 THR 54 3HG2 THR 54 -23.751 38.568 -16.577 401 H TRP 55 H TRP 55 -22.545 34.608 -17.137 402 HA TRP 55 HA TRP 55 -23.934 32.280 -18.230 403 HB2 TRP 55 2HB TRP 55 -22.208 32.926 -19.989 404 HB3 TRP 55 3HB TRP 55 -20.970 32.592 -18.789 405 HD1 TRP 55 HD1 TRP 55 -20.435 30.095 -18.284 406 HE1 TRP 55 HE1 TRP 55 -20.830 27.928 -19.554 407 HE3 TRP 55 HE3 TRP 55 -24.173 31.690 -21.335 408 HZ2 TRP 55 HZ2 TRP 55 -22.660 26.951 -21.599 409 HZ3 TRP 55 HZ3 TRP 55 -25.246 30.124 -22.959 410 HH2 TRP 55 HH2 TRP 55 -24.490 27.761 -23.099 411 H LEU 56 H LEU 56 -23.468 30.344 -17.032 412 HA LEU 56 HA LEU 56 -22.758 30.818 -14.280 413 HB2 LEU 56 2HB LEU 56 -24.292 28.964 -15.680 414 HB3 LEU 56 3HB LEU 56 -22.895 28.015 -15.176 415 HG LEU 56 HG LEU 56 -24.581 29.697 -13.277 416 HD11 LEU 56 1HD1 LEU 56 -25.618 27.568 -12.590 417 HD12 LEU 56 2HD1 LEU 56 -25.944 27.910 -14.296 418 HD13 LEU 56 3HD1 LEU 56 -24.712 26.706 -13.855 419 HD21 LEU 56 3HD2 LEU 56 -22.335 29.179 -12.405 420 HD22 LEU 56 1HD2 LEU 56 -23.561 28.243 -11.545 421 HD23 LEU 56 2HD2 LEU 56 -22.557 27.464 -12.790 422 H CYS 57 H CYS 57 -20.871 30.639 -13.273 423 HA CYS 57 HA CYS 57 -18.459 29.816 -14.776 424 HB2 CYS 57 2HB CYS 57 -18.923 31.318 -12.173 425 HB3 CYS 57 3HB CYS 57 -17.323 30.814 -12.722 426 HG CYS 57 HG CYS 57 -17.532 33.312 -13.309 427 H ARG 58 H ARG 58 -16.736 28.625 -13.612 428 HA ARG 58 HA ARG 58 -17.766 26.085 -12.780 429 HB2 ARG 58 2HB ARG 58 -14.852 26.865 -12.515 430 HB3 ARG 58 3HB ARG 58 -15.548 25.282 -12.800 431 HG2 ARG 58 2HG ARG 58 -16.353 26.102 -15.049 432 HG3 ARG 58 3HG ARG 58 -15.449 27.599 -14.793 433 HD2 ARG 58 2HD ARG 58 -14.234 24.814 -14.840 434 HD3 ARG 58 3HD ARG 58 -14.288 25.921 -16.210 435 HE ARG 58 HE ARG 58 -12.526 26.079 -13.863 436 HH11 ARG 58 2HH2 ARG 58 -13.531 27.742 -16.862 437 HH12 ARG 58 1HH2 ARG 58 -12.025 28.653 -16.827 438 HH21 ARG 58 1HH1 ARG 58 -10.695 27.431 -14.060 439 HH22 ARG 58 2HH1 ARG 58 -10.671 28.572 -15.407 440 H ASN 59 H ASN 59 -17.056 28.820 -10.870 441 HA ASN 59 HA ASN 59 -16.742 27.539 -8.308 442 HB2 ASN 59 2HB ASN 59 -16.135 29.849 -8.735 443 HB3 ASN 59 3HB ASN 59 -17.792 30.258 -9.187 444 HD21 ASN 59 1HD2 ASN 59 -17.811 31.975 -7.655 445 HD22 ASN 59 2HD2 ASN 59 -17.799 31.643 -5.937 446 H GLY 60 H GLY 60 -19.470 27.862 -10.413 447 HA2 GLY 60 HA2 GLY 60 -21.577 26.849 -10.167 448 HA3 GLY 60 HA3 GLY 60 -21.364 26.747 -8.418 449 H MET 61 H MET 61 -20.549 29.845 -9.760 450 HA MET 61 HA MET 61 -23.201 30.962 -8.999 451 HB2 MET 61 2HB MET 61 -21.184 31.531 -7.535 452 HB3 MET 61 3HB MET 61 -20.520 32.396 -8.898 453 HG2 MET 61 2HG MET 61 -21.696 33.889 -7.324 454 HG3 MET 61 3HG MET 61 -22.394 33.943 -8.941 455 HE1 MET 61 3HE MET 61 -25.574 34.633 -6.814 456 HE2 MET 61 1HE MET 61 -23.941 35.197 -6.414 457 HE3 MET 61 2HE MET 61 -24.493 35.195 -8.109 458 H GLU 62 H GLU 62 -24.087 32.596 -10.276 459 HA GLU 62 HA GLU 62 -23.554 32.502 -13.121 460 HB2 GLU 62 2HB GLU 62 -25.304 34.334 -11.443 461 HB3 GLU 62 3HB GLU 62 -25.220 34.355 -13.212 462 HG2 GLU 62 2HG GLU 62 -25.929 31.977 -13.283 463 HG3 GLU 62 3HG GLU 62 -26.059 31.958 -11.523 464 H GLY 63 H GLY 63 -21.797 33.324 -14.005 465 HA2 GLY 63 HA2 GLY 63 -20.385 35.643 -12.894 466 HA3 GLY 63 HA3 GLY 63 -19.849 34.610 -14.192 467 H THR 64 H THR 64 -20.027 37.579 -14.035 468 HA THR 64 HA THR 64 -21.760 38.039 -16.417 469 HB THR 64 HB THR 64 -20.578 40.093 -14.505 470 HG1 THR 64 HG1 THR 64 -22.223 38.898 -13.550 471 HG21 THR 64 1HG2 THR 64 -22.522 40.392 -16.843 472 HG22 THR 64 2HG2 THR 64 -22.288 41.624 -15.582 473 HG23 THR 64 3HG2 THR 64 -20.944 41.178 -16.636 474 H LEU 65 H LEU 65 -21.009 38.858 -18.274 475 HA LEU 65 HA LEU 65 -18.500 37.970 -19.103 476 HB2 LEU 65 2HB LEU 65 -20.630 38.198 -20.358 477 HB3 LEU 65 3HB LEU 65 -20.431 39.931 -20.389 478 HG LEU 65 HG LEU 65 -18.865 37.775 -21.856 479 HD11 LEU 65 1HD1 LEU 65 -21.082 38.497 -22.739 480 HD12 LEU 65 2HD1 LEU 65 -20.498 40.171 -22.817 481 HD13 LEU 65 3HD1 LEU 65 -19.767 38.918 -23.842 482 HD21 LEU 65 3HD2 LEU 65 -17.682 39.650 -23.068 483 HD22 LEU 65 1HD2 LEU 65 -18.205 40.743 -21.766 484 HD23 LEU 65 2HD2 LEU 65 -17.134 39.350 -21.432 485 H ILE 66 H ILE 66 -16.535 38.766 -18.895 486 HA ILE 66 HA ILE 66 -16.020 41.664 -19.260 487 HB ILE 66 HB ILE 66 -14.116 41.626 -17.833 488 HG12 ILE 66 2HG1 ILE 66 -13.439 39.256 -17.985 489 HG13 ILE 66 3HG1 ILE 66 -13.456 39.895 -16.344 490 HG21 ILE 66 1HG2 ILE 66 -15.204 41.583 -15.636 491 HG22 ILE 66 2HG2 ILE 66 -16.216 42.359 -16.868 492 HG23 ILE 66 3HG2 ILE 66 -16.594 40.717 -16.320 493 HD11 ILE 66 3HD1 ILE 66 -15.559 38.091 -17.408 494 HD12 ILE 66 1HD1 ILE 66 -14.226 37.642 -16.332 495 HD13 ILE 66 2HD1 ILE 66 -15.486 38.765 -15.789 496 H GLU 67 H GLU 67 -13.942 42.112 -20.310 497 HA GLU 67 HA GLU 67 -13.748 40.483 -22.634 498 HB2 GLU 67 2HB GLU 67 -11.815 41.919 -23.251 499 HB3 GLU 67 3HB GLU 67 -13.339 42.734 -22.979 500 HG2 GLU 67 2HG GLU 67 -11.305 42.639 -20.730 501 HG3 GLU 67 3HG GLU 67 -11.068 43.722 -22.088 502 H GLY 68 H GLY 68 -12.917 38.596 -22.868 503 HA2 GLY 68 HA2 GLY 68 -10.230 37.910 -21.717 504 HA3 GLY 68 HA3 GLY 68 -11.607 36.808 -21.655 505 H ASP 69 H ASP 69 -12.092 37.997 -24.652 506 HA ASP 69 HA ASP 69 -10.796 35.657 -25.761 507 HB2 ASP 69 2HB ASP 69 -13.186 36.145 -26.136 508 HB3 ASP 69 3HB ASP 69 -12.725 37.500 -27.159 509 H LEU 70 H LEU 70 -8.955 37.558 -25.068 510 HA LEU 70 HA LEU 70 -7.922 39.005 -27.393 511 HB2 LEU 70 2HB LEU 70 -7.219 38.720 -24.460 512 HB3 LEU 70 3HB LEU 70 -6.053 39.394 -25.567 513 HG LEU 70 HG LEU 70 -7.655 41.157 -26.257 514 HD11 LEU 70 1HD1 LEU 70 -9.608 41.640 -24.779 515 HD12 LEU 70 2HD1 LEU 70 -9.832 40.178 -25.734 516 HD13 LEU 70 3HD1 LEU 70 -9.397 40.051 -24.010 517 HD21 LEU 70 3HD2 LEU 70 -7.134 40.973 -23.261 518 HD22 LEU 70 1HD2 LEU 70 -5.975 41.534 -24.488 519 HD23 LEU 70 2HD2 LEU 70 -7.452 42.461 -24.182 520 HA PRO 71 HA PRO 71 -5.078 39.631 -27.373 521 HB2 PRO 71 2HB PRO 71 -3.990 38.813 -30.041 522 HB3 PRO 71 3HB PRO 71 -3.207 39.734 -28.722 523 HG2 PRO 71 2HG PRO 71 -2.598 37.135 -29.082 524 HG3 PRO 71 3HG PRO 71 -2.920 37.732 -27.416 525 HD2 PRO 71 2HD PRO 71 -4.849 36.353 -29.317 526 HD3 PRO 71 3HD PRO 71 -4.471 35.940 -27.622 527 H GLU 72 H GLU 72 -6.839 38.195 -30.126 528 HA GLU 72 HA GLU 72 -7.744 40.913 -30.993 529 HB2 GLU 72 2HB GLU 72 -6.738 38.671 -32.766 530 HB3 GLU 72 3HB GLU 72 -7.561 40.144 -33.308 531 HG2 GLU 72 2HG GLU 72 -5.724 41.429 -31.994 532 HG3 GLU 72 3HG GLU 72 -4.839 39.905 -32.003 533 HA PRO 73 HA PRO 73 -11.643 38.443 -30.606 534 HB2 PRO 73 2HB PRO 73 -13.091 40.211 -29.154 535 HB3 PRO 73 3HB PRO 73 -11.858 39.163 -28.408 536 HG2 PRO 73 2HG PRO 73 -11.477 42.032 -29.341 537 HG3 PRO 73 3HG PRO 73 -11.130 41.341 -27.724 538 HD2 PRO 73 2HD PRO 73 -9.176 41.555 -29.585 539 HD3 PRO 73 3HD PRO 73 -9.273 40.135 -28.515 540 H LYS 74 H LYS 74 -10.956 39.259 -32.880 541 HA LYS 74 HA LYS 74 -12.362 41.585 -33.972 542 HB2 LYS 74 2HB LYS 74 -9.990 40.824 -34.503 543 HB3 LYS 74 3HB LYS 74 -10.698 39.550 -35.497 544 HG2 LYS 74 2HG LYS 74 -11.834 41.314 -36.876 545 HG3 LYS 74 3HG LYS 74 -11.128 42.561 -35.834 546 HD2 LYS 74 2HD LYS 74 -8.850 41.790 -36.462 547 HD3 LYS 74 3HD LYS 74 -9.545 40.570 -37.534 548 HE2 LYS 74 2HE LYS 74 -9.978 43.586 -37.794 549 HE3 LYS 74 3HE LYS 74 -8.741 42.677 -38.667 550 HZ1 LYS 74 HZ1 LYS 74 -10.709 42.959 -40.032 551 HZ2 LYS 74 HZ2 LYS 74 -10.514 41.373 -39.713 552 HZ3 LYS 74 HZ3 LYS 74 -11.667 42.234 -38.932 553 H LYS 75 H LYS 75 -14.300 40.188 -33.034 554 HA LYS 75 HA LYS 75 -15.718 38.832 -35.310 555 HB2 LYS 75 2HB LYS 75 -15.599 37.961 -32.395 556 HB3 LYS 75 3HB LYS 75 -16.710 37.292 -33.600 557 HG2 LYS 75 2HG LYS 75 -14.805 36.594 -35.008 558 HG3 LYS 75 3HG LYS 75 -13.670 37.185 -33.778 559 HD2 LYS 75 2HD LYS 75 -14.569 35.625 -32.130 560 HD3 LYS 75 3HD LYS 75 -15.771 35.024 -33.283 561 HE2 LYS 75 2HE LYS 75 -12.744 34.847 -33.656 562 HE3 LYS 75 3HE LYS 75 -13.742 33.555 -32.986 563 HZ1 LYS 75 HZ1 LYS 75 -14.038 34.659 -35.726 564 HZ2 LYS 75 HZ2 LYS 75 -13.387 33.213 -35.347 565 HZ3 LYS 75 HZ3 LYS 75 -14.983 33.484 -35.090 566 H VAL 76 H VAL 76 -15.950 41.513 -34.881 567 HA VAL 76 HA VAL 76 -18.792 41.820 -33.975 568 HB VAL 76 HB VAL 76 -16.606 43.933 -33.874 569 HG11 VAL 76 1HG1 VAL 76 -18.810 44.945 -34.306 570 HG12 VAL 76 2HG1 VAL 76 -19.522 44.009 -32.968 571 HG13 VAL 76 3HG1 VAL 76 -18.310 45.266 -32.647 572 HG21 VAL 76 3HG2 VAL 76 -18.005 42.412 -31.628 573 HG22 VAL 76 1HG2 VAL 76 -16.287 42.296 -32.068 574 HG23 VAL 76 2HG2 VAL 76 -16.920 43.802 -31.409 575 H LYS 77 H LYS 77 -20.194 42.651 -35.412 576 HA LYS 77 HA LYS 77 -19.322 43.952 -37.910 577 HB2 LYS 77 2HB LYS 77 -20.705 42.345 -39.282 578 HB3 LYS 77 3HB LYS 77 -19.200 41.690 -38.648 579 HG2 LYS 77 2HG LYS 77 -20.336 40.437 -36.932 580 HG3 LYS 77 3HG LYS 77 -21.884 41.214 -37.275 581 HD2 LYS 77 2HD LYS 77 -20.398 39.490 -39.300 582 HD3 LYS 77 3HD LYS 77 -21.585 38.859 -38.147 583 HE2 LYS 77 2HE LYS 77 -23.295 40.437 -39.044 584 HE3 LYS 77 3HE LYS 77 -22.140 40.997 -40.256 585 HZ1 LYS 77 HZ1 LYS 77 -22.093 38.767 -41.186 586 HZ2 LYS 77 HZ2 LYS 77 -23.066 38.184 -40.004 587 HZ3 LYS 77 HZ3 LYS 77 -23.660 39.248 -41.085 588 HA PRO 78 HA PRO 78 -23.372 45.873 -37.414 589 HB2 PRO 78 2HB PRO 78 -23.777 46.976 -39.867 590 HB3 PRO 78 3HB PRO 78 -22.516 47.580 -38.750 591 HG2 PRO 78 2HG PRO 78 -22.180 45.618 -41.049 592 HG3 PRO 78 3HG PRO 78 -21.219 47.094 -40.709 593 HD2 PRO 78 2HD PRO 78 -20.408 44.605 -39.923 594 HD3 PRO 78 3HD PRO 78 -20.080 46.057 -38.931 595 HA PRO 79 HA PRO 79 -26.371 42.963 -39.074 596 HB2 PRO 79 2HB PRO 79 -28.154 45.310 -39.683 597 HB3 PRO 79 3HB PRO 79 -28.529 43.804 -38.792 598 HG2 PRO 79 2HG PRO 79 -28.091 46.113 -37.446 599 HG3 PRO 79 3HG PRO 79 -27.373 44.579 -36.849 600 HD2 PRO 79 2HD PRO 79 -26.045 46.746 -38.509 601 HD3 PRO 79 3HD PRO 79 -25.452 45.927 -37.032 602 H ARG 80 H ARG 80 -26.444 43.004 -42.712 603 HA ARG 80 HA ARG 80 -25.900 41.379 -40.356 604 HB2 ARG 80 2HB ARG 80 -27.936 40.035 -40.493 605 HB3 ARG 80 3HB ARG 80 -28.301 41.694 -40.037 606 HG2 ARG 80 2HG ARG 80 -29.028 42.169 -42.387 607 HG3 ARG 80 3HG ARG 80 -28.706 40.472 -42.805 608 HD2 ARG 80 2HD ARG 80 -30.352 39.742 -41.111 609 HD3 ARG 80 3HD ARG 80 -30.675 41.439 -40.696 610 HE ARG 80 HE ARG 80 -31.063 41.112 -43.493 611 HH11 ARG 80 1HH2 ARG 80 -32.648 40.104 -40.537 612 HH12 ARG 80 2HH2 ARG 80 -34.210 39.998 -41.306 613 HH21 ARG 80 1HH1 ARG 80 -33.077 40.956 -44.405 614 HH22 ARG 80 2HH1 ARG 80 -34.438 40.469 -43.438 Start of MODEL 7 1 H1 SER 1 1H SER 1 -17.642 1.701 -4.064 2 H2 SER 1 2H SER 1 -17.378 3.146 -3.320 3 H3 SER 1 3H SER 1 -17.684 1.803 -2.435 4 HA SER 1 HA SER 1 -15.370 2.284 -2.293 5 HB2 SER 1 2HB SER 1 -14.457 0.128 -3.206 6 HB3 SER 1 3HB SER 1 -15.885 -0.045 -2.174 7 HG SER 1 HG SER 1 -16.076 -1.290 -4.084 8 H MET 2 H MET 2 -15.771 1.179 -5.676 9 HA MET 2 HA MET 2 -14.954 1.776 -7.652 10 HB2 MET 2 2HB MET 2 -14.894 4.588 -6.520 11 HB3 MET 2 3HB MET 2 -14.667 4.167 -8.218 12 HG2 MET 2 2HG MET 2 -16.898 3.097 -8.266 13 HG3 MET 2 3HG MET 2 -17.159 3.573 -6.584 14 HE1 MET 2 3HE MET 2 -19.645 5.866 -8.570 15 HE2 MET 2 1HE MET 2 -19.186 4.196 -8.965 16 HE3 MET 2 2HE MET 2 -19.468 4.666 -7.272 17 H ALA 3 H ALA 3 -12.776 2.698 -5.055 18 HA ALA 3 HA ALA 3 -10.550 2.782 -4.864 19 HB1 ALA 3 3HB ALA 3 -10.855 0.386 -5.342 20 HB2 ALA 3 1HB ALA 3 -10.536 0.692 -7.065 21 HB3 ALA 3 2HB ALA 3 -9.267 0.980 -5.856 22 H ASP 4 H ASP 4 -11.656 4.803 -6.604 23 HA ASP 4 HA ASP 4 -9.808 5.312 -8.774 24 HB2 ASP 4 2HB ASP 4 -10.994 7.352 -9.088 25 HB3 ASP 4 3HB ASP 4 -12.159 6.072 -8.785 26 H ARG 5 H ARG 5 -8.377 7.091 -8.980 27 HA ARG 5 HA ARG 5 -7.150 8.193 -6.491 28 HB2 ARG 5 2HB ARG 5 -5.705 6.688 -8.714 29 HB3 ARG 5 3HB ARG 5 -4.889 7.700 -7.516 30 HG2 ARG 5 2HG ARG 5 -5.704 6.289 -5.684 31 HG3 ARG 5 3HG ARG 5 -6.605 5.274 -6.824 32 HD2 ARG 5 2HD ARG 5 -4.512 4.591 -7.928 33 HD3 ARG 5 3HD ARG 5 -3.590 5.670 -6.881 34 HE ARG 5 HE ARG 5 -3.671 4.131 -5.177 35 HH11 ARG 5 1HH2 ARG 5 -6.161 3.126 -7.444 36 HH12 ARG 5 2HH2 ARG 5 -6.363 1.587 -6.663 37 HH21 ARG 5 1HH1 ARG 5 -4.013 2.167 -4.224 38 HH22 ARG 5 2HH1 ARG 5 -5.184 1.066 -4.887 39 H VAL 6 H VAL 6 -5.991 10.097 -6.737 40 HA VAL 6 HA VAL 6 -6.327 11.657 -9.243 41 HB VAL 6 HB VAL 6 -7.069 13.561 -7.860 42 HG11 VAL 6 1HG1 VAL 6 -8.974 11.205 -7.673 43 HG12 VAL 6 2HG1 VAL 6 -9.394 12.928 -7.671 44 HG13 VAL 6 3HG1 VAL 6 -8.695 12.194 -9.124 45 HG21 VAL 6 3HG2 VAL 6 -6.299 12.839 -5.620 46 HG22 VAL 6 1HG2 VAL 6 -8.016 13.254 -5.633 47 HG23 VAL 6 2HG2 VAL 6 -7.528 11.551 -5.619 48 H LEU 7 H LEU 7 -5.123 13.701 -9.205 49 HA LEU 7 HA LEU 7 -2.400 13.403 -8.294 50 HB2 LEU 7 2HB LEU 7 -1.995 15.459 -9.407 51 HB3 LEU 7 3HB LEU 7 -2.986 14.448 -10.442 52 HG LEU 7 HG LEU 7 -4.002 16.811 -8.798 53 HD11 LEU 7 1HD1 LEU 7 -2.446 17.416 -10.664 54 HD12 LEU 7 2HD1 LEU 7 -3.514 16.568 -11.797 55 HD13 LEU 7 3HD1 LEU 7 -4.095 18.007 -10.929 56 HD21 LEU 7 3HD2 LEU 7 -5.416 15.117 -10.894 57 HD22 LEU 7 1HD2 LEU 7 -5.907 15.396 -9.195 58 HD23 LEU 7 2HD2 LEU 7 -5.983 16.708 -10.358 59 H ARG 8 H ARG 8 -1.261 14.726 -6.836 60 HA ARG 8 HA ARG 8 -2.827 15.540 -4.462 61 HB2 ARG 8 2HB ARG 8 0.173 15.292 -4.929 62 HB3 ARG 8 3HB ARG 8 -0.578 15.754 -3.397 63 HG2 ARG 8 2HG ARG 8 -1.782 13.570 -3.317 64 HG3 ARG 8 3HG ARG 8 -1.026 13.104 -4.845 65 HD2 ARG 8 2HD ARG 8 0.201 12.054 -3.086 66 HD3 ARG 8 3HD ARG 8 1.219 13.322 -3.788 67 HE ARG 8 HE ARG 8 -0.271 14.305 -1.505 68 HH11 ARG 8 1HH2 ARG 8 2.545 12.344 -2.218 69 HH12 ARG 8 2HH2 ARG 8 3.296 12.706 -0.686 70 HH21 ARG 8 1HH1 ARG 8 0.747 14.731 0.424 71 HH22 ARG 8 2HH1 ARG 8 2.296 14.017 0.766 72 H GLY 9 H GLY 9 -2.722 17.514 -3.433 73 HA2 GLY 9 HA2 GLY 9 -2.198 19.774 -3.116 74 HA3 GLY 9 HA3 GLY 9 -1.404 19.849 -4.681 75 H SER 10 H SER 10 -3.111 21.819 -3.687 76 HA SER 10 HA SER 10 -5.828 21.628 -4.220 77 HB2 SER 10 2HB SER 10 -4.134 24.150 -4.323 78 HB3 SER 10 3HB SER 10 -5.875 24.050 -3.993 79 HG SER 10 HG SER 10 -4.634 24.204 -2.061 80 H ARG 11 H ARG 11 -3.362 22.155 -6.598 81 HA ARG 11 HA ARG 11 -4.916 23.371 -8.677 82 HB2 ARG 11 2HB ARG 11 -3.098 22.562 -10.191 83 HB3 ARG 11 3HB ARG 11 -2.589 23.520 -8.816 84 HG2 ARG 11 2HG ARG 11 -0.985 21.806 -9.095 85 HG3 ARG 11 3HG ARG 11 -1.869 21.442 -7.623 86 HD2 ARG 11 2HD ARG 11 -3.239 19.773 -8.954 87 HD3 ARG 11 3HD ARG 11 -2.198 20.091 -10.343 88 HE ARG 11 HE ARG 11 -1.525 18.720 -7.782 89 HH11 ARG 11 1HH1 ARG 11 -0.210 19.734 -10.883 90 HH12 ARG 11 2HH1 ARG 11 1.194 18.720 -10.684 91 HH21 ARG 11 1HH2 ARG 11 0.203 17.557 -7.583 92 HH22 ARG 11 2HH2 ARG 11 1.434 17.487 -8.832 93 H LEU 12 H LEU 12 -5.411 20.328 -7.384 94 HA LEU 12 HA LEU 12 -6.570 18.901 -9.574 95 HB2 LEU 12 2HB LEU 12 -6.089 18.007 -7.354 96 HB3 LEU 12 3HB LEU 12 -7.273 19.062 -6.602 97 HG LEU 12 HG LEU 12 -8.100 17.015 -8.703 98 HD11 LEU 12 1HD1 LEU 12 -8.546 15.442 -6.855 99 HD12 LEU 12 2HD1 LEU 12 -6.825 15.830 -6.952 100 HD13 LEU 12 3HD1 LEU 12 -7.825 16.582 -5.695 101 HD21 LEU 12 3HD2 LEU 12 -9.563 18.259 -6.318 102 HD22 LEU 12 1HD2 LEU 12 -9.908 18.578 -8.031 103 HD23 LEU 12 2HD2 LEU 12 -10.220 16.987 -7.367 104 H GLY 13 H GLY 13 -7.764 21.669 -7.652 105 HA2 GLY 13 HA2 GLY 13 -9.492 23.143 -8.058 106 HA3 GLY 13 HA3 GLY 13 -9.731 22.401 -9.644 107 H ALA 14 H ALA 14 -10.096 21.258 -6.240 108 HA ALA 14 HA ALA 14 -12.065 19.364 -6.675 109 HB1 ALA 14 3HB ALA 14 -11.646 21.089 -4.197 110 HB2 ALA 14 1HB ALA 14 -12.513 19.539 -4.254 111 HB3 ALA 14 2HB ALA 14 -10.774 19.591 -4.596 112 H VAL 15 H VAL 15 -14.077 19.397 -7.339 113 HA VAL 15 HA VAL 15 -15.886 20.113 -8.369 114 HB VAL 15 HB VAL 15 -17.675 20.729 -6.979 115 HG11 VAL 15 1HG1 VAL 15 -15.840 18.855 -5.457 116 HG12 VAL 15 2HG1 VAL 15 -17.610 18.929 -5.374 117 HG13 VAL 15 3HG1 VAL 15 -16.822 18.425 -6.878 118 HG21 VAL 15 3HG2 VAL 15 -16.601 22.504 -5.568 119 HG22 VAL 15 1HG2 VAL 15 -17.503 21.306 -4.628 120 HG23 VAL 15 2HG2 VAL 15 -15.734 21.227 -4.688 121 H SER 16 H SER 16 -13.727 22.126 -8.645 122 HA SER 16 HA SER 16 -15.357 24.153 -10.022 123 HB2 SER 16 2HB SER 16 -15.066 25.034 -7.703 124 HB3 SER 16 3HB SER 16 -13.310 24.960 -7.919 125 HG SER 16 HG SER 16 -14.078 27.030 -8.417 126 H TYR 17 H TYR 17 -14.502 23.046 -11.822 127 HA TYR 17 HA TYR 17 -11.722 23.703 -12.599 128 HB2 TYR 17 2HB TYR 17 -11.263 21.387 -13.225 129 HB3 TYR 17 3HB TYR 17 -11.565 21.514 -11.508 130 HD1 TYR 17 HD2 TYR 17 -13.627 20.572 -10.499 131 HD2 TYR 17 HD1 TYR 17 -12.793 20.163 -14.710 132 HE1 TYR 17 HE2 TYR 17 -15.385 18.814 -10.674 133 HE2 TYR 17 HE1 TYR 17 -14.532 18.391 -14.882 134 HH TYR 17 HH TYR 17 -16.121 17.163 -13.773 135 H GLU 18 H GLU 18 -11.234 23.331 -14.831 136 HA GLU 18 HA GLU 18 -13.338 24.259 -16.568 137 HB2 GLU 18 2HB GLU 18 -11.677 24.146 -18.342 138 HB3 GLU 18 3HB GLU 18 -11.121 25.020 -16.920 139 HG2 GLU 18 2HG GLU 18 -9.840 22.927 -16.231 140 HG3 GLU 18 3HG GLU 18 -10.256 22.235 -17.799 141 H THR 19 H THR 19 -14.987 23.034 -17.061 142 HA THR 19 HA THR 19 -14.820 20.157 -17.477 143 HB THR 19 HB THR 19 -17.282 20.407 -17.989 144 HG1 THR 19 HG1 THR 19 -18.193 22.402 -17.596 145 HG21 THR 19 1HG2 THR 19 -17.935 20.963 -15.695 146 HG22 THR 19 2HG2 THR 19 -16.491 19.940 -15.695 147 HG23 THR 19 3HG2 THR 19 -16.341 21.681 -15.384 148 H ASP 20 H ASP 20 -14.239 22.702 -19.584 149 HA ASP 20 HA ASP 20 -15.279 21.374 -22.015 150 HB2 ASP 20 2HB ASP 20 -13.883 24.044 -21.634 151 HB3 ASP 20 3HB ASP 20 -14.549 23.442 -23.153 152 H ARG 21 H ARG 21 -13.985 20.929 -23.876 153 HA ARG 21 HA ARG 21 -11.064 20.504 -23.434 154 HB2 ARG 21 2HB ARG 21 -13.029 18.389 -24.416 155 HB3 ARG 21 3HB ARG 21 -11.279 18.206 -24.423 156 HG2 ARG 21 2HG ARG 21 -12.950 18.594 -21.893 157 HG3 ARG 21 3HG ARG 21 -12.437 17.041 -22.541 158 HD2 ARG 21 2HD ARG 21 -10.079 17.626 -22.290 159 HD3 ARG 21 3HD ARG 21 -10.493 19.239 -21.718 160 HE ARG 21 HE ARG 21 -10.692 16.704 -20.228 161 HH11 ARG 21 2HH1 ARG 21 -11.586 20.118 -20.179 162 HH12 ARG 21 1HH1 ARG 21 -11.794 20.109 -18.447 163 HH21 ARG 21 2HH2 ARG 21 -11.009 16.806 -18.015 164 HH22 ARG 21 1HH2 ARG 21 -11.480 18.316 -17.285 165 H ASN 22 H ASN 22 -9.841 20.095 -25.304 166 HA ASN 22 HA ASN 22 -10.870 21.482 -27.732 167 HB2 ASN 22 2HB ASN 22 -8.705 22.472 -27.982 168 HB3 ASN 22 3HB ASN 22 -9.287 22.797 -26.357 169 HD21 ASN 22 2HD2 ASN 22 -6.632 23.160 -26.846 170 HD22 ASN 22 1HD2 ASN 22 -5.712 21.874 -26.079 171 H HIS 23 H HIS 23 -10.932 18.546 -27.251 172 HA HIS 23 HA HIS 23 -8.948 17.237 -28.866 173 HB2 HIS 23 2HB HIS 23 -10.413 16.134 -27.181 174 HB3 HIS 23 3HB HIS 23 -11.807 16.404 -28.229 175 HD2 HIS 23 HD2 HIS 23 -8.339 14.589 -28.399 176 HE1 HIS 23 HE1 HIS 23 -11.095 12.319 -30.736 177 HE2 HIS 23 HE2 HIS 23 -8.707 12.421 -29.855 178 H ASP 24 H ASP 24 -11.962 18.840 -29.696 179 HA ASP 24 HA ASP 24 -11.218 18.699 -32.590 180 HB2 ASP 24 2HB ASP 24 -13.924 19.285 -31.340 181 HB3 ASP 24 3HB ASP 24 -13.530 19.521 -33.036 182 H LEU 25 H LEU 25 -11.235 20.683 -33.722 183 HA LEU 25 HA LEU 25 -10.987 23.164 -32.073 184 HB2 LEU 25 2HB LEU 25 -9.170 22.247 -34.330 185 HB3 LEU 25 3HB LEU 25 -9.102 23.828 -33.558 186 HG LEU 25 HG LEU 25 -8.571 21.176 -32.135 187 HD11 LEU 25 1HD1 LEU 25 -6.222 21.886 -32.161 188 HD12 LEU 25 2HD1 LEU 25 -6.848 21.725 -33.808 189 HD13 LEU 25 3HD1 LEU 25 -6.652 23.339 -33.091 190 HD21 LEU 25 3HD2 LEU 25 -8.174 24.059 -31.211 191 HD22 LEU 25 1HD2 LEU 25 -9.363 22.907 -30.558 192 HD23 LEU 25 2HD2 LEU 25 -7.638 22.606 -30.341 193 H ALA 26 H ALA 26 -11.743 25.006 -32.913 194 HA ALA 26 HA ALA 26 -12.892 25.167 -35.622 195 HB1 ALA 26 3HB ALA 26 -14.625 24.047 -34.238 196 HB2 ALA 26 1HB ALA 26 -14.547 25.373 -33.056 197 HB3 ALA 26 2HB ALA 26 -15.150 25.670 -34.699 198 HA PRO 27 HA PRO 27 -12.352 29.684 -35.065 199 HB2 PRO 27 2HB PRO 27 -15.178 29.812 -36.149 200 HB3 PRO 27 3HB PRO 27 -13.754 30.817 -36.590 201 HG2 PRO 27 2HG PRO 27 -14.492 28.787 -38.183 202 HG3 PRO 27 3HG PRO 27 -12.756 28.935 -37.740 203 HD2 PRO 27 2HD PRO 27 -14.874 27.164 -36.469 204 HD3 PRO 27 3HD PRO 27 -13.240 26.725 -37.047 205 H ARG 28 H ARG 28 -12.463 29.074 -32.748 206 HA ARG 28 HA ARG 28 -14.985 29.529 -31.311 207 HB2 ARG 28 2HB ARG 28 -13.960 28.301 -29.514 208 HB3 ARG 28 3HB ARG 28 -13.718 27.455 -31.041 209 HG2 ARG 28 2HG ARG 28 -11.394 28.750 -31.078 210 HG3 ARG 28 3HG ARG 28 -11.690 28.945 -29.350 211 HD2 ARG 28 2HD ARG 28 -11.824 26.517 -29.065 212 HD3 ARG 28 3HD ARG 28 -11.724 26.259 -30.807 213 HE ARG 28 HE ARG 28 -9.531 26.794 -28.972 214 HH11 ARG 28 2HH2 ARG 28 -10.376 27.137 -32.398 215 HH12 ARG 28 1HH2 ARG 28 -8.703 27.078 -32.865 216 HH21 ARG 28 2HH1 ARG 28 -7.448 26.775 -29.693 217 HH22 ARG 28 1HH1 ARG 28 -7.107 26.882 -31.394 218 H GLN 29 H GLN 29 -15.071 30.538 -29.290 219 HA GLN 29 HA GLN 29 -13.589 33.145 -29.181 220 HB2 GLN 29 2HB GLN 29 -16.569 32.756 -28.773 221 HB3 GLN 29 3HB GLN 29 -15.687 34.277 -28.799 222 HG2 GLN 29 2HG GLN 29 -16.007 34.479 -31.017 223 HG3 GLN 29 3HG GLN 29 -15.255 32.917 -31.340 224 HE21 GLN 29 1HE2 GLN 29 -16.884 31.063 -30.258 225 HE22 GLN 29 2HE2 GLN 29 -18.476 31.145 -30.998 226 H ILE 30 H ILE 30 -12.437 32.835 -27.360 227 HA ILE 30 HA ILE 30 -13.579 31.515 -24.979 228 HB ILE 30 HB ILE 30 -10.864 32.848 -25.092 229 HG12 ILE 30 2HG1 ILE 30 -10.762 31.413 -27.003 230 HG13 ILE 30 3HG1 ILE 30 -9.818 30.739 -25.693 231 HG21 ILE 30 1HG2 ILE 30 -10.366 31.155 -23.345 232 HG22 ILE 30 2HG2 ILE 30 -11.712 32.204 -22.886 233 HG23 ILE 30 3HG2 ILE 30 -12.036 30.556 -23.449 234 HD11 ILE 30 3HD1 ILE 30 -12.580 29.764 -26.545 235 HD12 ILE 30 1HD1 ILE 30 -11.027 28.997 -26.917 236 HD13 ILE 30 2HD1 ILE 30 -11.577 29.076 -25.240 237 H ALA 31 H ALA 31 -15.040 32.786 -23.897 238 HA ALA 31 HA ALA 31 -14.381 35.652 -23.371 239 HB1 ALA 31 3HB ALA 31 -16.592 35.342 -24.203 240 HB2 ALA 31 1HB ALA 31 -16.924 34.027 -23.047 241 HB3 ALA 31 2HB ALA 31 -16.720 35.694 -22.474 242 H ARG 32 H ARG 32 -14.665 36.463 -21.217 243 HA ARG 32 HA ARG 32 -14.127 34.522 -18.998 244 HB2 ARG 32 2HB ARG 32 -12.906 37.210 -19.601 245 HB3 ARG 32 3HB ARG 32 -13.185 36.778 -17.912 246 HG2 ARG 32 2HG ARG 32 -11.795 34.898 -17.967 247 HG3 ARG 32 3HG ARG 32 -11.736 34.851 -19.729 248 HD2 ARG 32 2HD ARG 32 -9.655 35.729 -19.058 249 HD3 ARG 32 3HD ARG 32 -10.576 37.124 -19.644 250 HE ARG 32 HE ARG 32 -11.088 37.202 -16.949 251 HH11 ARG 32 1HH1 ARG 32 -8.069 37.191 -18.736 252 HH12 ARG 32 2HH1 ARG 32 -7.161 37.756 -17.358 253 HH21 ARG 32 2HH2 ARG 32 -9.956 38.181 -15.385 254 HH22 ARG 32 1HH2 ARG 32 -8.214 38.368 -15.515 255 H TYR 33 H TYR 33 -15.213 34.819 -17.090 256 HA TYR 33 HA TYR 33 -17.225 36.987 -16.948 257 HB2 TYR 33 2HB TYR 33 -17.883 34.063 -16.492 258 HB3 TYR 33 3HB TYR 33 -18.934 35.409 -16.145 259 HD1 TYR 33 HD2 TYR 33 -17.208 33.589 -18.910 260 HD2 TYR 33 HD1 TYR 33 -20.344 36.301 -17.785 261 HE1 TYR 33 HE2 TYR 33 -18.226 33.354 -21.169 262 HE2 TYR 33 HE1 TYR 33 -21.338 36.112 -20.067 263 HH TYR 33 HH TYR 33 -20.043 33.819 -22.481 264 H ARG 34 H ARG 34 -17.617 37.728 -14.939 265 HA ARG 34 HA ARG 34 -15.990 36.646 -12.683 266 HB2 ARG 34 2HB ARG 34 -15.545 38.968 -13.593 267 HB3 ARG 34 3HB ARG 34 -17.126 39.463 -12.981 268 HG2 ARG 34 2HG ARG 34 -16.478 39.014 -10.691 269 HG3 ARG 34 3HG ARG 34 -15.065 38.096 -11.210 270 HD2 ARG 34 2HD ARG 34 -14.304 40.371 -12.312 271 HD3 ARG 34 3HD ARG 34 -15.474 41.086 -11.185 272 HE ARG 34 HE ARG 34 -13.578 39.160 -10.001 273 HH11 ARG 34 2HH1 ARG 34 -13.900 42.570 -10.765 274 HH12 ARG 34 1HH1 ARG 34 -12.667 43.018 -9.619 275 HH21 ARG 34 2HH2 ARG 34 -12.064 39.779 -8.594 276 HH22 ARG 34 1HH2 ARG 34 -11.646 41.461 -8.410 277 H THR 35 H THR 35 -16.890 35.820 -10.984 278 HA THR 35 HA THR 35 -19.796 35.530 -10.778 279 HB THR 35 HB THR 35 -19.371 34.084 -8.857 280 HG1 THR 35 HG1 THR 35 -16.658 34.561 -9.317 281 HG21 THR 35 1HG2 THR 35 -18.046 32.354 -9.899 282 HG22 THR 35 2HG2 THR 35 -19.240 33.053 -11.017 283 HG23 THR 35 3HG2 THR 35 -17.521 33.471 -11.177 284 H ASP 36 H ASP 36 -20.613 35.593 -8.322 285 HA ASP 36 HA ASP 36 -20.557 38.390 -7.666 286 HB2 ASP 36 2HB ASP 36 -22.585 36.911 -7.572 287 HB3 ASP 36 3HB ASP 36 -21.873 36.073 -6.190 288 H ASN 37 H ASN 37 -18.574 35.754 -6.535 289 HA ASN 37 HA ASN 37 -17.804 37.307 -4.115 290 HB2 ASN 37 2HB ASN 37 -16.363 34.861 -4.964 291 HB3 ASN 37 3HB ASN 37 -16.544 35.555 -3.391 292 HD21 ASN 37 1HD2 ASN 37 -17.023 32.859 -4.532 293 HD22 ASN 37 2HD2 ASN 37 -18.643 32.446 -3.929 294 H GLY 38 H GLY 38 -17.218 37.767 -7.291 295 HA2 GLY 38 HA2 GLY 38 -15.590 39.020 -8.393 296 HA3 GLY 38 HA3 GLY 38 -14.491 38.881 -7.016 297 H GLU 39 H GLU 39 -15.661 35.796 -7.737 298 HA GLU 39 HA GLU 39 -13.001 34.969 -8.582 299 HB2 GLU 39 2HB GLU 39 -15.391 33.137 -8.755 300 HB3 GLU 39 3HB GLU 39 -13.728 32.767 -8.413 301 HG2 GLU 39 2HG GLU 39 -14.301 34.340 -6.249 302 HG3 GLU 39 3HG GLU 39 -15.935 33.813 -6.700 303 H GLU 40 H GLU 40 -12.290 35.169 -10.624 304 HA GLU 40 HA GLU 40 -14.220 35.294 -12.885 305 HB2 GLU 40 2HB GLU 40 -11.278 35.996 -12.635 306 HB3 GLU 40 3HB GLU 40 -12.150 35.944 -14.174 307 HG2 GLU 40 2HG GLU 40 -13.771 37.592 -13.332 308 HG3 GLU 40 3HG GLU 40 -12.890 37.688 -11.802 309 H PHE 41 H PHE 41 -14.470 33.813 -14.370 310 HA PHE 41 HA PHE 41 -12.450 31.633 -14.741 311 HB2 PHE 41 2HB PHE 41 -15.475 31.408 -14.727 312 HB3 PHE 41 3HB PHE 41 -14.375 30.135 -15.190 313 HD1 PHE 41 HD1 PHE 41 -15.564 32.153 -12.220 314 HD2 PHE 41 HD2 PHE 41 -13.176 28.803 -13.604 315 HE1 PHE 41 HE1 PHE 41 -15.264 31.384 -9.928 316 HE2 PHE 41 HE2 PHE 41 -12.844 28.089 -11.257 317 HZ PHE 41 HZ PHE 41 -13.859 29.395 -9.407 318 H GLU 42 H GLU 42 -12.579 30.575 -16.801 319 HA GLU 42 HA GLU 42 -13.319 32.402 -19.024 320 HB2 GLU 42 2HB GLU 42 -11.336 30.122 -19.239 321 HB3 GLU 42 3HB GLU 42 -11.615 31.467 -20.335 322 HG2 GLU 42 2HG GLU 42 -9.742 32.290 -19.394 323 HG3 GLU 42 3HG GLU 42 -10.842 32.887 -18.165 324 H VAL 43 H VAL 43 -14.713 31.758 -20.528 325 HA VAL 43 HA VAL 43 -15.643 28.906 -20.635 326 HB VAL 43 HB VAL 43 -17.382 31.339 -21.039 327 HG11 VAL 43 1HG1 VAL 43 -18.087 28.382 -20.832 328 HG12 VAL 43 2HG1 VAL 43 -19.199 29.747 -21.101 329 HG13 VAL 43 3HG1 VAL 43 -18.047 29.311 -22.346 330 HG21 VAL 43 3HG2 VAL 43 -17.348 29.395 -18.695 331 HG22 VAL 43 1HG2 VAL 43 -16.759 31.079 -18.632 332 HG23 VAL 43 2HG2 VAL 43 -18.452 30.761 -18.955 333 HA PRO 44 HA PRO 44 -14.457 29.576 -24.993 334 HB2 PRO 44 2HB PRO 44 -14.788 26.612 -24.988 335 HB3 PRO 44 3HB PRO 44 -13.468 27.582 -25.672 336 HG2 PRO 44 2HG PRO 44 -13.138 26.191 -23.350 337 HG3 PRO 44 3HG PRO 44 -12.448 27.837 -23.519 338 HD2 PRO 44 2HD PRO 44 -15.027 27.023 -22.156 339 HD3 PRO 44 3HD PRO 44 -13.751 28.174 -21.626 340 H PHE 45 H PHE 45 -15.931 30.107 -26.407 341 HA PHE 45 HA PHE 45 -18.479 28.558 -26.747 342 HB2 PHE 45 2HB PHE 45 -17.776 31.438 -27.319 343 HB3 PHE 45 3HB PHE 45 -19.146 30.674 -28.064 344 HD1 PHE 45 HD2 PHE 45 -17.633 31.604 -24.776 345 HD2 PHE 45 HD1 PHE 45 -21.201 30.332 -26.836 346 HE1 PHE 45 HE2 PHE 45 -18.953 31.990 -22.727 347 HE2 PHE 45 HE1 PHE 45 -22.540 30.804 -24.787 348 HZ PHE 45 HZ PHE 45 -21.400 31.621 -22.722 349 H ALA 46 H ALA 46 -19.041 27.790 -28.717 350 HA ALA 46 HA ALA 46 -16.807 27.307 -30.579 351 HB1 ALA 46 3HB ALA 46 -18.212 25.436 -29.764 352 HB2 ALA 46 1HB ALA 46 -19.645 26.189 -30.504 353 HB3 ALA 46 2HB ALA 46 -18.315 25.605 -31.526 354 H ASP 47 H ASP 47 -17.202 27.373 -32.939 355 HA ASP 47 HA ASP 47 -17.848 29.887 -33.978 356 HB2 ASP 47 2HB ASP 47 -17.536 28.815 -36.086 357 HB3 ASP 47 3HB ASP 47 -16.470 27.996 -34.947 358 H ASP 48 H ASP 48 -19.869 27.185 -33.361 359 HA ASP 48 HA ASP 48 -22.233 27.935 -34.863 360 HB2 ASP 48 2HB ASP 48 -21.574 25.630 -34.125 361 HB3 ASP 48 3HB ASP 48 -21.949 26.091 -32.468 362 H ALA 49 H ALA 49 -20.958 29.210 -31.953 363 HA ALA 49 HA ALA 49 -23.599 30.304 -31.057 364 HB1 ALA 49 3HB ALA 49 -22.874 28.372 -29.685 365 HB2 ALA 49 1HB ALA 49 -21.337 29.202 -29.342 366 HB3 ALA 49 2HB ALA 49 -22.870 29.881 -28.752 367 H GLU 50 H GLU 50 -23.497 32.190 -29.683 368 HA GLU 50 HA GLU 50 -21.002 33.783 -29.743 369 HB2 GLU 50 2HB GLU 50 -23.726 34.812 -30.635 370 HB3 GLU 50 3HB GLU 50 -22.417 35.870 -30.076 371 HG2 GLU 50 2HG GLU 50 -20.907 34.767 -31.749 372 HG3 GLU 50 3HG GLU 50 -22.331 34.006 -32.467 373 H ILE 51 H ILE 51 -20.774 35.273 -28.192 374 HA ILE 51 HA ILE 51 -21.218 34.363 -25.626 375 HB ILE 51 HB ILE 51 -20.258 37.146 -26.264 376 HG12 ILE 51 2HG1 ILE 51 -19.066 35.683 -27.840 377 HG13 ILE 51 3HG1 ILE 51 -17.992 36.309 -26.590 378 HG21 ILE 51 1HG2 ILE 51 -19.446 35.158 -24.104 379 HG22 ILE 51 2HG2 ILE 51 -18.830 36.792 -24.328 380 HG23 ILE 51 3HG2 ILE 51 -20.516 36.541 -23.849 381 HD11 ILE 51 3HD1 ILE 51 -17.487 33.993 -27.099 382 HD12 ILE 51 1HD1 ILE 51 -18.099 34.075 -25.454 383 HD13 ILE 51 2HD1 ILE 51 -19.158 33.509 -26.769 384 HA PRO 52 HA PRO 52 -24.988 36.778 -24.619 385 HB2 PRO 52 2HB PRO 52 -25.597 35.350 -22.367 386 HB3 PRO 52 3HB PRO 52 -26.018 34.800 -24.019 387 HG2 PRO 52 2HG PRO 52 -23.727 33.935 -22.256 388 HG3 PRO 52 3HG PRO 52 -24.771 32.934 -23.323 389 HD2 PRO 52 2HD PRO 52 -22.223 33.900 -23.961 390 HD3 PRO 52 3HD PRO 52 -23.421 33.430 -25.175 391 H GLY 53 H GLY 53 -25.237 38.368 -23.037 392 HA2 GLY 53 HA2 GLY 53 -23.132 39.713 -21.880 393 HA3 GLY 53 HA3 GLY 53 -24.794 39.804 -21.290 394 H THR 54 H THR 54 -24.835 36.971 -20.352 395 HA THR 54 HA THR 54 -22.650 36.830 -18.405 396 HB THR 54 HB THR 54 -24.277 36.275 -16.551 397 HG1 THR 54 HG1 THR 54 -26.493 36.651 -16.918 398 HG21 THR 54 1HG2 THR 54 -23.671 38.696 -16.915 399 HG22 THR 54 2HG2 THR 54 -25.199 38.905 -17.769 400 HG23 THR 54 3HG2 THR 54 -25.187 38.427 -16.053 401 H TRP 55 H TRP 55 -22.496 34.734 -17.265 402 HA TRP 55 HA TRP 55 -23.856 32.412 -18.412 403 HB2 TRP 55 2HB TRP 55 -22.040 33.066 -20.071 404 HB3 TRP 55 3HB TRP 55 -20.865 32.724 -18.811 405 HD1 TRP 55 HD1 TRP 55 -20.368 30.235 -18.241 406 HE1 TRP 55 HE1 TRP 55 -20.725 28.042 -19.483 407 HE3 TRP 55 HE3 TRP 55 -23.945 31.799 -21.512 408 HZ2 TRP 55 HZ2 TRP 55 -22.495 27.032 -21.569 409 HZ3 TRP 55 HZ3 TRP 55 -24.989 30.197 -23.111 410 HH2 TRP 55 HH2 TRP 55 -24.264 27.819 -23.151 411 H LEU 56 H LEU 56 -23.529 30.483 -17.177 412 HA LEU 56 HA LEU 56 -22.822 30.892 -14.418 413 HB2 LEU 56 2HB LEU 56 -24.424 29.125 -15.841 414 HB3 LEU 56 3HB LEU 56 -23.061 28.110 -15.362 415 HG LEU 56 HG LEU 56 -24.664 29.821 -13.423 416 HD11 LEU 56 1HD1 LEU 56 -24.931 26.852 -14.061 417 HD12 LEU 56 2HD1 LEU 56 -25.789 27.725 -12.769 418 HD13 LEU 56 3HD1 LEU 56 -26.112 28.120 -14.464 419 HD21 LEU 56 3HD2 LEU 56 -22.742 27.487 -12.993 420 HD22 LEU 56 1HD2 LEU 56 -22.433 29.181 -12.579 421 HD23 LEU 56 2HD2 LEU 56 -23.698 28.290 -11.726 422 H CYS 57 H CYS 57 -20.947 30.648 -13.411 423 HA CYS 57 HA CYS 57 -18.553 29.799 -14.936 424 HB2 CYS 57 2HB CYS 57 -18.973 31.306 -12.333 425 HB3 CYS 57 3HB CYS 57 -17.383 30.775 -12.887 426 HG CYS 57 HG CYS 57 -19.555 32.488 -14.688 427 H ARG 58 H ARG 58 -16.854 28.641 -13.732 428 HA ARG 58 HA ARG 58 -17.854 26.029 -13.108 429 HB2 ARG 58 2HB ARG 58 -15.050 27.194 -12.853 430 HB3 ARG 58 3HB ARG 58 -15.421 25.499 -12.682 431 HG2 ARG 58 2HG ARG 58 -14.401 26.062 -14.831 432 HG3 ARG 58 3HG ARG 58 -15.965 25.253 -14.997 433 HD2 ARG 58 2HD ARG 58 -17.028 27.249 -15.767 434 HD3 ARG 58 3HD ARG 58 -15.693 28.259 -15.199 435 HE ARG 58 HE ARG 58 -14.651 27.996 -17.199 436 HH11 ARG 58 1HH1 ARG 58 -16.884 25.219 -17.093 437 HH12 ARG 58 2HH1 ARG 58 -16.505 24.883 -18.776 438 HH21 ARG 58 1HH2 ARG 58 -14.360 27.422 -19.233 439 HH22 ARG 58 2HH2 ARG 58 -15.217 25.992 -19.877 440 H ASN 59 H ASN 59 -17.052 28.696 -11.045 441 HA ASN 59 HA ASN 59 -16.847 27.372 -8.543 442 HB2 ASN 59 2HB ASN 59 -16.201 29.660 -8.916 443 HB3 ASN 59 3HB ASN 59 -17.849 30.121 -9.363 444 HD21 ASN 59 1HD2 ASN 59 -17.866 31.806 -7.793 445 HD22 ASN 59 2HD2 ASN 59 -17.844 31.438 -6.083 446 H GLY 60 H GLY 60 -19.584 27.770 -10.623 447 HA2 GLY 60 HA2 GLY 60 -21.697 26.788 -10.397 448 HA3 GLY 60 HA3 GLY 60 -21.487 26.641 -8.650 449 H MET 61 H MET 61 -20.648 29.756 -9.951 450 HA MET 61 HA MET 61 -23.287 30.884 -9.160 451 HB2 MET 61 2HB MET 61 -21.271 31.401 -7.678 452 HB3 MET 61 3HB MET 61 -20.590 32.284 -9.021 453 HG2 MET 61 2HG MET 61 -21.759 33.757 -7.415 454 HG3 MET 61 3HG MET 61 -22.433 33.861 -9.039 455 HE1 MET 61 3HE MET 61 -25.639 34.550 -6.959 456 HE2 MET 61 1HE MET 61 -24.008 35.076 -6.498 457 HE3 MET 61 2HE MET 61 -24.512 35.130 -8.206 458 H GLU 62 H GLU 62 -24.156 32.549 -10.399 459 HA GLU 62 HA GLU 62 -23.596 32.571 -13.223 460 HB2 GLU 62 2HB GLU 62 -25.250 34.387 -13.328 461 HB3 GLU 62 3HB GLU 62 -25.815 32.902 -12.571 462 HG2 GLU 62 2HG GLU 62 -25.538 33.948 -10.316 463 HG3 GLU 62 3HG GLU 62 -25.054 35.458 -11.091 464 H GLY 63 H GLY 63 -21.865 33.379 -14.114 465 HA2 GLY 63 HA2 GLY 63 -20.412 35.648 -12.935 466 HA3 GLY 63 HA3 GLY 63 -19.831 34.632 -14.231 467 H THR 64 H THR 64 -20.106 37.618 -14.006 468 HA THR 64 HA THR 64 -21.740 38.079 -16.461 469 HB THR 64 HB THR 64 -20.610 40.097 -14.498 470 HG1 THR 64 HG1 THR 64 -22.749 40.310 -13.847 471 HG21 THR 64 1HG2 THR 64 -20.853 41.230 -16.610 472 HG22 THR 64 2HG2 THR 64 -22.407 40.449 -16.949 473 HG23 THR 64 3HG2 THR 64 -22.272 41.665 -15.657 474 H LEU 65 H LEU 65 -20.919 38.922 -18.300 475 HA LEU 65 HA LEU 65 -18.304 38.187 -18.990 476 HB2 LEU 65 2HB LEU 65 -20.356 38.347 -20.436 477 HB3 LEU 65 3HB LEU 65 -20.241 40.097 -20.356 478 HG LEU 65 HG LEU 65 -17.865 39.773 -21.439 479 HD11 LEU 65 1HD1 LEU 65 -17.669 37.377 -20.993 480 HD12 LEU 65 2HD1 LEU 65 -19.068 37.065 -22.007 481 HD13 LEU 65 3HD1 LEU 65 -17.575 37.756 -22.713 482 HD21 LEU 65 3HD2 LEU 65 -20.374 38.972 -22.981 483 HD22 LEU 65 1HD2 LEU 65 -19.832 40.637 -22.674 484 HD23 LEU 65 2HD2 LEU 65 -18.856 39.567 -23.693 485 H ILE 66 H ILE 66 -16.388 39.118 -18.667 486 HA ILE 66 HA ILE 66 -16.124 42.085 -18.585 487 HB ILE 66 HB ILE 66 -14.466 42.032 -16.894 488 HG12 ILE 66 2HG1 ILE 66 -13.312 39.958 -17.140 489 HG13 ILE 66 3HG1 ILE 66 -13.930 40.053 -15.491 490 HG21 ILE 66 1HG2 ILE 66 -16.901 40.544 -15.875 491 HG22 ILE 66 2HG2 ILE 66 -15.785 41.542 -14.930 492 HG23 ILE 66 3HG2 ILE 66 -16.790 42.284 -16.189 493 HD11 ILE 66 3HD1 ILE 66 -14.846 38.344 -17.717 494 HD12 ILE 66 1HD1 ILE 66 -14.227 37.851 -16.135 495 HD13 ILE 66 2HD1 ILE 66 -15.844 38.586 -16.264 496 H GLU 67 H GLU 67 -14.081 42.947 -19.192 497 HA GLU 67 HA GLU 67 -12.666 41.452 -21.298 498 HB2 GLU 67 2HB GLU 67 -12.226 44.220 -20.120 499 HB3 GLU 67 3HB GLU 67 -11.291 43.518 -21.446 500 HG2 GLU 67 2HG GLU 67 -13.365 43.290 -22.798 501 HG3 GLU 67 3HG GLU 67 -14.297 44.034 -21.498 502 H GLY 68 H GLY 68 -10.627 40.692 -21.243 503 HA2 GLY 68 HA2 GLY 68 -8.668 40.991 -19.176 504 HA3 GLY 68 HA3 GLY 68 -9.626 39.533 -18.867 505 H ASP 69 H ASP 69 -8.202 41.166 -21.737 506 HA ASP 69 HA ASP 69 -7.796 38.558 -23.032 507 HB2 ASP 69 2HB ASP 69 -8.419 41.369 -24.040 508 HB3 ASP 69 3HB ASP 69 -8.190 39.965 -25.077 509 H LEU 70 H LEU 70 -6.484 39.100 -25.046 510 HA LEU 70 HA LEU 70 -3.663 39.752 -24.275 511 HB2 LEU 70 2HB LEU 70 -4.874 37.505 -25.918 512 HB3 LEU 70 3HB LEU 70 -3.226 38.010 -26.219 513 HG LEU 70 HG LEU 70 -3.335 36.019 -24.883 514 HD11 LEU 70 1HD1 LEU 70 -1.747 36.676 -23.164 515 HD12 LEU 70 2HD1 LEU 70 -1.442 37.554 -24.674 516 HD13 LEU 70 3HD1 LEU 70 -2.237 38.377 -23.312 517 HD21 LEU 70 3HD2 LEU 70 -5.453 36.524 -23.667 518 HD22 LEU 70 1HD2 LEU 70 -4.136 35.926 -22.633 519 HD23 LEU 70 2HD2 LEU 70 -4.542 37.653 -22.632 520 HA PRO 71 HA PRO 71 -3.608 42.599 -27.646 521 HB2 PRO 71 2HB PRO 71 -1.024 42.544 -28.571 522 HB3 PRO 71 3HB PRO 71 -1.508 43.230 -26.991 523 HG2 PRO 71 2HG PRO 71 -0.386 40.469 -27.555 524 HG3 PRO 71 3HG PRO 71 0.110 41.632 -26.286 525 HD2 PRO 71 2HD PRO 71 -1.600 39.585 -25.768 526 HD3 PRO 71 3HD PRO 71 -1.805 41.179 -24.988 527 H GLU 72 H GLU 72 -2.094 39.452 -28.629 528 HA GLU 72 HA GLU 72 -3.725 39.529 -31.114 529 HB2 GLU 72 2HB GLU 72 -1.753 38.937 -32.428 530 HB3 GLU 72 3HB GLU 72 -1.610 40.497 -31.620 531 HG2 GLU 72 2HG GLU 72 -0.103 39.576 -29.930 532 HG3 GLU 72 3HG GLU 72 -0.237 37.968 -30.630 533 HA PRO 73 HA PRO 73 -3.929 35.159 -29.489 534 HB2 PRO 73 2HB PRO 73 -6.523 35.063 -28.637 535 HB3 PRO 73 3HB PRO 73 -5.178 35.611 -27.592 536 HG2 PRO 73 2HG PRO 73 -7.049 37.351 -29.256 537 HG3 PRO 73 3HG PRO 73 -6.673 37.501 -27.506 538 HD2 PRO 73 2HD PRO 73 -5.344 39.003 -29.288 539 HD3 PRO 73 3HD PRO 73 -4.466 38.244 -27.975 540 H LYS 74 H LYS 74 -5.148 33.465 -30.484 541 HA LYS 74 HA LYS 74 -6.154 34.100 -33.190 542 HB2 LYS 74 2HB LYS 74 -5.757 31.783 -33.715 543 HB3 LYS 74 3HB LYS 74 -4.339 32.513 -32.972 544 HG2 LYS 74 2HG LYS 74 -4.901 31.407 -30.800 545 HG3 LYS 74 3HG LYS 74 -6.350 30.718 -31.535 546 HD2 LYS 74 2HD LYS 74 -4.695 29.007 -31.506 547 HD3 LYS 74 3HD LYS 74 -4.888 29.510 -33.192 548 HE2 LYS 74 2HE LYS 74 -2.845 30.929 -32.985 549 HE3 LYS 74 3HE LYS 74 -2.684 30.450 -31.291 550 HZ1 LYS 74 HZ1 LYS 74 -1.255 29.118 -32.733 551 HZ2 LYS 74 HZ2 LYS 74 -2.372 28.151 -32.042 552 HZ3 LYS 74 HZ3 LYS 74 -2.527 28.593 -33.608 553 H LYS 75 H LYS 75 -7.828 34.450 -30.733 554 HA LYS 75 HA LYS 75 -9.957 32.477 -30.792 555 HB2 LYS 75 2HB LYS 75 -10.877 33.739 -28.948 556 HB3 LYS 75 3HB LYS 75 -9.145 33.508 -28.741 557 HG2 LYS 75 2HG LYS 75 -8.843 35.876 -29.700 558 HG3 LYS 75 3HG LYS 75 -10.581 36.097 -29.539 559 HD2 LYS 75 2HD LYS 75 -8.807 35.253 -27.198 560 HD3 LYS 75 3HD LYS 75 -9.076 36.947 -27.644 561 HE2 LYS 75 2HE LYS 75 -11.505 36.706 -27.383 562 HE3 LYS 75 3HE LYS 75 -11.297 34.996 -26.982 563 HZ1 LYS 75 HZ1 LYS 75 -9.851 35.832 -25.082 564 HZ2 LYS 75 HZ2 LYS 75 -10.490 37.330 -25.342 565 HZ3 LYS 75 HZ3 LYS 75 -11.456 36.065 -24.954 566 H VAL 76 H VAL 76 -9.835 33.406 -33.332 567 HA VAL 76 HA VAL 76 -11.593 35.677 -33.780 568 HB VAL 76 HB VAL 76 -11.197 35.307 -36.164 569 HG11 VAL 76 1HG1 VAL 76 -9.627 36.642 -34.794 570 HG12 VAL 76 2HG1 VAL 76 -8.636 35.191 -34.517 571 HG13 VAL 76 3HG1 VAL 76 -8.825 35.845 -36.156 572 HG21 VAL 76 3HG2 VAL 76 -10.994 32.842 -36.251 573 HG22 VAL 76 1HG2 VAL 76 -9.585 33.640 -36.958 574 HG23 VAL 76 2HG2 VAL 76 -9.472 32.928 -35.339 575 H LYS 77 H LYS 77 -13.523 35.825 -34.813 576 HA LYS 77 HA LYS 77 -15.437 33.644 -34.530 577 HB2 LYS 77 2HB LYS 77 -15.604 36.421 -35.798 578 HB3 LYS 77 3HB LYS 77 -16.964 35.305 -35.710 579 HG2 LYS 77 2HG LYS 77 -16.783 35.269 -33.231 580 HG3 LYS 77 3HG LYS 77 -15.487 36.477 -33.313 581 HD2 LYS 77 2HD LYS 77 -17.008 38.094 -34.369 582 HD3 LYS 77 3HD LYS 77 -18.285 36.875 -34.468 583 HE2 LYS 77 2HE LYS 77 -18.124 36.693 -31.904 584 HE3 LYS 77 3HE LYS 77 -17.112 38.143 -31.962 585 HZ1 LYS 77 HZ1 LYS 77 -19.413 38.762 -31.611 586 HZ2 LYS 77 HZ2 LYS 77 -19.013 39.257 -33.113 587 HZ3 LYS 77 HZ3 LYS 77 -19.932 37.909 -32.903 588 HA PRO 78 HA PRO 78 -15.293 32.181 -38.863 589 HB2 PRO 78 2HB PRO 78 -17.812 31.198 -39.159 590 HB3 PRO 78 3HB PRO 78 -16.628 30.395 -38.085 591 HG2 PRO 78 2HG PRO 78 -18.769 32.412 -37.322 592 HG3 PRO 78 3HG PRO 78 -18.484 30.804 -36.602 593 HD2 PRO 78 2HD PRO 78 -17.462 33.074 -35.502 594 HD3 PRO 78 3HD PRO 78 -16.540 31.549 -35.481 595 HA PRO 79 HA PRO 79 -17.443 35.531 -41.124 596 HB2 PRO 79 2HB PRO 79 -18.347 34.292 -43.405 597 HB3 PRO 79 3HB PRO 79 -16.636 34.744 -43.131 598 HG2 PRO 79 2HG PRO 79 -17.938 32.039 -42.684 599 HG3 PRO 79 3HG PRO 79 -16.409 32.404 -43.545 600 HD2 PRO 79 2HD PRO 79 -16.415 31.574 -40.965 601 HD3 PRO 79 3HD PRO 79 -15.261 32.821 -41.517 602 H ARG 80 H ARG 80 -19.418 36.352 -40.800 603 HA ARG 80 HA ARG 80 -21.859 34.664 -40.525 604 HB2 ARG 80 2HB ARG 80 -20.797 36.626 -38.445 605 HB3 ARG 80 3HB ARG 80 -22.458 36.028 -38.484 606 HG2 ARG 80 2HG ARG 80 -21.657 33.701 -38.222 607 HG3 ARG 80 3HG ARG 80 -19.983 34.282 -38.160 608 HD2 ARG 80 2HD ARG 80 -20.485 35.600 -36.151 609 HD3 ARG 80 3HD ARG 80 -22.169 35.053 -36.189 610 HE ARG 80 HE ARG 80 -21.129 32.679 -36.011 611 HH11 ARG 80 2HH1 ARG 80 -20.048 35.434 -34.101 612 HH12 ARG 80 1HH1 ARG 80 -19.071 34.375 -33.102 613 HH21 ARG 80 2HH2 ARG 80 -20.114 31.500 -34.388 614 HH22 ARG 80 1HH2 ARG 80 -19.357 32.387 -33.076 Start of MODEL 8 1 H1 SER 1 1H SER 1 17.036 33.884 -32.962 2 H2 SER 1 2H SER 1 15.889 34.575 -33.913 3 H3 SER 1 3H SER 1 17.300 34.059 -34.570 4 HA SER 1 HA SER 1 15.277 32.330 -33.320 5 HB2 SER 1 2HB SER 1 15.902 32.671 -36.280 6 HB3 SER 1 3HB SER 1 14.707 31.567 -35.566 7 HG SER 1 HG SER 1 13.751 33.531 -36.272 8 H MET 2 H MET 2 15.651 30.042 -33.571 9 HA MET 2 HA MET 2 18.425 29.254 -33.296 10 HB2 MET 2 2HB MET 2 16.523 28.246 -32.051 11 HB3 MET 2 3HB MET 2 15.919 27.543 -33.558 12 HG2 MET 2 2HG MET 2 17.967 26.206 -33.773 13 HG3 MET 2 3HG MET 2 18.658 26.984 -32.344 14 HE1 MET 2 3HE MET 2 19.225 24.440 -31.621 15 HE2 MET 2 1HE MET 2 17.981 23.194 -31.381 16 HE3 MET 2 2HE MET 2 18.331 23.790 -33.016 17 H ALA 3 H ALA 3 19.703 27.989 -34.662 18 HA ALA 3 HA ALA 3 19.340 28.454 -37.487 19 HB1 ALA 3 3HB ALA 3 21.499 28.658 -36.310 20 HB2 ALA 3 1HB ALA 3 21.479 26.911 -35.962 21 HB3 ALA 3 2HB ALA 3 21.591 27.488 -37.638 22 H ASP 4 H ASP 4 18.073 25.956 -35.633 23 HA ASP 4 HA ASP 4 17.560 24.277 -37.992 24 HB2 ASP 4 2HB ASP 4 19.656 23.406 -36.864 25 HB3 ASP 4 3HB ASP 4 18.691 23.103 -35.420 26 H ARG 5 H ARG 5 15.866 22.666 -37.543 27 HA ARG 5 HA ARG 5 13.738 23.855 -35.797 28 HB2 ARG 5 2HB ARG 5 12.162 23.039 -37.383 29 HB3 ARG 5 3HB ARG 5 13.387 24.035 -38.175 30 HG2 ARG 5 2HG ARG 5 14.507 22.038 -39.069 31 HG3 ARG 5 3HG ARG 5 13.377 20.974 -38.225 32 HD2 ARG 5 2HD ARG 5 12.593 23.008 -40.352 33 HD3 ARG 5 3HD ARG 5 12.889 21.287 -40.658 34 HE ARG 5 HE ARG 5 10.979 21.388 -38.599 35 HH11 ARG 5 1HH1 ARG 5 11.077 22.328 -41.973 36 HH12 ARG 5 2HH1 ARG 5 9.358 22.115 -42.178 37 HH21 ARG 5 1HH2 ARG 5 8.795 21.143 -38.924 38 HH22 ARG 5 2HH2 ARG 5 8.107 21.458 -40.490 39 H VAL 6 H VAL 6 15.676 21.804 -35.099 40 HA VAL 6 HA VAL 6 13.877 19.642 -34.048 41 HB VAL 6 HB VAL 6 16.745 19.276 -34.994 42 HG11 VAL 6 1HG1 VAL 6 14.681 17.258 -34.000 43 HG12 VAL 6 2HG1 VAL 6 16.251 16.852 -34.724 44 HG13 VAL 6 3HG1 VAL 6 16.200 17.705 -33.185 45 HG21 VAL 6 3HG2 VAL 6 15.273 19.556 -36.936 46 HG22 VAL 6 1HG2 VAL 6 15.726 17.862 -36.782 47 HG23 VAL 6 2HG2 VAL 6 14.111 18.391 -36.260 48 H LEU 7 H LEU 7 14.075 19.062 -31.985 49 HA LEU 7 HA LEU 7 16.206 20.222 -30.247 50 HB2 LEU 7 2HB LEU 7 13.205 20.104 -29.744 51 HB3 LEU 7 3HB LEU 7 14.383 20.445 -28.485 52 HG LEU 7 HG LEU 7 14.015 22.179 -30.967 53 HD11 LEU 7 1HD1 LEU 7 12.009 22.182 -29.529 54 HD12 LEU 7 2HD1 LEU 7 13.014 22.583 -28.115 55 HD13 LEU 7 3HD1 LEU 7 12.859 23.731 -29.464 56 HD21 LEU 7 3HD2 LEU 7 15.519 22.654 -28.345 57 HD22 LEU 7 1HD2 LEU 7 16.256 22.416 -29.947 58 HD23 LEU 7 2HD2 LEU 7 15.278 23.851 -29.638 59 H ARG 8 H ARG 8 16.560 19.104 -28.293 60 HA ARG 8 HA ARG 8 15.756 16.215 -28.193 61 HB2 ARG 8 2HB ARG 8 18.407 17.487 -27.378 62 HB3 ARG 8 3HB ARG 8 17.941 15.813 -27.051 63 HG2 ARG 8 2HG ARG 8 17.721 15.390 -29.495 64 HG3 ARG 8 3HG ARG 8 18.257 17.048 -29.823 65 HD2 ARG 8 2HD ARG 8 20.409 16.570 -28.653 66 HD3 ARG 8 3HD ARG 8 19.861 14.925 -28.341 67 HE ARG 8 HE ARG 8 20.228 14.328 -30.558 68 HH11 ARG 8 1HH2 ARG 8 20.696 17.799 -30.334 69 HH12 ARG 8 2HH2 ARG 8 21.400 17.891 -31.926 70 HH21 ARG 8 2HH1 ARG 8 21.134 14.524 -32.567 71 HH22 ARG 8 1HH1 ARG 8 21.639 16.083 -33.149 72 H GLY 9 H GLY 9 15.771 15.308 -25.990 73 HA2 GLY 9 HA2 GLY 9 14.319 17.020 -24.102 74 HA3 GLY 9 HA3 GLY 9 14.672 15.305 -23.926 75 H SER 10 H SER 10 14.843 16.731 -21.734 76 HA SER 10 HA SER 10 16.092 17.300 -19.936 77 HB2 SER 10 2HB SER 10 17.961 15.226 -21.110 78 HB3 SER 10 3HB SER 10 17.870 15.725 -19.409 79 HG SER 10 HG SER 10 16.654 13.818 -19.823 80 H ARG 11 H ARG 11 16.570 19.213 -21.961 81 HA ARG 11 HA ARG 11 19.431 19.874 -22.022 82 HB2 ARG 11 2HB ARG 11 17.182 21.747 -22.773 83 HB3 ARG 11 3HB ARG 11 18.839 21.723 -23.378 84 HG2 ARG 11 2HG ARG 11 18.310 19.553 -24.556 85 HG3 ARG 11 3HG ARG 11 16.622 19.744 -24.042 86 HD2 ARG 11 2HD ARG 11 18.215 21.708 -25.753 87 HD3 ARG 11 3HD ARG 11 16.989 20.596 -26.353 88 HE ARG 11 HE ARG 11 16.571 23.112 -24.890 89 HH11 ARG 11 1HH2 ARG 11 14.886 20.129 -25.735 90 HH12 ARG 11 2HH2 ARG 11 13.336 20.865 -25.422 91 HH21 ARG 11 1HH1 ARG 11 14.692 23.852 -24.367 92 HH22 ARG 11 2HH1 ARG 11 13.214 22.949 -24.650 93 H LEU 12 H LEU 12 20.301 21.908 -21.316 94 HA LEU 12 HA LEU 12 19.082 23.139 -18.892 95 HB2 LEU 12 2HB LEU 12 21.674 23.741 -20.369 96 HB3 LEU 12 3HB LEU 12 21.143 24.506 -18.875 97 HG LEU 12 HG LEU 12 21.834 21.551 -19.200 98 HD11 LEU 12 1HD1 LEU 12 23.779 22.102 -17.811 99 HD12 LEU 12 2HD1 LEU 12 23.782 23.061 -19.300 100 HD13 LEU 12 3HD1 LEU 12 23.288 23.811 -17.765 101 HD21 LEU 12 3HD2 LEU 12 20.142 21.803 -17.442 102 HD22 LEU 12 1HD2 LEU 12 21.717 21.487 -16.714 103 HD23 LEU 12 2HD2 LEU 12 21.063 23.140 -16.712 104 H GLY 13 H GLY 13 19.332 23.714 -22.346 105 HA2 GLY 13 HA2 GLY 13 18.680 26.559 -22.224 106 HA3 GLY 13 HA3 GLY 13 18.882 25.573 -23.662 107 H ALA 14 H ALA 14 16.670 27.239 -21.807 108 HA ALA 14 HA ALA 14 14.239 25.818 -22.608 109 HB1 ALA 14 3HB ALA 14 14.668 28.603 -21.448 110 HB2 ALA 14 1HB ALA 14 13.110 27.766 -21.615 111 HB3 ALA 14 2HB ALA 14 14.345 27.120 -20.519 112 H VAL 15 H VAL 15 12.601 26.780 -24.011 113 HA VAL 15 HA VAL 15 13.626 28.517 -26.206 114 HB VAL 15 HB VAL 15 12.335 27.174 -27.789 115 HG11 VAL 15 1HG1 VAL 15 14.475 25.550 -26.364 116 HG12 VAL 15 2HG1 VAL 15 13.949 25.377 -28.049 117 HG13 VAL 15 3HG1 VAL 15 14.772 26.854 -27.533 118 HG21 VAL 15 3HG2 VAL 15 10.749 26.028 -26.286 119 HG22 VAL 15 1HG2 VAL 15 11.641 24.893 -27.302 120 HG23 VAL 15 2HG2 VAL 15 12.086 25.081 -25.596 121 H SER 16 H SER 16 12.051 29.630 -27.418 122 HA SER 16 HA SER 16 10.303 30.973 -25.597 123 HB2 SER 16 2HB SER 16 10.768 31.544 -28.536 124 HB3 SER 16 3HB SER 16 10.152 32.664 -27.305 125 HG SER 16 HG SER 16 12.388 32.974 -27.688 126 H TYR 17 H TYR 17 9.368 28.254 -26.819 127 HA TYR 17 HA TYR 17 6.582 28.984 -27.478 128 HB2 TYR 17 2HB TYR 17 6.802 27.548 -29.596 129 HB3 TYR 17 3HB TYR 17 7.452 29.172 -29.637 130 HD1 TYR 17 HD2 TYR 17 8.385 25.564 -29.491 131 HD2 TYR 17 HD1 TYR 17 9.802 29.621 -29.885 132 HE1 TYR 17 HE2 TYR 17 10.633 24.725 -30.183 133 HE2 TYR 17 HE1 TYR 17 12.049 28.785 -30.517 134 HH TYR 17 HH TYR 17 13.340 26.937 -30.961 135 H GLU 18 H GLU 18 5.134 27.234 -27.612 136 HA GLU 18 HA GLU 18 5.682 25.184 -25.616 137 HB2 GLU 18 2HB GLU 18 3.303 24.572 -25.960 138 HB3 GLU 18 3HB GLU 18 3.617 26.218 -25.427 139 HG2 GLU 18 2HG GLU 18 3.261 27.024 -27.789 140 HG3 GLU 18 3HG GLU 18 2.814 25.382 -28.245 141 H THR 19 H THR 19 6.972 23.609 -26.177 142 HA THR 19 HA THR 19 6.965 22.322 -28.790 143 HB THR 19 HB THR 19 8.760 20.898 -27.739 144 HG1 THR 19 HG1 THR 19 9.466 21.508 -25.697 145 HG21 THR 19 1HG2 THR 19 9.332 22.994 -28.912 146 HG22 THR 19 2HG2 THR 19 9.139 23.905 -27.398 147 HG23 THR 19 3HG2 THR 19 10.418 22.683 -27.548 148 H ASP 20 H ASP 20 5.022 21.797 -26.121 149 HA ASP 20 HA ASP 20 4.271 19.068 -27.007 150 HB2 ASP 20 2HB ASP 20 5.918 18.834 -25.151 151 HB3 ASP 20 3HB ASP 20 4.883 19.830 -24.122 152 H ARG 21 H ARG 21 2.185 18.394 -26.173 153 HA ARG 21 HA ARG 21 -0.058 18.726 -26.443 154 HB2 ARG 21 2HB ARG 21 -1.161 19.561 -24.477 155 HB3 ARG 21 3HB ARG 21 0.215 18.548 -24.070 156 HG2 ARG 21 2HG ARG 21 1.550 20.499 -23.445 157 HG3 ARG 21 3HG ARG 21 0.260 21.599 -23.982 158 HD2 ARG 21 2HD ARG 21 -1.255 20.639 -22.277 159 HD3 ARG 21 3HD ARG 21 0.036 19.538 -21.749 160 HE ARG 21 HE ARG 21 1.027 22.204 -21.641 161 HH11 ARG 21 1HH1 ARG 21 -1.305 20.247 -19.906 162 HH12 ARG 21 2HH1 ARG 21 -1.118 21.163 -18.435 163 HH21 ARG 21 1HH2 ARG 21 1.219 23.329 -19.731 164 HH22 ARG 21 2HH2 ARG 21 0.276 22.861 -18.346 165 H ASN 22 H ASN 22 1.230 20.369 -28.188 166 HA ASN 22 HA ASN 22 -0.085 23.002 -28.138 167 HB2 ASN 22 2HB ASN 22 1.662 23.663 -29.682 168 HB3 ASN 22 3HB ASN 22 2.339 22.876 -28.267 169 HD21 ASN 22 1HD2 ASN 22 4.226 22.818 -29.798 170 HD22 ASN 22 2HD2 ASN 22 4.334 21.416 -30.873 171 H HIS 23 H HIS 23 -1.206 20.238 -29.319 172 HA HIS 23 HA HIS 23 -2.053 20.989 -32.004 173 HB2 HIS 23 2HB HIS 23 -1.799 18.641 -31.237 174 HB3 HIS 23 3HB HIS 23 -3.124 18.878 -30.093 175 HD2 HIS 23 HD2 HIS 23 -5.151 17.577 -31.037 176 HE1 HIS 23 HE1 HIS 23 -4.975 18.785 -35.126 177 HE2 HIS 23 HE2 HIS 23 -6.302 17.457 -33.407 178 H ASP 24 H ASP 24 -4.330 21.281 -32.619 179 HA ASP 24 HA ASP 24 -6.017 22.643 -30.597 180 HB2 ASP 24 2HB ASP 24 -4.554 24.236 -32.059 181 HB3 ASP 24 3HB ASP 24 -5.753 23.908 -33.318 182 H LEU 25 H LEU 25 -8.147 22.888 -31.070 183 HA LEU 25 HA LEU 25 -9.414 21.401 -33.282 184 HB2 LEU 25 2HB LEU 25 -9.796 20.766 -30.329 185 HB3 LEU 25 3HB LEU 25 -10.936 20.265 -31.573 186 HG LEU 25 HG LEU 25 -8.024 19.363 -31.440 187 HD11 LEU 25 1HD1 LEU 25 -9.381 18.491 -29.580 188 HD12 LEU 25 2HD1 LEU 25 -10.597 17.899 -30.733 189 HD13 LEU 25 3HD1 LEU 25 -8.957 17.211 -30.726 190 HD21 LEU 25 3HD2 LEU 25 -8.882 19.281 -33.753 191 HD22 LEU 25 1HD2 LEU 25 -8.772 17.647 -33.092 192 HD23 LEU 25 2HD2 LEU 25 -10.353 18.450 -33.198 193 H ALA 26 H ALA 26 -11.083 22.435 -33.988 194 HA ALA 26 HA ALA 26 -12.949 23.576 -34.263 195 HB1 ALA 26 3HB ALA 26 -14.546 23.850 -32.485 196 HB2 ALA 26 1HB ALA 26 -13.782 22.248 -32.429 197 HB3 ALA 26 2HB ALA 26 -13.298 23.507 -31.271 198 HA PRO 27 HA PRO 27 -11.725 27.925 -33.996 199 HB2 PRO 27 2HB PRO 27 -14.214 28.161 -35.688 200 HB3 PRO 27 3HB PRO 27 -12.620 28.951 -35.903 201 HG2 PRO 27 2HG PRO 27 -13.298 26.817 -37.424 202 HG3 PRO 27 3HG PRO 27 -11.650 26.914 -36.715 203 HD2 PRO 27 2HD PRO 27 -14.062 25.419 -35.632 204 HD3 PRO 27 3HD PRO 27 -12.385 24.823 -35.897 205 H ARG 28 H ARG 28 -12.178 28.993 -32.280 206 HA ARG 28 HA ARG 28 -14.907 29.189 -31.110 207 HB2 ARG 28 2HB ARG 28 -14.150 28.324 -28.973 208 HB3 ARG 28 3HB ARG 28 -13.817 27.168 -30.257 209 HG2 ARG 28 2HG ARG 28 -11.421 28.143 -30.305 210 HG3 ARG 28 3HG ARG 28 -11.846 28.962 -28.794 211 HD2 ARG 28 2HD ARG 28 -12.357 26.792 -27.741 212 HD3 ARG 28 3HD ARG 28 -12.053 25.948 -29.264 213 HE ARG 28 HE ARG 28 -10.076 26.878 -27.354 214 HH11 ARG 28 1HH2 ARG 28 -10.468 26.040 -30.769 215 HH12 ARG 28 2HH2 ARG 28 -8.744 25.885 -30.992 216 HH21 ARG 28 1HH1 ARG 28 -7.898 26.567 -27.751 217 HH22 ARG 28 2HH1 ARG 28 -7.375 26.092 -29.356 218 H GLN 29 H GLN 29 -14.952 30.426 -29.109 219 HA GLN 29 HA GLN 29 -13.341 32.934 -29.109 220 HB2 GLN 29 2HB GLN 29 -16.343 32.717 -28.643 221 HB3 GLN 29 3HB GLN 29 -15.381 34.191 -28.598 222 HG2 GLN 29 2HG GLN 29 -15.679 34.530 -30.803 223 HG3 GLN 29 3HG GLN 29 -15.045 32.930 -31.197 224 HE21 GLN 29 1HE2 GLN 29 -16.756 31.149 -30.206 225 HE22 GLN 29 2HE2 GLN 29 -18.348 31.354 -30.932 226 H ILE 30 H ILE 30 -12.312 32.850 -27.268 227 HA ILE 30 HA ILE 30 -13.475 31.657 -24.815 228 HB ILE 30 HB ILE 30 -10.758 32.984 -25.073 229 HG12 ILE 30 2HG1 ILE 30 -10.663 31.242 -26.701 230 HG13 ILE 30 3HG1 ILE 30 -9.779 30.731 -25.275 231 HG21 ILE 30 1HG2 ILE 30 -11.970 31.034 -23.061 232 HG22 ILE 30 2HG2 ILE 30 -10.276 31.575 -23.070 233 HG23 ILE 30 3HG2 ILE 30 -11.573 32.739 -22.786 234 HD11 ILE 30 3HD1 ILE 30 -11.712 29.307 -24.608 235 HD12 ILE 30 1HD1 ILE 30 -12.545 29.779 -26.119 236 HD13 ILE 30 2HD1 ILE 30 -11.030 28.869 -26.184 237 H ALA 31 H ALA 31 -14.993 32.923 -23.930 238 HA ALA 31 HA ALA 31 -14.412 35.817 -23.459 239 HB1 ALA 31 3HB ALA 31 -16.797 35.913 -22.748 240 HB2 ALA 31 1HB ALA 31 -16.571 35.445 -24.441 241 HB3 ALA 31 2HB ALA 31 -16.978 34.209 -23.222 242 H ARG 32 H ARG 32 -14.551 36.638 -21.347 243 HA ARG 32 HA ARG 32 -14.167 34.647 -19.142 244 HB2 ARG 32 2HB ARG 32 -12.799 37.247 -19.740 245 HB3 ARG 32 3HB ARG 32 -13.229 36.966 -18.048 246 HG2 ARG 32 2HG ARG 32 -12.095 34.869 -17.984 247 HG3 ARG 32 3HG ARG 32 -11.747 34.908 -19.723 248 HD2 ARG 32 2HD ARG 32 -10.155 36.661 -19.454 249 HD3 ARG 32 3HD ARG 32 -10.665 36.978 -17.778 250 HE ARG 32 HE ARG 32 -9.885 34.359 -17.663 251 HH11 ARG 32 1HH2 ARG 32 -8.064 37.168 -18.832 252 HH12 ARG 32 2HH2 ARG 32 -6.565 36.426 -18.356 253 HH21 ARG 32 2HH1 ARG 32 -8.012 33.516 -17.198 254 HH22 ARG 32 1HH1 ARG 32 -6.516 34.408 -17.442 255 H TYR 33 H TYR 33 -15.196 34.960 -17.182 256 HA TYR 33 HA TYR 33 -17.271 37.053 -17.009 257 HB2 TYR 33 2HB TYR 33 -17.864 34.113 -16.615 258 HB3 TYR 33 3HB TYR 33 -18.919 35.426 -16.184 259 HD1 TYR 33 HD2 TYR 33 -17.252 33.789 -19.111 260 HD2 TYR 33 HD1 TYR 33 -20.438 36.311 -17.710 261 HE1 TYR 33 HE2 TYR 33 -18.383 33.608 -21.322 262 HE2 TYR 33 HE1 TYR 33 -21.537 36.168 -19.937 263 HH TYR 33 HH TYR 33 -21.542 35.206 -21.939 264 H ARG 34 H ARG 34 -17.640 37.738 -14.961 265 HA ARG 34 HA ARG 34 -15.939 36.667 -12.747 266 HB2 ARG 34 2HB ARG 34 -15.511 38.975 -13.623 267 HB3 ARG 34 3HB ARG 34 -17.138 39.443 -13.121 268 HG2 ARG 34 2HG ARG 34 -16.574 38.855 -10.763 269 HG3 ARG 34 3HG ARG 34 -14.949 38.388 -11.257 270 HD2 ARG 34 2HD ARG 34 -16.214 41.139 -11.424 271 HD3 ARG 34 3HD ARG 34 -14.958 40.606 -10.286 272 HE ARG 34 HE ARG 34 -13.690 40.193 -12.654 273 HH11 ARG 34 1HH2 ARG 34 -15.341 43.096 -11.542 274 HH12 ARG 34 2HH2 ARG 34 -14.317 44.113 -12.520 275 HH21 ARG 34 1HH1 ARG 34 -12.485 41.443 -13.745 276 HH22 ARG 34 2HH1 ARG 34 -12.690 43.199 -13.773 277 H THR 35 H THR 35 -16.826 35.826 -11.022 278 HA THR 35 HA THR 35 -19.741 35.504 -10.835 279 HB THR 35 HB THR 35 -19.289 34.009 -8.954 280 HG1 THR 35 HG1 THR 35 -16.584 34.492 -9.421 281 HG21 THR 35 1HG2 THR 35 -19.173 33.013 -11.123 282 HG22 THR 35 2HG2 THR 35 -17.470 33.477 -11.317 283 HG23 THR 35 3HG2 THR 35 -17.931 32.322 -10.050 284 H ASP 36 H ASP 36 -20.558 35.484 -8.397 285 HA ASP 36 HA ASP 36 -20.568 38.248 -7.670 286 HB2 ASP 36 2HB ASP 36 -22.544 36.686 -7.584 287 HB3 ASP 36 3HB ASP 36 -21.791 35.856 -6.222 288 H ASN 37 H ASN 37 -18.476 35.671 -6.622 289 HA ASN 37 HA ASN 37 -17.720 37.230 -4.195 290 HB2 ASN 37 2HB ASN 37 -16.270 34.786 -5.040 291 HB3 ASN 37 3HB ASN 37 -16.449 35.487 -3.470 292 HD21 ASN 37 1HD2 ASN 37 -16.932 32.787 -4.630 293 HD22 ASN 37 2HD2 ASN 37 -18.545 32.366 -4.007 294 H GLY 38 H GLY 38 -17.156 37.699 -7.373 295 HA2 GLY 38 HA2 GLY 38 -15.526 38.913 -8.509 296 HA3 GLY 38 HA3 GLY 38 -14.445 38.844 -7.116 297 H GLU 39 H GLU 39 -15.631 35.721 -7.873 298 HA GLU 39 HA GLU 39 -12.935 34.902 -8.673 299 HB2 GLU 39 2HB GLU 39 -15.327 33.076 -8.847 300 HB3 GLU 39 3HB GLU 39 -13.658 32.701 -8.522 301 HG2 GLU 39 2HG GLU 39 -14.215 34.260 -6.345 302 HG3 GLU 39 3HG GLU 39 -15.856 33.741 -6.788 303 H GLU 40 H GLU 40 -12.230 35.139 -10.715 304 HA GLU 40 HA GLU 40 -14.151 35.401 -12.952 305 HB2 GLU 40 2HB GLU 40 -11.172 35.945 -12.746 306 HB3 GLU 40 3HB GLU 40 -12.151 36.183 -14.207 307 HG2 GLU 40 2HG GLU 40 -13.607 37.746 -13.010 308 HG3 GLU 40 3HG GLU 40 -12.652 37.571 -11.542 309 H PHE 41 H PHE 41 -14.441 33.904 -14.492 310 HA PHE 41 HA PHE 41 -12.462 31.693 -14.924 311 HB2 PHE 41 2HB PHE 41 -15.484 31.514 -14.808 312 HB3 PHE 41 3HB PHE 41 -14.434 30.227 -15.339 313 HD1 PHE 41 HD1 PHE 41 -15.509 32.193 -12.337 314 HD2 PHE 41 HD2 PHE 41 -13.088 28.918 -13.806 315 HE1 PHE 41 HE1 PHE 41 -15.151 31.397 -10.057 316 HE2 PHE 41 HE2 PHE 41 -12.697 28.166 -11.479 317 HZ PHE 41 HZ PHE 41 -13.714 29.417 -9.586 318 H GLU 42 H GLU 42 -12.709 30.585 -16.990 319 HA GLU 42 HA GLU 42 -13.457 32.445 -19.172 320 HB2 GLU 42 2HB GLU 42 -11.535 30.095 -19.403 321 HB3 GLU 42 3HB GLU 42 -11.854 31.415 -20.522 322 HG2 GLU 42 2HG GLU 42 -9.910 32.201 -19.646 323 HG3 GLU 42 3HG GLU 42 -11.089 32.951 -18.570 324 H VAL 43 H VAL 43 -14.926 31.863 -20.589 325 HA VAL 43 HA VAL 43 -15.993 29.069 -20.598 326 HB VAL 43 HB VAL 43 -17.529 31.582 -21.224 327 HG11 VAL 43 1HG1 VAL 43 -18.264 29.521 -22.451 328 HG12 VAL 43 2HG1 VAL 43 -18.454 28.699 -20.890 329 HG13 VAL 43 3HG1 VAL 43 -19.446 30.119 -21.303 330 HG21 VAL 43 3HG2 VAL 43 -17.821 29.771 -18.798 331 HG22 VAL 43 1HG2 VAL 43 -16.973 31.334 -18.756 332 HG23 VAL 43 2HG2 VAL 43 -18.678 31.291 -19.160 333 HA PRO 44 HA PRO 44 -14.504 29.490 -24.914 334 HB2 PRO 44 2HB PRO 44 -14.465 26.820 -25.521 335 HB3 PRO 44 3HB PRO 44 -13.175 27.621 -24.588 336 HG2 PRO 44 2HG PRO 44 -15.474 25.988 -23.527 337 HG3 PRO 44 3HG PRO 44 -13.751 25.943 -23.042 338 HD2 PRO 44 2HD PRO 44 -15.686 27.320 -21.669 339 HD3 PRO 44 3HD PRO 44 -13.989 27.892 -21.712 340 H PHE 45 H PHE 45 -15.896 30.020 -26.460 341 HA PHE 45 HA PHE 45 -18.497 28.529 -26.827 342 HB2 PHE 45 2HB PHE 45 -17.729 31.413 -27.290 343 HB3 PHE 45 3HB PHE 45 -19.095 30.714 -28.094 344 HD1 PHE 45 HD1 PHE 45 -17.693 31.672 -24.798 345 HD2 PHE 45 HD2 PHE 45 -21.187 30.285 -26.904 346 HE1 PHE 45 HE1 PHE 45 -19.106 32.231 -22.840 347 HE2 PHE 45 HE2 PHE 45 -22.590 30.842 -24.931 348 HZ PHE 45 HZ PHE 45 -21.530 31.767 -22.863 349 H ALA 46 H ALA 46 -19.041 27.847 -28.894 350 HA ALA 46 HA ALA 46 -16.791 27.533 -30.782 351 HB1 ALA 46 3HB ALA 46 -18.312 25.986 -31.943 352 HB2 ALA 46 1HB ALA 46 -18.212 25.592 -30.217 353 HB3 ALA 46 2HB ALA 46 -19.640 26.443 -30.853 354 H ASP 47 H ASP 47 -16.994 28.096 -33.053 355 HA ASP 47 HA ASP 47 -17.908 30.704 -33.622 356 HB2 ASP 47 2HB ASP 47 -16.134 29.482 -34.818 357 HB3 ASP 47 3HB ASP 47 -17.333 28.389 -35.510 358 H ASP 48 H ASP 48 -19.777 27.781 -33.606 359 HA ASP 48 HA ASP 48 -22.007 28.735 -35.243 360 HB2 ASP 48 2HB ASP 48 -21.345 26.339 -34.922 361 HB3 ASP 48 3HB ASP 48 -21.834 26.464 -33.235 362 H ALA 49 H ALA 49 -20.932 29.468 -32.109 363 HA ALA 49 HA ALA 49 -23.618 30.322 -31.110 364 HB1 ALA 49 3HB ALA 49 -22.615 28.394 -29.894 365 HB2 ALA 49 1HB ALA 49 -21.187 29.393 -29.527 366 HB3 ALA 49 2HB ALA 49 -22.777 29.832 -28.872 367 H GLU 50 H GLU 50 -23.353 32.017 -29.332 368 HA GLU 50 HA GLU 50 -21.223 34.020 -29.823 369 HB2 GLU 50 2HB GLU 50 -22.785 35.833 -29.923 370 HB3 GLU 50 3HB GLU 50 -23.191 34.659 -31.175 371 HG2 GLU 50 2HG GLU 50 -25.017 33.760 -29.704 372 HG3 GLU 50 3HG GLU 50 -24.631 34.996 -28.504 373 H ILE 51 H ILE 51 -21.228 35.706 -28.064 374 HA ILE 51 HA ILE 51 -21.285 34.428 -25.448 375 HB ILE 51 HB ILE 51 -20.299 37.212 -26.059 376 HG12 ILE 51 2HG1 ILE 51 -19.207 35.779 -27.697 377 HG13 ILE 51 3HG1 ILE 51 -18.068 36.380 -26.491 378 HG21 ILE 51 1HG2 ILE 51 -18.845 36.831 -24.125 379 HG22 ILE 51 2HG2 ILE 51 -20.528 36.564 -23.656 380 HG23 ILE 51 3HG2 ILE 51 -19.456 35.188 -23.948 381 HD11 ILE 51 3HD1 ILE 51 -17.581 34.073 -27.070 382 HD12 ILE 51 1HD1 ILE 51 -18.145 34.117 -25.398 383 HD13 ILE 51 2HD1 ILE 51 -19.242 33.581 -26.692 384 HA PRO 52 HA PRO 52 -25.025 36.901 -24.484 385 HB2 PRO 52 2HB PRO 52 -25.757 35.427 -22.297 386 HB3 PRO 52 3HB PRO 52 -26.141 34.941 -23.979 387 HG2 PRO 52 2HG PRO 52 -23.901 33.987 -22.188 388 HG3 PRO 52 3HG PRO 52 -24.974 33.018 -23.259 389 HD2 PRO 52 2HD PRO 52 -22.421 33.830 -23.941 390 HD3 PRO 52 3HD PRO 52 -23.695 33.585 -25.152 391 H GLY 53 H GLY 53 -25.300 38.429 -22.881 392 HA2 GLY 53 HA2 GLY 53 -23.203 39.736 -21.685 393 HA3 GLY 53 HA3 GLY 53 -24.872 39.850 -21.121 394 H THR 54 H THR 54 -24.970 37.013 -20.175 395 HA THR 54 HA THR 54 -22.758 36.845 -18.262 396 HB THR 54 HB THR 54 -24.344 36.255 -16.392 397 HG1 THR 54 HG1 THR 54 -26.572 36.621 -16.706 398 HG21 THR 54 1HG2 THR 54 -23.773 38.681 -16.654 399 HG22 THR 54 2HG2 THR 54 -25.279 38.911 -17.546 400 HG23 THR 54 3HG2 THR 54 -25.310 38.387 -15.847 401 H TRP 55 H TRP 55 -22.568 34.709 -17.201 402 HA TRP 55 HA TRP 55 -23.953 32.406 -18.359 403 HB2 TRP 55 2HB TRP 55 -22.224 33.101 -20.083 404 HB3 TRP 55 3HB TRP 55 -20.986 32.766 -18.883 405 HD1 TRP 55 HD1 TRP 55 -20.414 30.271 -18.404 406 HE1 TRP 55 HE1 TRP 55 -20.761 28.121 -19.712 407 HE3 TRP 55 HE3 TRP 55 -24.161 31.851 -21.463 408 HZ2 TRP 55 HZ2 TRP 55 -22.576 27.136 -21.771 409 HZ3 TRP 55 HZ3 TRP 55 -25.205 30.286 -23.105 410 HH2 TRP 55 HH2 TRP 55 -24.413 27.936 -23.268 411 H LEU 56 H LEU 56 -23.556 30.454 -17.181 412 HA LEU 56 HA LEU 56 -22.776 30.826 -14.438 413 HB2 LEU 56 2HB LEU 56 -24.394 29.062 -15.848 414 HB3 LEU 56 3HB LEU 56 -23.010 28.056 -15.418 415 HG LEU 56 HG LEU 56 -24.586 29.721 -13.414 416 HD11 LEU 56 1HD1 LEU 56 -25.672 27.603 -12.766 417 HD12 LEU 56 2HD1 LEU 56 -26.037 28.016 -14.449 418 HD13 LEU 56 3HD1 LEU 56 -24.834 26.757 -14.088 419 HD21 LEU 56 3HD2 LEU 56 -23.562 28.175 -11.763 420 HD22 LEU 56 1HD2 LEU 56 -22.622 27.408 -13.065 421 HD23 LEU 56 2HD2 LEU 56 -22.331 29.100 -12.629 422 H CYS 57 H CYS 57 -20.877 30.579 -13.480 423 HA CYS 57 HA CYS 57 -18.516 29.766 -15.082 424 HB2 CYS 57 2HB CYS 57 -18.884 31.294 -12.484 425 HB3 CYS 57 3HB CYS 57 -17.301 30.790 -13.086 426 HG CYS 57 HG CYS 57 -19.568 32.431 -14.840 427 H ARG 58 H ARG 58 -16.766 28.627 -13.966 428 HA ARG 58 HA ARG 58 -17.692 26.040 -13.235 429 HB2 ARG 58 2HB ARG 58 -14.836 27.005 -12.878 430 HB3 ARG 58 3HB ARG 58 -15.397 25.373 -13.223 431 HG2 ARG 58 2HG ARG 58 -16.169 26.166 -15.495 432 HG3 ARG 58 3HG ARG 58 -15.481 27.760 -15.126 433 HD2 ARG 58 2HD ARG 58 -13.254 26.589 -14.727 434 HD3 ARG 58 3HD ARG 58 -13.999 25.135 -15.422 435 HE ARG 58 HE ARG 58 -14.327 27.468 -17.136 436 HH11 ARG 58 1HH1 ARG 58 -11.966 25.000 -16.340 437 HH12 ARG 58 2HH1 ARG 58 -11.108 25.223 -17.840 438 HH21 ARG 58 1HH2 ARG 58 -13.164 27.765 -18.939 439 HH22 ARG 58 2HH2 ARG 58 -11.784 26.745 -19.296 440 H ASN 59 H ASN 59 -17.036 28.716 -11.202 441 HA ASN 59 HA ASN 59 -16.653 27.356 -8.708 442 HB2 ASN 59 2HB ASN 59 -16.090 29.670 -9.064 443 HB3 ASN 59 3HB ASN 59 -17.763 30.082 -9.463 444 HD21 ASN 59 1HD2 ASN 59 -17.787 31.733 -7.880 445 HD22 ASN 59 2HD2 ASN 59 -17.731 31.355 -6.173 446 H GLY 60 H GLY 60 -19.446 27.681 -10.726 447 HA2 GLY 60 HA2 GLY 60 -21.554 26.672 -10.434 448 HA3 GLY 60 HA3 GLY 60 -21.293 26.542 -8.693 449 H MET 61 H MET 61 -20.488 29.641 -10.005 450 HA MET 61 HA MET 61 -23.071 30.819 -9.106 451 HB2 MET 61 2HB MET 61 -21.026 31.271 -7.697 452 HB3 MET 61 3HB MET 61 -20.296 32.066 -9.067 453 HG2 MET 61 2HG MET 61 -21.296 33.671 -7.496 454 HG3 MET 61 3HG MET 61 -22.008 33.777 -9.100 455 HE1 MET 61 3HE MET 61 -24.109 32.177 -5.292 456 HE2 MET 61 1HE MET 61 -22.748 31.302 -6.022 457 HE3 MET 61 2HE MET 61 -22.500 32.929 -5.342 458 H GLU 62 H GLU 62 -23.963 32.493 -10.329 459 HA GLU 62 HA GLU 62 -23.515 32.460 -13.192 460 HB2 GLU 62 2HB GLU 62 -25.196 34.261 -11.414 461 HB3 GLU 62 3HB GLU 62 -25.152 34.345 -13.183 462 HG2 GLU 62 2HG GLU 62 -25.900 31.981 -13.322 463 HG3 GLU 62 3HG GLU 62 -25.985 31.899 -11.561 464 H GLY 63 H GLY 63 -21.777 33.295 -14.109 465 HA2 GLY 63 HA2 GLY 63 -20.336 35.571 -12.954 466 HA3 GLY 63 HA3 GLY 63 -19.801 34.604 -14.305 467 H THR 64 H THR 64 -20.044 37.561 -14.024 468 HA THR 64 HA THR 64 -21.789 38.073 -16.396 469 HB THR 64 HB THR 64 -20.622 40.064 -14.415 470 HG1 THR 64 HG1 THR 64 -22.297 38.849 -13.531 471 HG21 THR 64 1HG2 THR 64 -20.934 41.236 -16.496 472 HG22 THR 64 2HG2 THR 64 -22.501 40.458 -16.790 473 HG23 THR 64 3HG2 THR 64 -22.317 41.640 -15.474 474 H LEU 65 H LEU 65 -21.012 38.928 -18.244 475 HA LEU 65 HA LEU 65 -18.396 38.227 -19.010 476 HB2 LEU 65 2HB LEU 65 -20.531 38.353 -20.326 477 HB3 LEU 65 3HB LEU 65 -20.382 40.090 -20.349 478 HG LEU 65 HG LEU 65 -18.736 37.950 -21.746 479 HD11 LEU 65 1HD1 LEU 65 -20.874 38.738 -22.741 480 HD12 LEU 65 2HD1 LEU 65 -20.252 40.400 -22.752 481 HD13 LEU 65 3HD1 LEU 65 -19.485 39.156 -23.758 482 HD21 LEU 65 3HD2 LEU 65 -17.996 40.897 -21.592 483 HD22 LEU 65 1HD2 LEU 65 -16.997 39.482 -21.143 484 HD23 LEU 65 2HD2 LEU 65 -17.397 39.766 -22.828 485 H ILE 66 H ILE 66 -16.515 39.212 -18.673 486 HA ILE 66 HA ILE 66 -16.314 42.182 -18.605 487 HB ILE 66 HB ILE 66 -14.554 42.148 -17.006 488 HG12 ILE 66 2HG1 ILE 66 -13.436 40.042 -17.312 489 HG13 ILE 66 3HG1 ILE 66 -13.922 40.209 -15.631 490 HG21 ILE 66 1HG2 ILE 66 -16.972 40.694 -15.896 491 HG22 ILE 66 2HG2 ILE 66 -15.793 41.637 -14.973 492 HG23 ILE 66 3HG2 ILE 66 -16.818 42.435 -16.180 493 HD11 ILE 66 3HD1 ILE 66 -15.102 38.421 -17.680 494 HD12 ILE 66 1HD1 ILE 66 -14.298 37.980 -16.166 495 HD13 ILE 66 2HD1 ILE 66 -15.901 38.744 -16.133 496 H GLU 67 H GLU 67 -14.292 43.058 -19.360 497 HA GLU 67 HA GLU 67 -13.286 41.813 -21.739 498 HB2 GLU 67 2HB GLU 67 -12.157 44.084 -20.054 499 HB3 GLU 67 3HB GLU 67 -11.533 43.587 -21.634 500 HG2 GLU 67 2HG GLU 67 -13.756 44.050 -22.656 501 HG3 GLU 67 3HG GLU 67 -14.359 44.602 -21.092 502 H GLY 68 H GLY 68 -11.881 40.212 -21.987 503 HA2 GLY 68 HA2 GLY 68 -10.953 38.816 -19.703 504 HA3 GLY 68 HA3 GLY 68 -10.659 38.377 -21.388 505 H ASP 69 H ASP 69 -9.276 41.162 -21.548 506 HA ASP 69 HA ASP 69 -7.226 41.974 -21.718 507 HB2 ASP 69 2HB ASP 69 -7.321 42.105 -19.281 508 HB3 ASP 69 3HB ASP 69 -6.561 40.518 -19.152 509 H LEU 70 H LEU 70 -5.447 41.701 -22.877 510 HA LEU 70 HA LEU 70 -4.320 38.984 -23.297 511 HB2 LEU 70 2HB LEU 70 -5.279 40.953 -25.368 512 HB3 LEU 70 3HB LEU 70 -4.022 39.785 -25.754 513 HG LEU 70 HG LEU 70 -6.774 38.975 -24.735 514 HD11 LEU 70 1HD1 LEU 70 -5.689 39.055 -27.584 515 HD12 LEU 70 2HD1 LEU 70 -7.267 38.416 -27.075 516 HD13 LEU 70 3HD1 LEU 70 -6.926 40.145 -26.914 517 HD21 LEU 70 3HD2 LEU 70 -4.494 37.439 -26.077 518 HD22 LEU 70 1HD2 LEU 70 -5.040 37.246 -24.395 519 HD23 LEU 70 2HD2 LEU 70 -6.105 36.775 -25.720 520 HA PRO 71 HA PRO 71 -0.450 41.364 -23.177 521 HB2 PRO 71 2HB PRO 71 1.327 39.336 -23.400 522 HB3 PRO 71 3HB PRO 71 0.382 39.600 -21.902 523 HG2 PRO 71 2HG PRO 71 -0.179 37.632 -24.138 524 HG3 PRO 71 3HG PRO 71 -0.186 37.336 -22.374 525 HD2 PRO 71 2HD PRO 71 -2.464 37.873 -23.843 526 HD3 PRO 71 3HD PRO 71 -2.290 38.318 -22.120 527 H GLU 72 H GLU 72 -1.589 39.159 -25.677 528 HA GLU 72 HA GLU 72 -0.111 40.674 -27.766 529 HB2 GLU 72 2HB GLU 72 0.301 38.575 -28.933 530 HB3 GLU 72 3HB GLU 72 1.049 38.653 -27.341 531 HG2 GLU 72 2HG GLU 72 -0.710 37.184 -26.401 532 HG3 GLU 72 3HG GLU 72 -1.478 37.069 -27.975 533 HA PRO 73 HA PRO 73 -4.732 40.862 -28.856 534 HB2 PRO 73 2HB PRO 73 -3.605 43.631 -29.334 535 HB3 PRO 73 3HB PRO 73 -5.278 43.158 -28.902 536 HG2 PRO 73 2HG PRO 73 -3.560 44.088 -27.018 537 HG3 PRO 73 3HG PRO 73 -4.655 42.721 -26.658 538 HD2 PRO 73 2HD PRO 73 -1.706 42.657 -27.258 539 HD3 PRO 73 3HD PRO 73 -2.686 41.645 -26.158 540 H LYS 74 H LYS 74 -5.404 40.667 -30.923 541 HA LYS 74 HA LYS 74 -3.529 40.191 -33.062 542 HB2 LYS 74 2HB LYS 74 -5.619 38.922 -32.718 543 HB3 LYS 74 3HB LYS 74 -6.574 40.369 -33.066 544 HG2 LYS 74 2HG LYS 74 -5.714 40.406 -35.380 545 HG3 LYS 74 3HG LYS 74 -4.672 39.009 -35.032 546 HD2 LYS 74 2HD LYS 74 -6.674 37.628 -34.577 547 HD3 LYS 74 3HD LYS 74 -7.722 39.032 -34.875 548 HE2 LYS 74 2HE LYS 74 -6.873 39.182 -37.198 549 HE3 LYS 74 3HE LYS 74 -5.814 37.792 -36.910 550 HZ1 LYS 74 HZ1 LYS 74 -7.811 36.442 -36.520 551 HZ2 LYS 74 HZ2 LYS 74 -8.786 37.727 -36.792 552 HZ3 LYS 74 HZ3 LYS 74 -7.877 37.119 -38.003 553 H LYS 75 H LYS 75 -3.055 41.315 -34.867 554 HA LYS 75 HA LYS 75 -4.055 44.128 -35.197 555 HB2 LYS 75 2HB LYS 75 -1.157 43.207 -35.370 556 HB3 LYS 75 3HB LYS 75 -1.753 44.857 -35.616 557 HG2 LYS 75 2HG LYS 75 -2.531 44.941 -33.263 558 HG3 LYS 75 3HG LYS 75 -1.945 43.289 -33.019 559 HD2 LYS 75 2HD LYS 75 0.381 44.061 -33.591 560 HD3 LYS 75 3HD LYS 75 -0.245 45.715 -33.661 561 HE2 LYS 75 2HE LYS 75 0.700 45.425 -31.482 562 HE3 LYS 75 3HE LYS 75 -1.055 45.467 -31.289 563 HZ1 LYS 75 HZ1 LYS 75 -1.019 43.014 -31.130 564 HZ2 LYS 75 HZ2 LYS 75 0.606 42.996 -31.339 565 HZ3 LYS 75 HZ3 LYS 75 -0.034 43.668 -29.999 566 H VAL 76 H VAL 76 -5.111 42.027 -36.589 567 HA VAL 76 HA VAL 76 -4.375 42.614 -39.410 568 HB VAL 76 HB VAL 76 -4.740 39.782 -38.334 569 HG11 VAL 76 1HG1 VAL 76 -5.606 39.983 -40.629 570 HG12 VAL 76 2HG1 VAL 76 -4.106 40.791 -41.146 571 HG13 VAL 76 3HG1 VAL 76 -4.090 39.091 -40.635 572 HG21 VAL 76 3HG2 VAL 76 -2.388 39.415 -39.060 573 HG22 VAL 76 1HG2 VAL 76 -2.232 41.154 -39.393 574 HG23 VAL 76 2HG2 VAL 76 -2.502 40.569 -37.734 575 H LYS 77 H LYS 77 -6.126 42.769 -40.718 576 HA LYS 77 HA LYS 77 -8.807 41.865 -39.794 577 HB2 LYS 77 2HB LYS 77 -8.116 44.640 -40.847 578 HB3 LYS 77 3HB LYS 77 -9.761 44.025 -40.656 579 HG2 LYS 77 2HG LYS 77 -9.319 43.671 -38.211 580 HG3 LYS 77 3HG LYS 77 -7.748 44.460 -38.405 581 HD2 LYS 77 2HD LYS 77 -10.458 45.738 -38.981 582 HD3 LYS 77 3HD LYS 77 -9.492 45.977 -37.518 583 HE2 LYS 77 2HE LYS 77 -7.639 46.917 -38.897 584 HE3 LYS 77 3HE LYS 77 -8.630 46.725 -40.349 585 HZ1 LYS 77 HZ1 LYS 77 -10.249 48.263 -39.372 586 HZ2 LYS 77 HZ2 LYS 77 -9.331 48.446 -38.030 587 HZ3 LYS 77 HZ3 LYS 77 -8.787 48.980 -39.472 588 HA PRO 78 HA PRO 78 -9.332 40.389 -43.920 589 HB2 PRO 78 2HB PRO 78 -12.093 41.605 -43.909 590 HB3 PRO 78 3HB PRO 78 -11.598 39.940 -44.347 591 HG2 PRO 78 2HG PRO 78 -12.717 40.426 -41.934 592 HG3 PRO 78 3HG PRO 78 -11.277 39.358 -42.043 593 HD2 PRO 78 2HD PRO 78 -11.379 42.300 -41.305 594 HD3 PRO 78 3HD PRO 78 -10.536 40.953 -40.481 595 HA PRO 79 HA PRO 79 -8.500 43.601 -46.846 596 HB2 PRO 79 2HB PRO 79 -10.131 42.105 -48.896 597 HB3 PRO 79 3HB PRO 79 -8.455 42.723 -49.018 598 HG2 PRO 79 2HG PRO 79 -8.893 40.093 -48.582 599 HG3 PRO 79 3HG PRO 79 -7.627 40.948 -47.636 600 HD2 PRO 79 2HD PRO 79 -10.474 40.300 -46.803 601 HD3 PRO 79 3HD PRO 79 -8.945 40.039 -45.914 602 H ARG 80 H ARG 80 -11.891 42.786 -46.472 603 HA ARG 80 HA ARG 80 -12.740 45.573 -46.988 604 HB2 ARG 80 2HB ARG 80 -13.001 44.335 -49.140 605 HB3 ARG 80 3HB ARG 80 -14.049 43.163 -48.327 606 HG2 ARG 80 2HG ARG 80 -15.678 44.965 -47.818 607 HG3 ARG 80 3HG ARG 80 -14.599 46.159 -48.572 608 HD2 ARG 80 2HD ARG 80 -14.795 44.967 -50.732 609 HD3 ARG 80 3HD ARG 80 -15.866 43.769 -49.975 610 HE ARG 80 HE ARG 80 -16.955 46.355 -49.522 611 HH11 ARG 80 1HH1 ARG 80 -16.491 44.192 -52.237 612 HH12 ARG 80 2HH1 ARG 80 -17.851 44.850 -53.109 613 HH21 ARG 80 1HH2 ARG 80 -18.671 47.143 -50.684 614 HH22 ARG 80 2HH2 ARG 80 -19.048 46.475 -52.247 Start of MODEL 9 1 H1 SER 1 1H SER 1 -9.905 25.405 2.644 2 H2 SER 1 2H SER 1 -11.052 26.316 1.900 3 H3 SER 1 3H SER 1 -10.361 26.839 3.291 4 HA SER 1 HA SER 1 -8.956 26.454 0.737 5 HB2 SER 1 2HB SER 1 -9.782 29.071 2.055 6 HB3 SER 1 3HB SER 1 -8.882 28.881 0.534 7 HG SER 1 HG SER 1 -11.130 29.179 0.174 8 H MET 2 H MET 2 -6.751 27.161 0.697 9 HA MET 2 HA MET 2 -5.367 26.523 3.157 10 HB2 MET 2 2HB MET 2 -3.371 26.575 1.783 11 HB3 MET 2 3HB MET 2 -4.635 25.614 1.030 12 HG2 MET 2 2HG MET 2 -4.292 28.528 0.243 13 HG3 MET 2 3HG MET 2 -3.177 27.310 -0.357 14 HE1 MET 2 3HE MET 2 -3.713 28.028 -2.809 15 HE2 MET 2 1HE MET 2 -5.348 28.054 -3.503 16 HE3 MET 2 2HE MET 2 -4.903 29.216 -2.234 17 H ALA 3 H ALA 3 -6.333 29.556 1.900 18 HA ALA 3 HA ALA 3 -5.865 31.706 2.367 19 HB1 ALA 3 3HB ALA 3 -5.760 32.245 4.730 20 HB2 ALA 3 1HB ALA 3 -6.868 30.888 4.460 21 HB3 ALA 3 2HB ALA 3 -5.242 30.591 5.118 22 H ASP 4 H ASP 4 -3.657 30.455 1.106 23 HA ASP 4 HA ASP 4 -1.209 31.417 2.399 24 HB2 ASP 4 2HB ASP 4 -0.035 30.141 0.833 25 HB3 ASP 4 3HB ASP 4 -1.416 29.169 1.325 26 H ARG 5 H ARG 5 -3.414 32.953 0.489 27 HA ARG 5 HA ARG 5 -3.478 34.880 -0.740 28 HB2 ARG 5 2HB ARG 5 -1.060 35.558 0.942 29 HB3 ARG 5 3HB ARG 5 -2.099 36.708 0.089 30 HG2 ARG 5 2HG ARG 5 -4.039 36.003 1.488 31 HG3 ARG 5 3HG ARG 5 -2.987 34.888 2.370 32 HD2 ARG 5 2HD ARG 5 -3.252 36.865 3.689 33 HD3 ARG 5 3HD ARG 5 -1.589 36.789 3.130 34 HE ARG 5 HE ARG 5 -3.749 38.621 2.137 35 HH11 ARG 5 1HH2 ARG 5 -0.302 37.969 2.251 36 HH12 ARG 5 2HH2 ARG 5 0.097 39.519 1.564 37 HH21 ARG 5 1HH1 ARG 5 -3.161 40.566 1.269 38 HH22 ARG 5 2HH1 ARG 5 -1.482 40.944 1.028 39 H VAL 6 H VAL 6 -2.148 32.839 -2.112 40 HA VAL 6 HA VAL 6 0.082 33.978 -3.568 41 HB VAL 6 HB VAL 6 -0.165 31.553 -3.067 42 HG11 VAL 6 1HG1 VAL 6 -2.090 31.469 -5.431 43 HG12 VAL 6 2HG1 VAL 6 -1.476 30.104 -4.481 44 HG13 VAL 6 3HG1 VAL 6 -2.575 31.273 -3.733 45 HG21 VAL 6 3HG2 VAL 6 1.442 32.416 -4.730 46 HG22 VAL 6 1HG2 VAL 6 0.842 30.801 -5.135 47 HG23 VAL 6 2HG2 VAL 6 0.223 32.208 -6.012 48 H LEU 7 H LEU 7 0.151 34.865 -5.461 49 HA LEU 7 HA LEU 7 -2.323 36.100 -6.474 50 HB2 LEU 7 2HB LEU 7 0.591 36.701 -7.091 51 HB3 LEU 7 3HB LEU 7 -0.789 37.687 -7.561 52 HG LEU 7 HG LEU 7 0.142 37.179 -4.701 53 HD11 LEU 7 1HD1 LEU 7 1.603 38.676 -6.009 54 HD12 LEU 7 2HD1 LEU 7 0.202 39.686 -6.431 55 HD13 LEU 7 3HD1 LEU 7 0.737 39.556 -4.740 56 HD21 LEU 7 3HD2 LEU 7 -1.506 38.940 -4.085 57 HD22 LEU 7 1HD2 LEU 7 -2.137 38.918 -5.748 58 HD23 LEU 7 2HD2 LEU 7 -2.291 37.486 -4.702 59 H ARG 8 H ARG 8 -0.681 33.388 -7.458 60 HA ARG 8 HA ARG 8 -1.752 33.540 -10.241 61 HB2 ARG 8 2HB ARG 8 1.046 32.602 -9.461 62 HB3 ARG 8 3HB ARG 8 0.306 32.376 -11.050 63 HG2 ARG 8 2HG ARG 8 0.121 34.846 -11.318 64 HG3 ARG 8 3HG ARG 8 0.934 35.065 -9.753 65 HD2 ARG 8 2HD ARG 8 2.914 33.858 -10.602 66 HD3 ARG 8 3HD ARG 8 2.113 33.646 -12.174 67 HE ARG 8 HE ARG 8 2.086 36.412 -11.589 68 HH11 ARG 8 1HH2 ARG 8 4.526 34.002 -12.308 69 HH12 ARG 8 2HH2 ARG 8 5.621 35.179 -12.982 70 HH21 ARG 8 1HH1 ARG 8 3.529 37.861 -12.462 71 HH22 ARG 8 2HH1 ARG 8 5.063 37.306 -13.066 72 H GLY 9 H GLY 9 -2.340 31.599 -11.168 73 HA2 GLY 9 HA2 GLY 9 -3.195 29.462 -9.359 74 HA3 GLY 9 HA3 GLY 9 -3.472 29.561 -11.094 75 H SER 10 H SER 10 -2.915 27.155 -10.093 76 HA SER 10 HA SER 10 -0.357 26.434 -11.371 77 HB2 SER 10 2HB SER 10 0.437 25.114 -9.511 78 HB3 SER 10 3HB SER 10 0.183 26.773 -8.956 79 HG SER 10 HG SER 10 -0.691 25.337 -7.455 80 H ARG 11 H ARG 11 -0.154 23.987 -11.502 81 HA ARG 11 HA ARG 11 -2.711 22.490 -11.317 82 HB2 ARG 11 2HB ARG 11 -1.009 22.661 -13.819 83 HB3 ARG 11 3HB ARG 11 -2.137 21.346 -13.522 84 HG2 ARG 11 2HG ARG 11 -2.961 24.283 -13.630 85 HG3 ARG 11 3HG ARG 11 -3.041 23.158 -14.982 86 HD2 ARG 11 2HD ARG 11 -4.549 21.669 -13.743 87 HD3 ARG 11 3HD ARG 11 -4.510 22.735 -12.341 88 HE ARG 11 HE ARG 11 -6.129 23.039 -14.711 89 HH11 ARG 11 1HH2 ARG 11 -4.657 25.022 -12.165 90 HH12 ARG 11 2HH2 ARG 11 -5.924 26.210 -12.328 91 HH21 ARG 11 1HH1 ARG 11 -7.607 24.464 -14.785 92 HH22 ARG 11 2HH1 ARG 11 -7.569 25.937 -13.815 93 H LEU 12 H LEU 12 -0.616 20.225 -9.624 94 HA LEU 12 HA LEU 12 -2.096 22.738 -9.149 95 HB2 LEU 12 2HB LEU 12 -3.661 20.906 -10.050 96 HB3 LEU 12 3HB LEU 12 -3.320 20.008 -8.580 97 HG LEU 12 HG LEU 12 -4.400 21.813 -7.235 98 HD11 LEU 12 1HD1 LEU 12 -5.681 23.593 -8.388 99 HD12 LEU 12 2HD1 LEU 12 -3.946 23.793 -8.618 100 HD13 LEU 12 3HD1 LEU 12 -4.942 23.125 -9.933 101 HD21 LEU 12 3HD2 LEU 12 -6.116 20.922 -9.578 102 HD22 LEU 12 1HD2 LEU 12 -5.739 19.939 -8.143 103 HD23 LEU 12 2HD2 LEU 12 -6.679 21.430 -7.973 104 H GLY 13 H GLY 13 0.481 21.730 -8.282 105 HA2 GLY 13 HA2 GLY 13 1.775 21.577 -6.349 106 HA3 GLY 13 HA3 GLY 13 0.328 21.772 -5.354 107 H ALA 14 H ALA 14 -1.280 19.764 -5.924 108 HA ALA 14 HA ALA 14 0.052 17.194 -5.389 109 HB1 ALA 14 3HB ALA 14 -2.866 17.904 -5.922 110 HB2 ALA 14 1HB ALA 14 -2.256 16.331 -5.365 111 HB3 ALA 14 2HB ALA 14 -2.106 17.755 -4.321 112 H VAL 15 H VAL 15 -0.235 15.351 -6.789 113 HA VAL 15 HA VAL 15 0.262 16.009 -9.591 114 HB VAL 15 HB VAL 15 1.671 14.478 -8.240 115 HG11 VAL 15 1HG1 VAL 15 1.013 12.160 -7.875 116 HG12 VAL 15 2HG1 VAL 15 -0.095 13.242 -7.024 117 HG13 VAL 15 3HG1 VAL 15 -0.598 12.471 -8.545 118 HG21 VAL 15 3HG2 VAL 15 2.187 12.906 -9.955 119 HG22 VAL 15 1HG2 VAL 15 0.593 13.081 -10.705 120 HG23 VAL 15 2HG2 VAL 15 1.742 14.440 -10.721 121 H SER 16 H SER 16 -2.531 15.293 -7.956 122 HA SER 16 HA SER 16 -3.906 14.096 -10.330 123 HB2 SER 16 2HB SER 16 -3.975 12.729 -8.348 124 HB3 SER 16 3HB SER 16 -4.516 14.109 -7.379 125 HG SER 16 HG SER 16 -6.257 12.694 -8.037 126 H TYR 17 H TYR 17 -4.962 15.494 -11.519 127 HA TYR 17 HA TYR 17 -6.767 17.532 -10.515 128 HB2 TYR 17 2HB TYR 17 -5.581 19.451 -11.526 129 HB3 TYR 17 3HB TYR 17 -4.696 18.735 -10.210 130 HD1 TYR 17 HD2 TYR 17 -4.727 19.288 -13.870 131 HD2 TYR 17 HD1 TYR 17 -2.537 17.663 -10.527 132 HE1 TYR 17 HE2 TYR 17 -2.686 19.126 -15.283 133 HE2 TYR 17 HE1 TYR 17 -0.501 17.496 -11.943 134 HH TYR 17 HH TYR 17 0.414 17.854 -14.019 135 H GLU 18 H GLU 18 -7.201 19.023 -12.714 136 HA GLU 18 HA GLU 18 -8.276 17.305 -14.792 137 HB2 GLU 18 2HB GLU 18 -8.730 19.496 -15.928 138 HB3 GLU 18 3HB GLU 18 -9.467 19.288 -14.345 139 HG2 GLU 18 2HG GLU 18 -8.018 20.828 -13.295 140 HG3 GLU 18 3HG GLU 18 -6.820 20.752 -14.576 141 H THR 19 H THR 19 -6.160 16.135 -15.125 142 HA THR 19 HA THR 19 -3.924 17.369 -16.385 143 HB THR 19 HB THR 19 -3.295 15.010 -17.016 144 HG1 THR 19 HG1 THR 19 -4.613 13.370 -16.214 145 HG21 THR 19 1HG2 THR 19 -3.001 14.204 -14.707 146 HG22 THR 19 2HG2 THR 19 -2.609 15.922 -14.848 147 HG23 THR 19 3HG2 THR 19 -4.149 15.426 -14.118 148 H ASP 20 H ASP 20 -6.925 16.759 -17.753 149 HA ASP 20 HA ASP 20 -6.113 16.376 -20.523 150 HB2 ASP 20 2HB ASP 20 -8.496 16.424 -20.979 151 HB3 ASP 20 3HB ASP 20 -8.110 15.313 -19.678 152 H ARG 21 H ARG 21 -4.761 18.551 -19.619 153 HA ARG 21 HA ARG 21 -6.046 21.096 -20.237 154 HB2 ARG 21 2HB ARG 21 -3.099 20.379 -19.986 155 HB3 ARG 21 3HB ARG 21 -3.738 22.013 -20.035 156 HG2 ARG 21 2HG ARG 21 -4.360 19.963 -17.856 157 HG3 ARG 21 3HG ARG 21 -3.107 21.180 -17.750 158 HD2 ARG 21 2HD ARG 21 -6.078 21.772 -18.011 159 HD3 ARG 21 3HD ARG 21 -5.131 21.854 -16.522 160 HE ARG 21 HE ARG 21 -3.730 23.523 -18.179 161 HH11 ARG 21 1HH2 ARG 21 -7.085 23.600 -17.095 162 HH12 ARG 21 2HH2 ARG 21 -7.297 25.230 -17.686 163 HH21 ARG 21 2HH1 ARG 21 -4.061 25.633 -18.741 164 HH22 ARG 21 1HH1 ARG 21 -5.611 26.373 -18.473 165 H ASN 22 H ASN 22 -4.518 18.719 -22.231 166 HA ASN 22 HA ASN 22 -3.693 20.478 -24.370 167 HB2 ASN 22 2HB ASN 22 -2.731 18.197 -23.816 168 HB3 ASN 22 3HB ASN 22 -4.212 17.477 -24.452 169 HD21 ASN 22 1HD2 ASN 22 -2.702 16.361 -25.954 170 HD22 ASN 22 2HD2 ASN 22 -2.151 17.241 -27.374 171 H HIS 23 H HIS 23 -4.595 20.673 -26.481 172 HA HIS 23 HA HIS 23 -7.406 19.943 -26.973 173 HB2 HIS 23 2HB HIS 23 -8.143 22.255 -27.286 174 HB3 HIS 23 3HB HIS 23 -7.619 21.995 -25.631 175 HD2 HIS 23 HD2 HIS 23 -5.429 23.304 -24.787 176 HE1 HIS 23 HE1 HIS 23 -4.849 25.724 -28.252 177 HE2 HIS 23 HE2 HIS 23 -4.136 25.348 -25.837 178 H ASP 24 H ASP 24 -8.144 20.549 -29.112 179 HA ASP 24 HA ASP 24 -5.984 20.853 -31.135 180 HB2 ASP 24 2HB ASP 24 -7.802 18.971 -31.191 181 HB3 ASP 24 3HB ASP 24 -8.849 20.231 -31.838 182 H LEU 25 H LEU 25 -6.579 22.203 -33.006 183 HA LEU 25 HA LEU 25 -7.383 24.896 -32.010 184 HB2 LEU 25 2HB LEU 25 -5.885 24.083 -34.519 185 HB3 LEU 25 3HB LEU 25 -6.218 25.736 -34.000 186 HG LEU 25 HG LEU 25 -4.470 23.716 -32.520 187 HD11 LEU 25 1HD1 LEU 25 -3.477 24.590 -34.601 188 HD12 LEU 25 2HD1 LEU 25 -3.758 26.255 -34.044 189 HD13 LEU 25 3HD1 LEU 25 -2.627 25.196 -33.171 190 HD21 LEU 25 3HD2 LEU 25 -3.799 25.660 -31.112 191 HD22 LEU 25 1HD2 LEU 25 -5.072 26.637 -31.878 192 HD23 LEU 25 2HD2 LEU 25 -5.491 25.222 -30.883 193 H ALA 26 H ALA 26 -9.574 24.587 -31.963 194 HA ALA 26 HA ALA 26 -11.049 24.291 -34.525 195 HB1 ALA 26 3HB ALA 26 -11.655 22.803 -32.662 196 HB2 ALA 26 1HB ALA 26 -11.988 24.211 -31.627 197 HB3 ALA 26 2HB ALA 26 -12.995 23.896 -33.052 198 HA PRO 27 HA PRO 27 -12.073 28.649 -34.575 199 HB2 PRO 27 2HB PRO 27 -14.435 28.726 -35.932 200 HB3 PRO 27 3HB PRO 27 -12.884 28.277 -36.697 201 HG2 PRO 27 2HG PRO 27 -15.027 26.408 -35.632 202 HG3 PRO 27 3HG PRO 27 -14.200 26.356 -37.221 203 HD2 PRO 27 2HD PRO 27 -13.398 24.820 -35.116 204 HD3 PRO 27 3HD PRO 27 -12.218 25.513 -36.268 205 H ARG 28 H ARG 28 -12.309 29.254 -32.496 206 HA ARG 28 HA ARG 28 -15.014 29.287 -31.271 207 HB2 ARG 28 2HB ARG 28 -14.222 28.345 -29.200 208 HB3 ARG 28 3HB ARG 28 -13.826 27.259 -30.530 209 HG2 ARG 28 2HG ARG 28 -11.480 28.332 -30.522 210 HG3 ARG 28 3HG ARG 28 -11.950 29.095 -28.997 211 HD2 ARG 28 2HD ARG 28 -12.279 26.908 -27.955 212 HD3 ARG 28 3HD ARG 28 -12.057 26.099 -29.521 213 HE ARG 28 HE ARG 28 -9.835 27.805 -28.538 214 HH11 ARG 28 1HH1 ARG 28 -10.888 24.480 -29.035 215 HH12 ARG 28 2HH1 ARG 28 -9.231 23.952 -29.270 216 HH21 ARG 28 1HH2 ARG 28 -7.829 26.991 -28.529 217 HH22 ARG 28 2HH2 ARG 28 -7.582 25.257 -28.674 218 H GLN 29 H GLN 29 -15.047 30.486 -29.231 219 HA GLN 29 HA GLN 29 -13.469 33.024 -29.249 220 HB2 GLN 29 2HB GLN 29 -16.454 32.761 -28.720 221 HB3 GLN 29 3HB GLN 29 -15.512 34.249 -28.713 222 HG2 GLN 29 2HG GLN 29 -15.855 34.555 -30.916 223 HG3 GLN 29 3HG GLN 29 -15.227 32.952 -31.305 224 HE21 GLN 29 1HE2 GLN 29 -16.907 31.175 -30.252 225 HE22 GLN 29 2HE2 GLN 29 -18.522 31.374 -30.938 226 H ILE 30 H ILE 30 -12.328 32.801 -27.446 227 HA ILE 30 HA ILE 30 -13.436 31.597 -24.983 228 HB ILE 30 HB ILE 30 -10.738 32.959 -25.217 229 HG12 ILE 30 2HG1 ILE 30 -10.664 31.338 -26.977 230 HG13 ILE 30 3HG1 ILE 30 -9.718 30.768 -25.612 231 HG21 ILE 30 1HG2 ILE 30 -11.543 32.536 -22.944 232 HG22 ILE 30 2HG2 ILE 30 -11.888 30.844 -23.335 233 HG23 ILE 30 3HG2 ILE 30 -10.212 31.437 -23.322 234 HD11 ILE 30 3HD1 ILE 30 -12.481 29.785 -26.424 235 HD12 ILE 30 1HD1 ILE 30 -10.944 28.926 -26.600 236 HD13 ILE 30 2HD1 ILE 30 -11.578 29.240 -24.984 237 H ALA 31 H ALA 31 -14.920 32.875 -24.011 238 HA ALA 31 HA ALA 31 -14.327 35.760 -23.505 239 HB1 ALA 31 3HB ALA 31 -16.516 35.322 -24.412 240 HB2 ALA 31 1HB ALA 31 -16.853 34.098 -23.163 241 HB3 ALA 31 2HB ALA 31 -16.695 35.812 -22.723 242 H ARG 32 H ARG 32 -14.923 36.497 -21.268 243 HA ARG 32 HA ARG 32 -14.307 34.524 -19.115 244 HB2 ARG 32 2HB ARG 32 -12.986 37.180 -19.663 245 HB3 ARG 32 3HB ARG 32 -13.247 36.691 -17.983 246 HG2 ARG 32 2HG ARG 32 -11.984 34.687 -18.242 247 HG3 ARG 32 3HG ARG 32 -11.922 34.831 -19.991 248 HD2 ARG 32 2HD ARG 32 -9.850 35.615 -19.585 249 HD3 ARG 32 3HD ARG 32 -10.668 37.155 -19.378 250 HE ARG 32 HE ARG 32 -9.371 35.466 -17.352 251 HH11 ARG 32 1HH2 ARG 32 -11.580 38.230 -17.636 252 HH12 ARG 32 2HH2 ARG 32 -11.319 38.599 -15.927 253 HH21 ARG 32 1HH1 ARG 32 -9.132 36.191 -15.233 254 HH22 ARG 32 2HH1 ARG 32 -10.096 37.586 -14.739 255 H TYR 33 H TYR 33 -15.228 34.894 -17.141 256 HA TYR 33 HA TYR 33 -17.291 37.004 -16.946 257 HB2 TYR 33 2HB TYR 33 -17.904 34.064 -16.532 258 HB3 TYR 33 3HB TYR 33 -18.964 35.388 -16.142 259 HD1 TYR 33 HD2 TYR 33 -17.266 33.670 -18.999 260 HD2 TYR 33 HD1 TYR 33 -20.416 36.298 -17.725 261 HE1 TYR 33 HE2 TYR 33 -18.337 33.501 -21.250 262 HE2 TYR 33 HE1 TYR 33 -21.460 36.149 -19.981 263 HH TYR 33 HH TYR 33 -21.426 35.177 -21.971 264 H ARG 34 H ARG 34 -17.735 37.686 -14.928 265 HA ARG 34 HA ARG 34 -16.024 36.760 -12.664 266 HB2 ARG 34 2HB ARG 34 -15.681 39.066 -13.591 267 HB3 ARG 34 3HB ARG 34 -17.357 39.450 -13.225 268 HG2 ARG 34 2HG ARG 34 -16.953 39.168 -10.820 269 HG3 ARG 34 3HG ARG 34 -15.292 38.631 -11.126 270 HD2 ARG 34 2HD ARG 34 -14.763 40.827 -12.136 271 HD3 ARG 34 3HD ARG 34 -16.440 41.328 -11.920 272 HE ARG 34 HE ARG 34 -16.144 41.536 -9.597 273 HH11 ARG 34 2HH1 ARG 34 -13.022 40.643 -11.057 274 HH12 ARG 34 1HH1 ARG 34 -12.181 41.095 -9.603 275 HH21 ARG 34 1HH2 ARG 34 -14.940 42.103 -7.847 276 HH22 ARG 34 2HH2 ARG 34 -13.214 41.908 -7.871 277 H THR 35 H THR 35 -16.934 35.899 -10.945 278 HA THR 35 HA THR 35 -19.833 35.499 -10.805 279 HB THR 35 HB THR 35 -19.376 34.057 -8.890 280 HG1 THR 35 HG1 THR 35 -16.675 34.565 -9.350 281 HG21 THR 35 1HG2 THR 35 -17.527 33.522 -11.231 282 HG22 THR 35 2HG2 THR 35 -17.988 32.375 -9.956 283 HG23 THR 35 3HG2 THR 35 -19.225 33.036 -11.051 284 H ASP 36 H ASP 36 -20.686 35.512 -8.365 285 HA ASP 36 HA ASP 36 -20.751 38.284 -7.665 286 HB2 ASP 36 2HB ASP 36 -22.695 36.681 -7.568 287 HB3 ASP 36 3HB ASP 36 -21.930 35.885 -6.193 288 H ASN 37 H ASN 37 -18.611 35.761 -6.581 289 HA ASN 37 HA ASN 37 -17.880 37.370 -4.180 290 HB2 ASN 37 2HB ASN 37 -16.385 34.949 -5.011 291 HB3 ASN 37 3HB ASN 37 -16.554 35.666 -3.446 292 HD21 ASN 37 1HD2 ASN 37 -16.985 32.942 -4.539 293 HD22 ASN 37 2HD2 ASN 37 -18.581 32.495 -3.894 294 H GLY 38 H GLY 38 -17.346 37.797 -7.370 295 HA2 GLY 38 HA2 GLY 38 -15.766 39.004 -8.554 296 HA3 GLY 38 HA3 GLY 38 -14.675 39.030 -7.163 297 H GLU 39 H GLU 39 -15.761 35.843 -7.842 298 HA GLU 39 HA GLU 39 -13.034 35.089 -8.608 299 HB2 GLU 39 2HB GLU 39 -15.378 33.195 -8.783 300 HB3 GLU 39 3HB GLU 39 -13.703 32.869 -8.433 301 HG2 GLU 39 2HG GLU 39 -14.313 34.443 -6.288 302 HG3 GLU 39 3HG GLU 39 -15.940 33.879 -6.733 303 H GLU 40 H GLU 40 -12.314 35.322 -10.652 304 HA GLU 40 HA GLU 40 -14.234 35.397 -12.912 305 HB2 GLU 40 2HB GLU 40 -11.358 36.304 -12.622 306 HB3 GLU 40 3HB GLU 40 -12.224 36.250 -14.173 307 HG2 GLU 40 2HG GLU 40 -13.936 37.733 -13.363 308 HG3 GLU 40 3HG GLU 40 -13.238 37.755 -11.739 309 H PHE 41 H PHE 41 -14.457 33.927 -14.397 310 HA PHE 41 HA PHE 41 -12.419 31.765 -14.785 311 HB2 PHE 41 2HB PHE 41 -15.444 31.526 -14.727 312 HB3 PHE 41 3HB PHE 41 -14.355 30.250 -15.213 313 HD1 PHE 41 HD2 PHE 41 -15.514 32.247 -12.240 314 HD2 PHE 41 HD1 PHE 41 -13.135 28.914 -13.652 315 HE1 PHE 41 HE2 PHE 41 -15.199 31.467 -9.951 316 HE2 PHE 41 HE1 PHE 41 -12.795 28.173 -11.318 317 HZ PHE 41 HZ PHE 41 -13.801 29.465 -9.447 318 H GLU 42 H GLU 42 -12.616 30.675 -16.857 319 HA GLU 42 HA GLU 42 -13.318 32.535 -19.067 320 HB2 GLU 42 2HB GLU 42 -11.411 30.210 -19.348 321 HB3 GLU 42 3HB GLU 42 -11.615 31.625 -20.365 322 HG2 GLU 42 2HG GLU 42 -9.728 32.323 -19.343 323 HG3 GLU 42 3HG GLU 42 -10.821 32.872 -18.082 324 H VAL 43 H VAL 43 -14.663 31.918 -20.652 325 HA VAL 43 HA VAL 43 -15.675 29.091 -20.734 326 HB VAL 43 HB VAL 43 -17.369 31.536 -21.198 327 HG11 VAL 43 1HG1 VAL 43 -18.042 29.504 -22.488 328 HG12 VAL 43 2HG1 VAL 43 -18.115 28.594 -20.964 329 HG13 VAL 43 3HG1 VAL 43 -19.208 29.967 -21.264 330 HG21 VAL 43 3HG2 VAL 43 -18.464 31.082 -19.134 331 HG22 VAL 43 1HG2 VAL 43 -17.479 29.628 -18.836 332 HG23 VAL 43 2HG2 VAL 43 -16.762 31.253 -18.764 333 HA PRO 44 HA PRO 44 -14.460 29.664 -25.100 334 HB2 PRO 44 2HB PRO 44 -14.786 26.716 -25.092 335 HB3 PRO 44 3HB PRO 44 -13.424 27.675 -25.690 336 HG2 PRO 44 2HG PRO 44 -13.272 26.237 -23.361 337 HG3 PRO 44 3HG PRO 44 -12.480 27.834 -23.508 338 HD2 PRO 44 2HD PRO 44 -15.130 27.176 -22.215 339 HD3 PRO 44 3HD PRO 44 -13.819 28.280 -21.677 340 H PHE 45 H PHE 45 -15.925 30.129 -26.534 341 HA PHE 45 HA PHE 45 -18.505 28.590 -26.810 342 HB2 PHE 45 2HB PHE 45 -17.810 31.482 -27.334 343 HB3 PHE 45 3HB PHE 45 -19.189 30.745 -28.083 344 HD1 PHE 45 HD1 PHE 45 -17.677 31.710 -24.823 345 HD2 PHE 45 HD2 PHE 45 -21.233 30.299 -26.814 346 HE1 PHE 45 HE1 PHE 45 -19.014 32.190 -22.799 347 HE2 PHE 45 HE2 PHE 45 -22.561 30.776 -24.767 348 HZ PHE 45 HZ PHE 45 -21.432 31.720 -22.747 349 H ALA 46 H ALA 46 -19.119 27.880 -28.847 350 HA ALA 46 HA ALA 46 -16.934 27.562 -30.822 351 HB1 ALA 46 3HB ALA 46 -18.168 25.579 -30.086 352 HB2 ALA 46 1HB ALA 46 -19.697 26.316 -30.614 353 HB3 ALA 46 2HB ALA 46 -18.449 25.891 -31.808 354 H ASP 47 H ASP 47 -17.390 27.831 -33.121 355 HA ASP 47 HA ASP 47 -18.070 30.438 -33.835 356 HB2 ASP 47 2HB ASP 47 -17.841 29.703 -36.070 357 HB3 ASP 47 3HB ASP 47 -16.699 28.773 -35.102 358 H ASP 48 H ASP 48 -20.121 27.727 -33.535 359 HA ASP 48 HA ASP 48 -22.417 28.825 -35.017 360 HB2 ASP 48 2HB ASP 48 -23.605 26.871 -34.428 361 HB3 ASP 48 3HB ASP 48 -21.974 26.411 -34.907 362 H ALA 49 H ALA 49 -21.218 29.371 -31.948 363 HA ALA 49 HA ALA 49 -23.794 30.478 -30.894 364 HB1 ALA 49 3HB ALA 49 -22.891 30.068 -28.658 365 HB2 ALA 49 1HB ALA 49 -22.900 28.561 -29.593 366 HB3 ALA 49 2HB ALA 49 -21.377 29.451 -29.353 367 H GLU 50 H GLU 50 -23.572 32.376 -29.482 368 HA GLU 50 HA GLU 50 -21.111 33.982 -29.765 369 HB2 GLU 50 2HB GLU 50 -22.244 35.981 -30.351 370 HB3 GLU 50 3HB GLU 50 -22.702 34.733 -31.514 371 HG2 GLU 50 2HG GLU 50 -24.844 34.401 -30.205 372 HG3 GLU 50 3HG GLU 50 -24.393 35.783 -29.204 373 H ILE 51 H ILE 51 -20.737 35.403 -28.099 374 HA ILE 51 HA ILE 51 -21.185 34.411 -25.560 375 HB ILE 51 HB ILE 51 -20.216 37.223 -26.068 376 HG12 ILE 51 2HG1 ILE 51 -19.047 35.870 -27.720 377 HG13 ILE 51 3HG1 ILE 51 -17.954 36.394 -26.442 378 HG21 ILE 51 1HG2 ILE 51 -18.775 36.771 -24.123 379 HG22 ILE 51 2HG2 ILE 51 -20.469 36.517 -23.688 380 HG23 ILE 51 3HG2 ILE 51 -19.410 35.134 -24.002 381 HD11 ILE 51 3HD1 ILE 51 -17.466 34.116 -27.100 382 HD12 ILE 51 1HD1 ILE 51 -18.110 34.080 -25.460 383 HD13 ILE 51 2HD1 ILE 51 -19.146 33.619 -26.829 384 HA PRO 52 HA PRO 52 -24.981 36.746 -24.531 385 HB2 PRO 52 2HB PRO 52 -25.649 35.238 -22.361 386 HB3 PRO 52 3HB PRO 52 -25.986 34.716 -24.042 387 HG2 PRO 52 2HG PRO 52 -23.731 33.876 -22.216 388 HG3 PRO 52 3HG PRO 52 -24.721 32.864 -23.323 389 HD2 PRO 52 2HD PRO 52 -22.186 33.888 -23.908 390 HD3 PRO 52 3HD PRO 52 -23.361 33.439 -25.142 391 H GLY 53 H GLY 53 -25.274 38.281 -22.936 392 HA2 GLY 53 HA2 GLY 53 -23.191 39.636 -21.763 393 HA3 GLY 53 HA3 GLY 53 -24.859 39.721 -21.189 394 H THR 54 H THR 54 -24.894 36.889 -20.241 395 HA THR 54 HA THR 54 -22.703 36.782 -18.299 396 HB THR 54 HB THR 54 -24.314 36.174 -16.446 397 HG1 THR 54 HG1 THR 54 -26.541 36.491 -16.808 398 HG21 THR 54 1HG2 THR 54 -25.286 38.798 -17.646 399 HG22 THR 54 2HG2 THR 54 -25.333 38.290 -15.942 400 HG23 THR 54 3HG2 THR 54 -23.790 38.615 -16.725 401 H TRP 55 H TRP 55 -22.486 34.651 -17.217 402 HA TRP 55 HA TRP 55 -23.813 32.315 -18.376 403 HB2 TRP 55 2HB TRP 55 -22.070 33.017 -20.074 404 HB3 TRP 55 3HB TRP 55 -20.843 32.714 -18.850 405 HD1 TRP 55 HD1 TRP 55 -20.250 30.221 -18.323 406 HE1 TRP 55 HE1 TRP 55 -20.554 28.052 -19.618 407 HE3 TRP 55 HE3 TRP 55 -23.924 31.739 -21.495 408 HZ2 TRP 55 HZ2 TRP 55 -22.348 27.017 -21.669 409 HZ3 TRP 55 HZ3 TRP 55 -24.959 30.137 -23.105 410 HH2 TRP 55 HH2 TRP 55 -24.171 27.780 -23.201 411 H LEU 56 H LEU 56 -23.395 30.375 -17.182 412 HA LEU 56 HA LEU 56 -22.682 30.794 -14.423 413 HB2 LEU 56 2HB LEU 56 -24.264 29.003 -15.843 414 HB3 LEU 56 3HB LEU 56 -22.888 28.008 -15.362 415 HG LEU 56 HG LEU 56 -24.508 29.707 -13.424 416 HD11 LEU 56 1HD1 LEU 56 -25.620 27.605 -12.767 417 HD12 LEU 56 2HD1 LEU 56 -25.945 27.994 -14.463 418 HD13 LEU 56 3HD1 LEU 56 -24.757 26.735 -14.059 419 HD21 LEU 56 3HD2 LEU 56 -22.272 29.085 -12.584 420 HD22 LEU 56 1HD2 LEU 56 -23.529 28.192 -11.723 421 HD23 LEU 56 2HD2 LEU 56 -22.571 27.388 -12.990 422 H CYS 57 H CYS 57 -20.809 30.565 -13.416 423 HA CYS 57 HA CYS 57 -18.404 29.733 -14.939 424 HB2 CYS 57 2HB CYS 57 -18.851 31.267 -12.352 425 HB3 CYS 57 3HB CYS 57 -17.252 30.785 -12.935 426 HG CYS 57 HG CYS 57 -19.519 32.409 -14.710 427 H ARG 58 H ARG 58 -16.694 28.531 -13.803 428 HA ARG 58 HA ARG 58 -17.687 25.998 -12.954 429 HB2 ARG 58 2HB ARG 58 -14.832 27.034 -12.698 430 HB3 ARG 58 3HB ARG 58 -15.345 25.352 -12.679 431 HG2 ARG 58 2HG ARG 58 -16.161 25.601 -15.046 432 HG3 ARG 58 3HG ARG 58 -15.553 27.266 -15.043 433 HD2 ARG 58 2HD ARG 58 -13.931 25.893 -16.139 434 HD3 ARG 58 3HD ARG 58 -13.264 26.440 -14.591 435 HE ARG 58 HE ARG 58 -14.528 23.855 -14.312 436 HH11 ARG 58 2HH2 ARG 58 -11.536 25.229 -15.615 437 HH12 ARG 58 1HH2 ARG 58 -10.695 23.697 -15.323 438 HH21 ARG 58 1HH1 ARG 58 -13.243 21.992 -14.024 439 HH22 ARG 58 2HH1 ARG 58 -11.550 22.092 -14.528 440 H ASN 59 H ASN 59 -17.014 28.760 -11.021 441 HA ASN 59 HA ASN 59 -16.675 27.481 -8.487 442 HB2 ASN 59 2HB ASN 59 -16.114 29.783 -8.886 443 HB3 ASN 59 3HB ASN 59 -17.782 30.182 -9.315 444 HD21 ASN 59 1HD2 ASN 59 -17.823 31.862 -7.761 445 HD22 ASN 59 2HD2 ASN 59 -17.780 31.510 -6.043 446 H GLY 60 H GLY 60 -19.438 27.738 -10.549 447 HA2 GLY 60 HA2 GLY 60 -21.534 26.702 -10.281 448 HA3 GLY 60 HA3 GLY 60 -21.308 26.611 -8.533 449 H MET 61 H MET 61 -20.537 29.685 -9.935 450 HA MET 61 HA MET 61 -23.156 30.841 -9.110 451 HB2 MET 61 2HB MET 61 -21.170 31.354 -7.648 452 HB3 MET 61 3HB MET 61 -20.405 32.133 -9.008 453 HG2 MET 61 2HG MET 61 -21.482 33.750 -7.497 454 HG3 MET 61 3HG MET 61 -22.140 33.819 -9.127 455 HE1 MET 61 3HE MET 61 -24.345 32.251 -5.363 456 HE2 MET 61 1HE MET 61 -22.949 31.384 -6.032 457 HE3 MET 61 2HE MET 61 -22.746 33.025 -5.373 458 H GLU 62 H GLU 62 -24.051 32.466 -10.382 459 HA GLU 62 HA GLU 62 -23.525 32.408 -13.231 460 HB2 GLU 62 2HB GLU 62 -25.295 34.186 -11.516 461 HB3 GLU 62 3HB GLU 62 -25.206 34.257 -13.285 462 HG2 GLU 62 2HG GLU 62 -25.899 31.880 -13.426 463 HG3 GLU 62 3HG GLU 62 -26.022 31.802 -11.667 464 H GLY 63 H GLY 63 -21.784 33.277 -14.111 465 HA2 GLY 63 HA2 GLY 63 -20.423 35.584 -12.927 466 HA3 GLY 63 HA3 GLY 63 -19.823 34.610 -14.245 467 H THR 64 H THR 64 -20.141 37.581 -14.002 468 HA THR 64 HA THR 64 -21.801 38.045 -16.440 469 HB THR 64 HB THR 64 -20.685 40.057 -14.454 470 HG1 THR 64 HG1 THR 64 -22.814 40.223 -13.774 471 HG21 THR 64 1HG2 THR 64 -22.535 40.417 -16.862 472 HG22 THR 64 2HG2 THR 64 -22.361 41.622 -15.565 473 HG23 THR 64 3HG2 THR 64 -20.970 41.198 -16.565 474 H LEU 65 H LEU 65 -20.974 38.921 -18.287 475 HA LEU 65 HA LEU 65 -18.386 38.113 -18.976 476 HB2 LEU 65 2HB LEU 65 -20.448 38.295 -20.347 477 HB3 LEU 65 3HB LEU 65 -20.282 40.028 -20.360 478 HG LEU 65 HG LEU 65 -18.635 37.880 -21.745 479 HD11 LEU 65 1HD1 LEU 65 -20.754 38.695 -22.758 480 HD12 LEU 65 2HD1 LEU 65 -20.113 40.351 -22.755 481 HD13 LEU 65 3HD1 LEU 65 -19.350 39.103 -23.759 482 HD21 LEU 65 3HD2 LEU 65 -16.880 39.387 -21.130 483 HD22 LEU 65 1HD2 LEU 65 -17.274 39.698 -22.810 484 HD23 LEU 65 2HD2 LEU 65 -17.865 40.817 -21.560 485 H ILE 66 H ILE 66 -16.428 38.999 -18.625 486 HA ILE 66 HA ILE 66 -16.064 41.944 -18.690 487 HB ILE 66 HB ILE 66 -14.475 41.968 -16.950 488 HG12 ILE 66 2HG1 ILE 66 -13.324 39.881 -17.071 489 HG13 ILE 66 3HG1 ILE 66 -13.967 40.070 -15.446 490 HG21 ILE 66 1HG2 ILE 66 -16.908 40.512 -15.890 491 HG22 ILE 66 2HG2 ILE 66 -15.815 41.565 -14.982 492 HG23 ILE 66 3HG2 ILE 66 -16.816 42.238 -16.285 493 HD11 ILE 66 3HD1 ILE 66 -15.858 38.564 -16.115 494 HD12 ILE 66 1HD1 ILE 66 -14.926 38.247 -17.585 495 HD13 ILE 66 2HD1 ILE 66 -14.245 37.818 -16.009 496 H GLU 67 H GLU 67 -13.968 42.664 -19.339 497 HA GLU 67 HA GLU 67 -12.530 40.900 -21.208 498 HB2 GLU 67 2HB GLU 67 -11.993 43.745 -20.271 499 HB3 GLU 67 3HB GLU 67 -11.034 42.874 -21.473 500 HG2 GLU 67 2HG GLU 67 -13.047 42.626 -22.911 501 HG3 GLU 67 3HG GLU 67 -13.998 43.543 -21.740 502 H GLY 68 H GLY 68 -10.337 40.279 -20.986 503 HA2 GLY 68 HA2 GLY 68 -8.560 40.897 -18.953 504 HA3 GLY 68 HA3 GLY 68 -9.441 39.508 -18.323 505 H ASP 69 H ASP 69 -9.597 38.516 -21.328 506 HA ASP 69 HA ASP 69 -6.871 38.103 -22.095 507 HB2 ASP 69 2HB ASP 69 -7.310 36.217 -20.433 508 HB3 ASP 69 3HB ASP 69 -8.582 35.650 -21.520 509 H LEU 70 H LEU 70 -6.805 37.220 -24.198 510 HA LEU 70 HA LEU 70 -9.011 38.228 -25.883 511 HB2 LEU 70 2HB LEU 70 -6.141 37.474 -26.497 512 HB3 LEU 70 3HB LEU 70 -7.311 37.929 -27.720 513 HG LEU 70 HG LEU 70 -5.884 39.764 -27.289 514 HD11 LEU 70 1HD1 LEU 70 -8.599 40.410 -26.081 515 HD12 LEU 70 2HD1 LEU 70 -7.482 41.528 -26.881 516 HD13 LEU 70 3HD1 LEU 70 -8.259 40.244 -27.820 517 HD21 LEU 70 3HD2 LEU 70 -5.658 40.961 -25.240 518 HD22 LEU 70 1HD2 LEU 70 -6.842 39.937 -24.415 519 HD23 LEU 70 2HD2 LEU 70 -5.271 39.262 -24.917 520 HA PRO 71 HA PRO 71 -10.336 34.191 -27.230 521 HB2 PRO 71 2HB PRO 71 -11.749 34.765 -29.473 522 HB3 PRO 71 3HB PRO 71 -12.252 35.346 -27.859 523 HG2 PRO 71 2HG PRO 71 -10.660 36.869 -29.953 524 HG3 PRO 71 3HG PRO 71 -12.131 37.404 -29.077 525 HD2 PRO 71 2HD PRO 71 -9.607 38.074 -28.259 526 HD3 PRO 71 3HD PRO 71 -10.931 37.774 -27.095 527 H GLU 72 H GLU 72 -7.981 33.809 -27.432 528 HA GLU 72 HA GLU 72 -6.027 33.206 -28.449 529 HB2 GLU 72 2HB GLU 72 -8.232 31.658 -29.769 530 HB3 GLU 72 3HB GLU 72 -6.517 31.249 -30.017 531 HG2 GLU 72 2HG GLU 72 -6.199 30.895 -27.628 532 HG3 GLU 72 3HG GLU 72 -7.858 31.397 -27.286 533 HA PRO 73 HA PRO 73 -5.700 35.987 -32.153 534 HB2 PRO 73 2HB PRO 73 -3.339 36.778 -30.453 535 HB3 PRO 73 3HB PRO 73 -4.364 37.798 -31.507 536 HG2 PRO 73 2HG PRO 73 -4.703 37.846 -28.826 537 HG3 PRO 73 3HG PRO 73 -6.136 37.798 -29.908 538 HD2 PRO 73 2HD PRO 73 -4.820 35.495 -28.434 539 HD3 PRO 73 3HD PRO 73 -6.552 35.932 -28.543 540 H LYS 74 H LYS 74 -3.634 36.190 -33.496 541 HA LYS 74 HA LYS 74 -2.728 33.616 -34.235 542 HB2 LYS 74 2HB LYS 74 -2.951 35.731 -35.654 543 HB3 LYS 74 3HB LYS 74 -1.446 36.286 -34.942 544 HG2 LYS 74 2HG LYS 74 -0.899 35.378 -37.068 545 HG3 LYS 74 3HG LYS 74 -0.307 34.233 -35.879 546 HD2 LYS 74 2HD LYS 74 -1.271 32.972 -37.643 547 HD3 LYS 74 3HD LYS 74 -2.391 32.830 -36.287 548 HE2 LYS 74 2HE LYS 74 -3.822 34.606 -37.306 549 HE3 LYS 74 3HE LYS 74 -2.666 34.775 -38.633 550 HZ1 LYS 74 HZ1 LYS 74 -3.143 32.466 -39.254 551 HZ2 LYS 74 HZ2 LYS 74 -4.210 32.307 -38.025 552 HZ3 LYS 74 HZ3 LYS 74 -4.522 33.338 -39.250 553 H LYS 75 H LYS 75 -1.214 35.898 -32.065 554 HA LYS 75 HA LYS 75 0.679 35.827 -30.731 555 HB2 LYS 75 2HB LYS 75 -0.422 33.006 -30.518 556 HB3 LYS 75 3HB LYS 75 0.819 33.671 -29.438 557 HG2 LYS 75 2HG LYS 75 -0.655 35.378 -28.611 558 HG3 LYS 75 3HG LYS 75 -1.875 35.012 -29.822 559 HD2 LYS 75 2HD LYS 75 -2.597 34.166 -27.720 560 HD3 LYS 75 3HD LYS 75 -2.302 32.806 -28.790 561 HE2 LYS 75 2HE LYS 75 -0.186 33.756 -26.813 562 HE3 LYS 75 3HE LYS 75 -1.537 32.763 -26.270 563 HZ1 LYS 75 HZ1 LYS 75 0.411 31.929 -28.350 564 HZ2 LYS 75 HZ2 LYS 75 0.344 31.374 -26.819 565 HZ3 LYS 75 HZ3 LYS 75 -0.874 31.045 -27.850 566 H VAL 76 H VAL 76 1.850 36.160 -32.833 567 HA VAL 76 HA VAL 76 3.461 34.016 -33.906 568 HB VAL 76 HB VAL 76 4.388 35.721 -35.410 569 HG11 VAL 76 1HG1 VAL 76 2.243 34.599 -35.915 570 HG12 VAL 76 2HG1 VAL 76 1.368 35.945 -35.146 571 HG13 VAL 76 3HG1 VAL 76 2.348 36.230 -36.596 572 HG21 VAL 76 3HG2 VAL 76 3.580 38.024 -35.390 573 HG22 VAL 76 1HG2 VAL 76 2.628 37.734 -33.924 574 HG23 VAL 76 2HG2 VAL 76 4.403 37.689 -33.863 575 H LYS 77 H LYS 77 4.041 34.356 -31.129 576 HA LYS 77 HA LYS 77 6.964 34.913 -31.188 577 HB2 LYS 77 2HB LYS 77 5.002 35.977 -29.112 578 HB3 LYS 77 3HB LYS 77 6.759 35.996 -28.931 579 HG2 LYS 77 2HG LYS 77 6.953 37.387 -30.991 580 HG3 LYS 77 3HG LYS 77 5.182 37.449 -31.098 581 HD2 LYS 77 2HD LYS 77 5.086 38.487 -28.843 582 HD3 LYS 77 3HD LYS 77 6.850 38.495 -28.762 583 HE2 LYS 77 2HE LYS 77 5.179 39.921 -30.887 584 HE3 LYS 77 3HE LYS 77 5.796 40.687 -29.422 585 HZ1 LYS 77 HZ1 LYS 77 7.273 41.103 -31.281 586 HZ2 LYS 77 HZ2 LYS 77 8.059 40.190 -30.184 587 HZ3 LYS 77 HZ3 LYS 77 7.491 39.513 -31.561 588 HA PRO 78 HA PRO 78 7.393 31.098 -29.054 589 HB2 PRO 78 2HB PRO 78 9.317 32.472 -27.177 590 HB3 PRO 78 3HB PRO 78 9.521 30.931 -28.068 591 HG2 PRO 78 2HG PRO 78 10.703 33.180 -28.983 592 HG3 PRO 78 3HG PRO 78 9.857 32.094 -30.136 593 HD2 PRO 78 2HD PRO 78 8.828 34.647 -28.860 594 HD3 PRO 78 3HD PRO 78 8.773 34.130 -30.572 595 HA PRO 79 HA PRO 79 4.757 31.260 -25.466 596 HB2 PRO 79 2HB PRO 79 4.884 28.721 -24.499 597 HB3 PRO 79 3HB PRO 79 4.204 29.098 -26.111 598 HG2 PRO 79 2HG PRO 79 7.026 28.171 -25.461 599 HG3 PRO 79 3HG PRO 79 5.891 27.485 -26.670 600 HD2 PRO 79 2HD PRO 79 7.806 29.296 -27.362 601 HD3 PRO 79 3HD PRO 79 6.190 29.310 -28.129 602 H ARG 80 H ARG 80 8.153 30.739 -25.000 603 HA ARG 80 HA ARG 80 8.016 31.667 -22.198 604 HB2 ARG 80 2HB ARG 80 8.293 28.958 -22.615 605 HB3 ARG 80 3HB ARG 80 9.969 29.457 -22.751 606 HG2 ARG 80 2HG ARG 80 9.878 29.072 -20.492 607 HG3 ARG 80 3HG ARG 80 9.421 30.775 -20.467 608 HD2 ARG 80 2HD ARG 80 7.550 28.358 -20.382 609 HD3 ARG 80 3HD ARG 80 7.971 29.394 -19.020 610 HE ARG 80 HE ARG 80 6.465 30.329 -21.447 611 HH11 ARG 80 1HH2 ARG 80 6.750 30.503 -17.949 612 HH12 ARG 80 2HH2 ARG 80 5.452 31.663 -17.847 613 HH21 ARG 80 2HH1 ARG 80 4.930 31.727 -21.262 614 HH22 ARG 80 1HH1 ARG 80 4.416 32.348 -19.703 Start of MODEL 10 1 H1 SER 1 1H SER 1 -21.467 17.235 -15.219 2 H2 SER 1 2H SER 1 -20.174 17.235 -16.227 3 H3 SER 1 3H SER 1 -20.371 18.455 -15.148 4 HA SER 1 HA SER 1 -20.065 16.926 -13.308 5 HB2 SER 1 2HB SER 1 -19.211 14.632 -13.853 6 HB3 SER 1 3HB SER 1 -20.893 14.898 -14.336 7 HG SER 1 HG SER 1 -19.552 13.881 -15.963 8 H MET 2 H MET 2 -17.905 16.333 -12.497 9 HA MET 2 HA MET 2 -15.795 17.933 -13.834 10 HB2 MET 2 2HB MET 2 -16.629 18.279 -11.428 11 HB3 MET 2 3HB MET 2 -15.778 16.785 -11.032 12 HG2 MET 2 2HG MET 2 -14.365 18.607 -10.463 13 HG3 MET 2 3HG MET 2 -13.649 17.870 -11.885 14 HE1 MET 2 3HE MET 2 -12.096 19.952 -12.256 15 HE2 MET 2 1HE MET 2 -12.668 21.636 -12.257 16 HE3 MET 2 2HE MET 2 -12.768 20.666 -10.772 17 H ALA 3 H ALA 3 -16.622 14.663 -13.700 18 HA ALA 3 HA ALA 3 -13.976 13.838 -14.676 19 HB1 ALA 3 3HB ALA 3 -13.927 11.889 -13.111 20 HB2 ALA 3 1HB ALA 3 -13.858 13.431 -12.241 21 HB3 ALA 3 2HB ALA 3 -15.379 12.512 -12.305 22 H ASP 4 H ASP 4 -15.750 11.255 -16.516 23 HA ASP 4 HA ASP 4 -13.127 11.961 -15.282 24 HB2 ASP 4 2HB ASP 4 -13.923 9.613 -15.131 25 HB3 ASP 4 3HB ASP 4 -13.934 9.528 -16.894 26 H ARG 5 H ARG 5 -11.274 12.058 -16.666 27 HA ARG 5 HA ARG 5 -10.080 13.279 -18.173 28 HB2 ARG 5 2HB ARG 5 -11.869 11.966 -20.228 29 HB3 ARG 5 3HB ARG 5 -10.249 12.632 -20.466 30 HG2 ARG 5 2HG ARG 5 -9.382 10.909 -18.801 31 HG3 ARG 5 3HG ARG 5 -10.996 10.183 -18.828 32 HD2 ARG 5 2HD ARG 5 -9.674 8.924 -20.337 33 HD3 ARG 5 3HD ARG 5 -10.762 9.885 -21.329 34 HE ARG 5 HE ARG 5 -7.819 10.246 -20.953 35 HH11 ARG 5 1HH1 ARG 5 -10.649 11.308 -22.772 36 HH12 ARG 5 2HH1 ARG 5 -9.662 12.373 -23.762 37 HH21 ARG 5 1HH2 ARG 5 -6.693 11.582 -22.346 38 HH22 ARG 5 2HH2 ARG 5 -7.590 12.525 -23.519 39 H VAL 6 H VAL 6 -12.326 14.726 -17.134 40 HA VAL 6 HA VAL 6 -13.196 16.621 -19.192 41 HB VAL 6 HB VAL 6 -13.545 16.707 -16.172 42 HG11 VAL 6 1HG1 VAL 6 -15.405 18.279 -16.662 43 HG12 VAL 6 2HG1 VAL 6 -13.851 18.941 -17.147 44 HG13 VAL 6 3HG1 VAL 6 -14.953 18.275 -18.378 45 HG21 VAL 6 3HG2 VAL 6 -14.708 14.744 -17.102 46 HG22 VAL 6 1HG2 VAL 6 -15.881 15.975 -16.641 47 HG23 VAL 6 2HG2 VAL 6 -15.458 15.757 -18.351 48 H LEU 7 H LEU 7 -12.467 18.651 -19.419 49 HA LEU 7 HA LEU 7 -9.722 19.240 -18.761 50 HB2 LEU 7 2HB LEU 7 -9.927 21.150 -20.114 51 HB3 LEU 7 3HB LEU 7 -10.726 19.825 -20.937 52 HG LEU 7 HG LEU 7 -12.238 21.951 -19.344 53 HD11 LEU 7 1HD1 LEU 7 -11.636 21.894 -22.321 54 HD12 LEU 7 2HD1 LEU 7 -12.671 23.069 -21.482 55 HD13 LEU 7 3HD1 LEU 7 -10.937 23.021 -21.138 56 HD21 LEU 7 3HD2 LEU 7 -13.663 20.042 -19.753 57 HD22 LEU 7 1HD2 LEU 7 -14.123 21.309 -20.876 58 HD23 LEU 7 2HD2 LEU 7 -13.136 19.954 -21.459 59 H ARG 8 H ARG 8 -8.894 21.105 -17.744 60 HA ARG 8 HA ARG 8 -10.623 22.526 -15.758 61 HB2 ARG 8 2HB ARG 8 -8.854 22.665 -14.198 62 HB3 ARG 8 3HB ARG 8 -9.106 20.992 -14.590 63 HG2 ARG 8 2HG ARG 8 -7.006 22.119 -16.318 64 HG3 ARG 8 3HG ARG 8 -6.700 22.511 -14.640 65 HD2 ARG 8 2HD ARG 8 -5.555 20.534 -14.915 66 HD3 ARG 8 3HD ARG 8 -7.026 19.999 -14.122 67 HE ARG 8 HE ARG 8 -6.176 19.572 -16.943 68 HH11 ARG 8 1HH1 ARG 8 -8.751 18.928 -14.620 69 HH12 ARG 8 2HH1 ARG 8 -9.537 17.829 -15.739 70 HH21 ARG 8 1HH2 ARG 8 -7.151 17.966 -18.142 71 HH22 ARG 8 2HH2 ARG 8 -8.650 17.272 -17.558 72 H GLY 9 H GLY 9 -8.993 24.585 -15.091 73 HA2 GLY 9 HA2 GLY 9 -8.805 26.333 -17.415 74 HA3 GLY 9 HA3 GLY 9 -8.234 26.671 -15.779 75 H SER 10 H SER 10 -7.393 24.261 -18.316 76 HA SER 10 HA SER 10 -4.823 23.728 -17.442 77 HB2 SER 10 2HB SER 10 -5.890 23.462 -20.278 78 HB3 SER 10 3HB SER 10 -4.531 22.567 -19.576 79 HG SER 10 HG SER 10 -6.470 21.362 -19.539 80 H ARG 11 H ARG 11 -5.715 26.495 -19.345 81 HA ARG 11 HA ARG 11 -3.171 26.987 -20.601 82 HB2 ARG 11 2HB ARG 11 -4.002 29.124 -21.159 83 HB3 ARG 11 3HB ARG 11 -5.292 27.952 -21.393 84 HG2 ARG 11 2HG ARG 11 -6.369 28.703 -19.268 85 HG3 ARG 11 3HG ARG 11 -5.032 29.835 -19.003 86 HD2 ARG 11 2HD ARG 11 -5.596 30.803 -21.312 87 HD3 ARG 11 3HD ARG 11 -7.111 29.893 -21.219 88 HE ARG 11 HE ARG 11 -7.229 31.252 -18.878 89 HH11 ARG 11 1HH2 ARG 11 -6.723 32.459 -22.104 90 HH12 ARG 11 2HH2 ARG 11 -6.996 34.113 -21.619 91 HH21 ARG 11 1HH1 ARG 11 -7.722 33.257 -18.397 92 HH22 ARG 11 2HH1 ARG 11 -7.491 34.588 -19.567 93 H LEU 12 H LEU 12 -4.213 27.477 -17.373 94 HA LEU 12 HA LEU 12 -3.373 28.306 -15.499 95 HB2 LEU 12 2HB LEU 12 -1.599 26.698 -16.233 96 HB3 LEU 12 3HB LEU 12 -0.619 28.062 -16.746 97 HG LEU 12 HG LEU 12 -1.642 27.624 -13.898 98 HD11 LEU 12 1HD1 LEU 12 -0.113 25.824 -14.617 99 HD12 LEU 12 2HD1 LEU 12 1.094 27.034 -15.107 100 HD13 LEU 12 3HD1 LEU 12 0.642 26.855 -13.395 101 HD21 LEU 12 3HD2 LEU 12 0.464 29.531 -15.019 102 HD22 LEU 12 1HD2 LEU 12 -1.045 29.968 -14.178 103 HD23 LEU 12 2HD2 LEU 12 0.248 29.179 -13.291 104 H GLY 13 H GLY 13 -1.300 29.996 -17.898 105 HA2 GLY 13 HA2 GLY 13 -1.498 32.571 -16.483 106 HA3 GLY 13 HA3 GLY 13 -0.651 32.247 -17.994 107 H ALA 14 H ALA 14 -2.025 34.539 -17.840 108 HA ALA 14 HA ALA 14 -4.766 34.318 -18.750 109 HB1 ALA 14 3HB ALA 14 -2.960 36.747 -18.481 110 HB2 ALA 14 1HB ALA 14 -4.728 36.755 -18.670 111 HB3 ALA 14 2HB ALA 14 -4.002 36.073 -17.205 112 H VAL 15 H VAL 15 -3.180 32.934 -20.588 113 HA VAL 15 HA VAL 15 -3.894 34.334 -23.099 114 HB VAL 15 HB VAL 15 -1.141 33.056 -22.728 115 HG11 VAL 15 1HG1 VAL 15 -2.026 32.745 -25.010 116 HG12 VAL 15 2HG1 VAL 15 -2.399 34.482 -25.118 117 HG13 VAL 15 3HG1 VAL 15 -0.717 33.922 -25.018 118 HG21 VAL 15 3HG2 VAL 15 -1.113 35.261 -21.663 119 HG22 VAL 15 1HG2 VAL 15 -0.215 35.313 -23.178 120 HG23 VAL 15 2HG2 VAL 15 -1.856 35.994 -23.103 121 H SER 16 H SER 16 -5.033 33.066 -24.302 122 HA SER 16 HA SER 16 -5.299 30.209 -23.609 123 HB2 SER 16 2HB SER 16 -6.905 32.120 -25.318 124 HB3 SER 16 3HB SER 16 -7.228 30.378 -25.204 125 HG SER 16 HG SER 16 -8.441 31.580 -23.679 126 H TYR 17 H TYR 17 -4.678 28.561 -24.779 127 HA TYR 17 HA TYR 17 -4.286 28.620 -27.642 128 HB2 TYR 17 2HB TYR 17 -1.977 27.934 -27.696 129 HB3 TYR 17 3HB TYR 17 -2.119 29.501 -26.957 130 HD1 TYR 17 HD1 TYR 17 -2.017 29.660 -24.356 131 HD2 TYR 17 HD2 TYR 17 -0.699 26.236 -26.634 132 HE1 TYR 17 HE1 TYR 17 -0.549 28.980 -22.478 133 HE2 TYR 17 HE2 TYR 17 0.800 25.577 -24.759 134 HH TYR 17 HH TYR 17 1.006 27.471 -21.721 135 H GLU 18 H GLU 18 -2.963 26.147 -27.891 136 HA GLU 18 HA GLU 18 -5.239 24.475 -27.528 137 HB2 GLU 18 2HB GLU 18 -4.039 22.856 -28.858 138 HB3 GLU 18 3HB GLU 18 -3.894 24.466 -29.541 139 HG2 GLU 18 2HG GLU 18 -1.607 24.686 -28.628 140 HG3 GLU 18 3HG GLU 18 -1.735 23.102 -27.865 141 H THR 19 H THR 19 -4.118 25.093 -24.875 142 HA THR 19 HA THR 19 -2.925 22.684 -23.783 143 HB THR 19 HB THR 19 -3.541 23.719 -21.567 144 HG1 THR 19 HG1 THR 19 -5.369 24.919 -22.333 145 HG21 THR 19 1HG2 THR 19 -1.936 25.506 -21.704 146 HG22 THR 19 2HG2 THR 19 -1.387 24.217 -22.783 147 HG23 THR 19 3HG2 THR 19 -2.177 25.663 -23.456 148 H ASP 20 H ASP 20 -6.100 23.398 -24.681 149 HA ASP 20 HA ASP 20 -7.214 21.109 -23.121 150 HB2 ASP 20 2HB ASP 20 -9.321 22.172 -23.174 151 HB3 ASP 20 3HB ASP 20 -8.159 23.375 -22.629 152 H ARG 21 H ARG 21 -5.704 20.947 -25.668 153 HA ARG 21 HA ARG 21 -7.345 20.498 -27.913 154 HB2 ARG 21 2HB ARG 21 -4.950 20.787 -27.993 155 HB3 ARG 21 3HB ARG 21 -4.667 19.287 -27.104 156 HG2 ARG 21 2HG ARG 21 -5.385 17.951 -28.983 157 HG3 ARG 21 3HG ARG 21 -6.018 19.376 -29.833 158 HD2 ARG 21 2HD ARG 21 -3.735 20.312 -29.964 159 HD3 ARG 21 3HD ARG 21 -3.088 18.886 -29.136 160 HE ARG 21 HE ARG 21 -4.381 17.758 -31.250 161 HH11 ARG 21 1HH2 ARG 21 -2.020 20.400 -31.209 162 HH12 ARG 21 2HH2 ARG 21 -1.427 19.958 -32.790 163 HH21 ARG 21 1HH1 ARG 21 -3.565 17.315 -33.257 164 HH22 ARG 21 2HH1 ARG 21 -2.276 18.283 -33.910 165 H ASN 22 H ASN 22 -7.037 18.436 -25.155 166 HA ASN 22 HA ASN 22 -7.980 15.962 -26.224 167 HB2 ASN 22 2HB ASN 22 -7.007 16.223 -23.980 168 HB3 ASN 22 3HB ASN 22 -8.337 17.276 -23.491 169 HD21 ASN 22 2HD2 ASN 22 -9.864 16.241 -22.278 170 HD22 ASN 22 1HD2 ASN 22 -10.239 14.543 -22.388 171 H HIS 23 H HIS 23 -9.797 18.881 -25.176 172 HA HIS 23 HA HIS 23 -12.090 18.162 -26.784 173 HB2 HIS 23 2HB HIS 23 -12.528 16.691 -24.846 174 HB3 HIS 23 3HB HIS 23 -12.449 18.072 -23.762 175 HD2 HIS 23 HD2 HIS 23 -14.694 19.382 -23.400 176 HE1 HIS 23 HE1 HIS 23 -17.005 17.713 -26.575 177 HE2 HIS 23 HE2 HIS 23 -17.069 19.245 -24.541 178 H ASP 24 H ASP 24 -12.230 21.769 -26.629 179 HA ASP 24 HA ASP 24 -10.813 19.759 -28.112 180 HB2 ASP 24 2HB ASP 24 -13.426 19.215 -28.213 181 HB3 ASP 24 3HB ASP 24 -13.458 20.524 -29.377 182 H LEU 25 H LEU 25 -10.434 20.527 -30.361 183 HA LEU 25 HA LEU 25 -10.032 23.492 -30.407 184 HB2 LEU 25 2HB LEU 25 -8.799 21.409 -32.221 185 HB3 LEU 25 3HB LEU 25 -8.474 23.141 -32.240 186 HG LEU 25 HG LEU 25 -7.803 21.212 -29.982 187 HD11 LEU 25 1HD1 LEU 25 -6.053 22.692 -31.981 188 HD12 LEU 25 2HD1 LEU 25 -5.467 21.706 -30.630 189 HD13 LEU 25 3HD1 LEU 25 -6.377 20.944 -31.947 190 HD21 LEU 25 3HD2 LEU 25 -6.544 23.080 -28.978 191 HD22 LEU 25 1HD2 LEU 25 -7.185 24.188 -30.214 192 HD23 LEU 25 2HD2 LEU 25 -8.269 23.428 -29.022 193 H ALA 26 H ALA 26 -10.978 24.798 -31.771 194 HA ALA 26 HA ALA 26 -12.487 24.017 -34.134 195 HB1 ALA 26 3HB ALA 26 -14.674 24.828 -33.148 196 HB2 ALA 26 1HB ALA 26 -14.079 23.372 -32.340 197 HB3 ALA 26 2HB ALA 26 -13.885 24.960 -31.569 198 HA PRO 27 HA PRO 27 -12.102 28.626 -34.641 199 HB2 PRO 27 2HB PRO 27 -14.406 29.223 -35.995 200 HB3 PRO 27 3HB PRO 27 -12.976 28.492 -36.779 201 HG2 PRO 27 2HG PRO 27 -15.461 27.073 -35.761 202 HG3 PRO 27 3HG PRO 27 -14.645 26.885 -37.345 203 HD2 PRO 27 2HD PRO 27 -14.191 25.167 -35.292 204 HD3 PRO 27 3HD PRO 27 -12.867 25.657 -36.390 205 H ARG 28 H ARG 28 -12.288 29.418 -32.662 206 HA ARG 28 HA ARG 28 -14.890 29.416 -31.207 207 HB2 ARG 28 2HB ARG 28 -13.959 28.340 -29.309 208 HB3 ARG 28 3HB ARG 28 -13.576 27.367 -30.718 209 HG2 ARG 28 2HG ARG 28 -11.242 28.483 -30.690 210 HG3 ARG 28 3HG ARG 28 -11.711 29.161 -29.119 211 HD2 ARG 28 2HD ARG 28 -12.236 26.784 -28.371 212 HD3 ARG 28 3HD ARG 28 -11.504 26.214 -29.881 213 HE ARG 28 HE ARG 28 -9.615 27.927 -28.595 214 HH11 ARG 28 1HH2 ARG 28 -10.998 24.711 -27.874 215 HH12 ARG 28 2HH2 ARG 28 -9.924 24.594 -26.495 216 HH21 ARG 28 1HH1 ARG 28 -8.181 27.427 -27.131 217 HH22 ARG 28 2HH1 ARG 28 -8.234 25.837 -26.299 218 H GLN 29 H GLN 29 -14.838 30.476 -29.143 219 HA GLN 29 HA GLN 29 -13.311 33.034 -29.018 220 HB2 GLN 29 2HB GLN 29 -16.304 32.752 -28.558 221 HB3 GLN 29 3HB GLN 29 -15.355 34.230 -28.473 222 HG2 GLN 29 2HG GLN 29 -15.720 34.644 -30.651 223 HG3 GLN 29 3HG GLN 29 -15.027 33.091 -31.118 224 HE21 GLN 29 1HE2 GLN 29 -16.706 31.215 -30.127 225 HE22 GLN 29 2HE2 GLN 29 -18.295 31.396 -30.877 226 H ILE 30 H ILE 30 -12.243 32.759 -27.134 227 HA ILE 30 HA ILE 30 -13.501 31.353 -24.831 228 HB ILE 30 HB ILE 30 -10.753 32.629 -24.791 229 HG12 ILE 30 2HG1 ILE 30 -10.606 31.197 -26.705 230 HG13 ILE 30 3HG1 ILE 30 -9.750 30.485 -25.353 231 HG21 ILE 30 1HG2 ILE 30 -10.436 30.879 -23.024 232 HG22 ILE 30 2HG2 ILE 30 -11.731 32.024 -22.646 233 HG23 ILE 30 3HG2 ILE 30 -12.135 30.401 -23.225 234 HD11 ILE 30 3HD1 ILE 30 -11.610 28.907 -24.974 235 HD12 ILE 30 1HD1 ILE 30 -12.496 29.617 -26.352 236 HD13 ILE 30 2HD1 ILE 30 -10.954 28.786 -26.606 237 H ALA 31 H ALA 31 -15.047 32.656 -23.886 238 HA ALA 31 HA ALA 31 -14.413 35.526 -23.374 239 HB1 ALA 31 3HB ALA 31 -16.827 35.696 -22.829 240 HB2 ALA 31 1HB ALA 31 -16.485 35.187 -24.491 241 HB3 ALA 31 2HB ALA 31 -17.020 33.987 -23.279 242 H ARG 32 H ARG 32 -14.295 36.385 -21.389 243 HA ARG 32 HA ARG 32 -14.121 34.516 -19.063 244 HB2 ARG 32 2HB ARG 32 -12.896 37.188 -19.696 245 HB3 ARG 32 3HB ARG 32 -13.241 36.819 -18.005 246 HG2 ARG 32 2HG ARG 32 -11.859 34.947 -17.916 247 HG3 ARG 32 3HG ARG 32 -11.737 34.826 -19.677 248 HD2 ARG 32 2HD ARG 32 -9.676 35.694 -18.922 249 HD3 ARG 32 3HD ARG 32 -10.543 37.032 -19.696 250 HE ARG 32 HE ARG 32 -11.170 37.333 -17.017 251 HH11 ARG 32 2HH2 ARG 32 -8.047 37.132 -18.683 252 HH12 ARG 32 1HH2 ARG 32 -7.298 38.148 -17.478 253 HH21 ARG 32 1HH1 ARG 32 -10.148 38.608 -15.615 254 HH22 ARG 32 2HH1 ARG 32 -8.440 38.972 -15.795 255 H TYR 33 H TYR 33 -15.189 34.851 -17.154 256 HA TYR 33 HA TYR 33 -17.242 36.967 -17.029 257 HB2 TYR 33 2HB TYR 33 -17.864 34.033 -16.545 258 HB3 TYR 33 3HB TYR 33 -18.914 35.368 -16.169 259 HD1 TYR 33 HD1 TYR 33 -17.234 33.622 -19.026 260 HD2 TYR 33 HD2 TYR 33 -20.410 36.215 -17.733 261 HE1 TYR 33 HE1 TYR 33 -18.323 33.414 -21.251 262 HE2 TYR 33 HE2 TYR 33 -21.477 36.042 -19.970 263 HH TYR 33 HH TYR 33 -21.455 35.043 -21.955 264 H ARG 34 H ARG 34 -17.622 37.718 -15.012 265 HA ARG 34 HA ARG 34 -15.962 36.668 -12.767 266 HB2 ARG 34 2HB ARG 34 -15.526 38.978 -13.715 267 HB3 ARG 34 3HB ARG 34 -17.102 39.481 -13.100 268 HG2 ARG 34 2HG ARG 34 -16.438 39.077 -10.809 269 HG3 ARG 34 3HG ARG 34 -15.031 38.144 -11.320 270 HD2 ARG 34 2HD ARG 34 -14.267 40.393 -12.468 271 HD3 ARG 34 3HD ARG 34 -15.431 41.134 -11.351 272 HE ARG 34 HE ARG 34 -13.538 39.227 -10.134 273 HH11 ARG 34 1HH2 ARG 34 -13.857 42.623 -10.957 274 HH12 ARG 34 2HH2 ARG 34 -12.625 43.091 -9.817 275 HH21 ARG 34 1HH1 ARG 34 -12.023 39.870 -8.738 276 HH22 ARG 34 2HH1 ARG 34 -11.606 41.555 -8.582 277 H THR 35 H THR 35 -16.854 35.878 -11.034 278 HA THR 35 HA THR 35 -19.757 35.569 -10.845 279 HB THR 35 HB THR 35 -19.329 34.148 -8.916 280 HG1 THR 35 HG1 THR 35 -16.617 34.612 -9.376 281 HG21 THR 35 1HG2 THR 35 -17.483 33.527 -11.236 282 HG22 THR 35 2HG2 THR 35 -17.985 32.414 -9.948 283 HG23 THR 35 3HG2 THR 35 -19.196 33.092 -11.062 284 H ASP 36 H ASP 36 -20.605 35.654 -8.420 285 HA ASP 36 HA ASP 36 -20.581 38.434 -7.763 286 HB2 ASP 36 2HB ASP 36 -22.580 36.905 -7.655 287 HB3 ASP 36 3HB ASP 36 -21.850 36.096 -6.268 288 H ASN 37 H ASN 37 -18.531 35.863 -6.625 289 HA ASN 37 HA ASN 37 -17.784 37.463 -4.226 290 HB2 ASN 37 2HB ASN 37 -16.324 35.009 -5.019 291 HB3 ASN 37 3HB ASN 37 -16.525 35.730 -3.460 292 HD21 ASN 37 1HD2 ASN 37 -16.961 33.017 -4.550 293 HD22 ASN 37 2HD2 ASN 37 -18.581 32.589 -3.946 294 H GLY 38 H GLY 38 -17.202 37.869 -7.407 295 HA2 GLY 38 HA2 GLY 38 -15.578 39.109 -8.528 296 HA3 GLY 38 HA3 GLY 38 -14.477 38.991 -7.152 297 H GLU 39 H GLU 39 -15.647 35.894 -7.838 298 HA GLU 39 HA GLU 39 -12.978 35.070 -8.660 299 HB2 GLU 39 2HB GLU 39 -15.346 33.207 -8.794 300 HB3 GLU 39 3HB GLU 39 -13.677 32.872 -8.438 301 HG2 GLU 39 2HG GLU 39 -14.268 34.485 -6.317 302 HG3 GLU 39 3HG GLU 39 -15.902 33.938 -6.751 303 H GLU 40 H GLU 40 -12.261 35.237 -10.709 304 HA GLU 40 HA GLU 40 -14.194 35.311 -12.967 305 HB2 GLU 40 2HB GLU 40 -11.248 36.014 -12.746 306 HB3 GLU 40 3HB GLU 40 -12.144 35.964 -14.273 307 HG2 GLU 40 2HG GLU 40 -13.761 37.603 -13.385 308 HG3 GLU 40 3HG GLU 40 -12.825 37.717 -11.888 309 H PHE 41 H PHE 41 -14.451 33.832 -14.427 310 HA PHE 41 HA PHE 41 -12.500 31.597 -14.787 311 HB2 PHE 41 2HB PHE 41 -15.528 31.458 -14.756 312 HB3 PHE 41 3HB PHE 41 -14.484 30.152 -15.240 313 HD1 PHE 41 HD1 PHE 41 -15.482 32.229 -12.240 314 HD2 PHE 41 HD2 PHE 41 -13.441 28.697 -13.696 315 HE1 PHE 41 HE1 PHE 41 -15.168 31.437 -9.952 316 HE2 PHE 41 HE2 PHE 41 -13.102 27.938 -11.362 317 HZ PHE 41 HZ PHE 41 -13.934 29.324 -9.476 318 H GLU 42 H GLU 42 -12.646 30.543 -16.817 319 HA GLU 42 HA GLU 42 -13.377 32.339 -19.072 320 HB2 GLU 42 2HB GLU 42 -11.329 30.096 -19.180 321 HB3 GLU 42 3HB GLU 42 -11.665 31.368 -20.345 322 HG2 GLU 42 2HG GLU 42 -9.900 32.385 -19.461 323 HG3 GLU 42 3HG GLU 42 -11.025 32.927 -18.229 324 H VAL 43 H VAL 43 -14.799 31.697 -20.519 325 HA VAL 43 HA VAL 43 -15.753 28.858 -20.622 326 HB VAL 43 HB VAL 43 -17.384 31.353 -21.136 327 HG11 VAL 43 1HG1 VAL 43 -18.227 28.446 -20.824 328 HG12 VAL 43 2HG1 VAL 43 -19.265 29.850 -21.178 329 HG13 VAL 43 3HG1 VAL 43 -18.108 29.303 -22.376 330 HG21 VAL 43 3HG2 VAL 43 -17.528 29.517 -18.720 331 HG22 VAL 43 1HG2 VAL 43 -16.785 31.136 -18.706 332 HG23 VAL 43 2HG2 VAL 43 -18.490 30.977 -19.062 333 HA PRO 44 HA PRO 44 -14.451 29.422 -24.964 334 HB2 PRO 44 2HB PRO 44 -14.844 26.475 -24.980 335 HB3 PRO 44 3HB PRO 44 -13.466 27.414 -25.586 336 HG2 PRO 44 2HG PRO 44 -13.310 25.994 -23.255 337 HG3 PRO 44 3HG PRO 44 -12.537 27.604 -23.393 338 HD2 PRO 44 2HD PRO 44 -15.194 26.908 -22.125 339 HD3 PRO 44 3HD PRO 44 -13.899 28.019 -21.565 340 H PHE 45 H PHE 45 -15.841 29.969 -26.443 341 HA PHE 45 HA PHE 45 -18.425 28.484 -26.885 342 HB2 PHE 45 2HB PHE 45 -17.672 31.390 -27.269 343 HB3 PHE 45 3HB PHE 45 -19.038 30.699 -28.084 344 HD1 PHE 45 HD2 PHE 45 -17.611 31.603 -24.791 345 HD2 PHE 45 HD1 PHE 45 -21.114 30.171 -26.854 346 HE1 PHE 45 HE2 PHE 45 -18.978 32.020 -22.768 347 HE2 PHE 45 HE1 PHE 45 -22.477 30.585 -24.811 348 HZ PHE 45 HZ PHE 45 -21.388 31.498 -22.752 349 H ALA 46 H ALA 46 -18.936 27.867 -28.967 350 HA ALA 46 HA ALA 46 -16.726 27.768 -30.945 351 HB1 ALA 46 3HB ALA 46 -17.984 25.703 -30.443 352 HB2 ALA 46 1HB ALA 46 -19.493 26.490 -30.965 353 HB3 ALA 46 2HB ALA 46 -18.188 26.196 -32.135 354 H ASP 47 H ASP 47 -17.078 28.455 -33.170 355 HA ASP 47 HA ASP 47 -18.150 31.032 -33.512 356 HB2 ASP 47 2HB ASP 47 -16.382 30.010 -34.871 357 HB3 ASP 47 3HB ASP 47 -17.540 28.875 -35.570 358 H ASP 48 H ASP 48 -19.862 28.020 -33.627 359 HA ASP 48 HA ASP 48 -22.211 28.914 -35.100 360 HB2 ASP 48 2HB ASP 48 -21.442 26.545 -34.840 361 HB3 ASP 48 3HB ASP 48 -21.844 26.634 -33.127 362 H ALA 49 H ALA 49 -21.029 29.634 -31.990 363 HA ALA 49 HA ALA 49 -23.689 30.541 -30.964 364 HB1 ALA 49 3HB ALA 49 -22.822 30.113 -28.717 365 HB2 ALA 49 1HB ALA 49 -22.750 28.630 -29.688 366 HB3 ALA 49 2HB ALA 49 -21.269 29.572 -29.389 367 H GLU 50 H GLU 50 -23.591 32.417 -29.530 368 HA GLU 50 HA GLU 50 -21.221 34.198 -29.809 369 HB2 GLU 50 2HB GLU 50 -24.107 34.961 -30.366 370 HB3 GLU 50 3HB GLU 50 -22.874 36.144 -29.910 371 HG2 GLU 50 2HG GLU 50 -21.490 35.542 -31.832 372 HG3 GLU 50 3HG GLU 50 -22.633 34.285 -32.296 373 H ILE 51 H ILE 51 -20.694 35.265 -28.071 374 HA ILE 51 HA ILE 51 -21.179 34.334 -25.540 375 HB ILE 51 HB ILE 51 -20.226 37.157 -26.033 376 HG12 ILE 51 2HG1 ILE 51 -19.035 35.830 -27.664 377 HG13 ILE 51 3HG1 ILE 51 -17.956 36.335 -26.369 378 HG21 ILE 51 1HG2 ILE 51 -18.804 36.726 -24.079 379 HG22 ILE 51 2HG2 ILE 51 -20.497 36.444 -23.654 380 HG23 ILE 51 3HG2 ILE 51 -19.414 35.079 -23.960 381 HD11 ILE 51 3HD1 ILE 51 -18.158 33.998 -25.408 382 HD12 ILE 51 1HD1 ILE 51 -19.118 33.558 -26.836 383 HD13 ILE 51 2HD1 ILE 51 -17.429 34.076 -27.007 384 HA PRO 52 HA PRO 52 -24.991 36.629 -24.520 385 HB2 PRO 52 2HB PRO 52 -25.675 35.102 -22.367 386 HB3 PRO 52 3HB PRO 52 -25.990 34.593 -24.057 387 HG2 PRO 52 2HG PRO 52 -23.743 33.759 -22.218 388 HG3 PRO 52 3HG PRO 52 -24.722 32.741 -23.330 389 HD2 PRO 52 2HD PRO 52 -22.193 33.760 -23.906 390 HD3 PRO 52 3HD PRO 52 -23.368 33.352 -25.158 391 H GLY 53 H GLY 53 -25.312 38.164 -22.936 392 HA2 GLY 53 HA2 GLY 53 -23.246 39.537 -21.759 393 HA3 GLY 53 HA3 GLY 53 -24.919 39.620 -21.197 394 H THR 54 H THR 54 -24.925 36.782 -20.238 395 HA THR 54 HA THR 54 -22.740 36.701 -18.292 396 HB THR 54 HB THR 54 -24.302 36.098 -16.427 397 HG1 THR 54 HG1 THR 54 -26.377 36.926 -18.196 398 HG21 THR 54 1HG2 THR 54 -23.777 38.513 -16.664 399 HG22 THR 54 2HG2 THR 54 -25.252 38.738 -17.603 400 HG23 THR 54 3HG2 THR 54 -25.340 38.207 -15.906 401 H TRP 55 H TRP 55 -22.528 34.577 -17.210 402 HA TRP 55 HA TRP 55 -23.858 32.244 -18.372 403 HB2 TRP 55 2HB TRP 55 -22.078 32.917 -20.049 404 HB3 TRP 55 3HB TRP 55 -20.876 32.626 -18.799 405 HD1 TRP 55 HD1 TRP 55 -20.293 30.142 -18.243 406 HE1 TRP 55 HE1 TRP 55 -20.607 27.945 -19.492 407 HE3 TRP 55 HE3 TRP 55 -23.911 31.632 -21.485 408 HZ2 TRP 55 HZ2 TRP 55 -22.381 26.891 -21.551 409 HZ3 TRP 55 HZ3 TRP 55 -24.938 30.008 -23.086 410 HH2 TRP 55 HH2 TRP 55 -24.171 27.644 -23.126 411 H LEU 56 H LEU 56 -23.461 30.310 -17.142 412 HA LEU 56 HA LEU 56 -22.770 30.788 -14.380 413 HB2 LEU 56 2HB LEU 56 -24.335 28.949 -15.769 414 HB3 LEU 56 3HB LEU 56 -22.961 27.981 -15.232 415 HG LEU 56 HG LEU 56 -24.628 29.737 -13.387 416 HD11 LEU 56 1HD1 LEU 56 -24.807 26.737 -13.892 417 HD12 LEU 56 2HD1 LEU 56 -25.703 27.645 -12.652 418 HD13 LEU 56 3HD1 LEU 56 -26.015 27.952 -14.368 419 HD21 LEU 56 3HD2 LEU 56 -22.655 27.474 -12.824 420 HD22 LEU 56 1HD2 LEU 56 -22.386 29.193 -12.497 421 HD23 LEU 56 2HD2 LEU 56 -23.639 28.322 -11.607 422 H CYS 57 H CYS 57 -20.891 30.612 -13.380 423 HA CYS 57 HA CYS 57 -18.493 29.679 -14.857 424 HB2 CYS 57 2HB CYS 57 -18.883 31.285 -12.305 425 HB3 CYS 57 3HB CYS 57 -17.310 30.727 -12.883 426 HG CYS 57 HG CYS 57 -17.509 33.224 -13.521 427 H ARG 58 H ARG 58 -16.840 28.429 -13.720 428 HA ARG 58 HA ARG 58 -17.961 25.972 -12.758 429 HB2 ARG 58 2HB ARG 58 -15.028 26.784 -12.768 430 HB3 ARG 58 3HB ARG 58 -15.681 25.150 -12.667 431 HG2 ARG 58 2HG ARG 58 -16.744 25.508 -14.950 432 HG3 ARG 58 3HG ARG 58 -15.899 27.062 -15.031 433 HD2 ARG 58 2HD ARG 58 -14.631 25.514 -16.277 434 HD3 ARG 58 3HD ARG 58 -13.720 25.871 -14.802 435 HE ARG 58 HE ARG 58 -15.074 23.611 -14.077 436 HH11 ARG 58 1HH2 ARG 58 -13.158 24.219 -16.968 437 HH12 ARG 58 2HH2 ARG 58 -12.694 22.525 -17.066 438 HH21 ARG 58 1HH1 ARG 58 -14.361 21.477 -14.331 439 HH22 ARG 58 2HH1 ARG 58 -13.275 21.116 -15.658 440 H ASN 59 H ASN 59 -17.148 28.740 -10.958 441 HA ASN 59 HA ASN 59 -16.748 27.520 -8.390 442 HB2 ASN 59 2HB ASN 59 -16.179 29.816 -8.861 443 HB3 ASN 59 3HB ASN 59 -17.850 30.209 -9.272 444 HD21 ASN 59 1HD2 ASN 59 -17.815 31.941 -7.769 445 HD22 ASN 59 2HD2 ASN 59 -17.763 31.637 -6.042 446 H GLY 60 H GLY 60 -19.533 27.772 -10.424 447 HA2 GLY 60 HA2 GLY 60 -21.646 26.777 -10.104 448 HA3 GLY 60 HA3 GLY 60 -21.402 26.735 -8.356 449 H MET 61 H MET 61 -20.563 29.759 -9.813 450 HA MET 61 HA MET 61 -23.154 30.992 -9.010 451 HB2 MET 61 2HB MET 61 -21.134 31.496 -7.585 452 HB3 MET 61 3HB MET 61 -20.373 32.219 -8.979 453 HG2 MET 61 2HG MET 61 -21.385 33.906 -7.507 454 HG3 MET 61 3HG MET 61 -22.082 33.937 -9.121 455 HE1 MET 61 3HE MET 61 -22.858 31.620 -5.927 456 HE2 MET 61 1HE MET 61 -22.606 33.277 -5.330 457 HE3 MET 61 2HE MET 61 -24.219 32.538 -5.253 458 H GLU 62 H GLU 62 -24.041 32.576 -10.341 459 HA GLU 62 HA GLU 62 -23.490 32.439 -13.177 460 HB2 GLU 62 2HB GLU 62 -25.734 32.813 -12.239 461 HB3 GLU 62 3HB GLU 62 -25.221 34.387 -11.618 462 HG2 GLU 62 2HG GLU 62 -24.771 35.162 -13.932 463 HG3 GLU 62 3HG GLU 62 -25.179 33.563 -14.559 464 H GLY 63 H GLY 63 -21.724 33.266 -14.062 465 HA2 GLY 63 HA2 GLY 63 -20.351 35.603 -12.948 466 HA3 GLY 63 HA3 GLY 63 -19.784 34.592 -14.263 467 H THR 64 H THR 64 -20.062 37.558 -14.063 468 HA THR 64 HA THR 64 -21.788 37.993 -16.461 469 HB THR 64 HB THR 64 -20.618 40.056 -14.554 470 HG1 THR 64 HG1 THR 64 -22.268 38.855 -13.599 471 HG21 THR 64 1HG2 THR 64 -22.561 40.347 -16.896 472 HG22 THR 64 2HG2 THR 64 -22.335 41.582 -15.637 473 HG23 THR 64 3HG2 THR 64 -20.985 41.137 -16.684 474 H LEU 65 H LEU 65 -21.006 38.826 -18.322 475 HA LEU 65 HA LEU 65 -18.410 38.063 -19.086 476 HB2 LEU 65 2HB LEU 65 -20.529 38.207 -20.406 477 HB3 LEU 65 3HB LEU 65 -20.396 39.946 -20.408 478 HG LEU 65 HG LEU 65 -18.734 37.855 -21.856 479 HD11 LEU 65 1HD1 LEU 65 -20.906 38.624 -22.805 480 HD12 LEU 65 2HD1 LEU 65 -20.307 40.294 -22.804 481 HD13 LEU 65 3HD1 LEU 65 -19.541 39.072 -23.839 482 HD21 LEU 65 3HD2 LEU 65 -17.463 39.737 -22.935 483 HD22 LEU 65 1HD2 LEU 65 -18.051 40.811 -21.646 484 HD23 LEU 65 2HD2 LEU 65 -17.011 39.403 -21.274 485 H ILE 66 H ILE 66 -16.494 39.013 -18.784 486 HA ILE 66 HA ILE 66 -16.226 41.969 -18.871 487 HB ILE 66 HB ILE 66 -14.561 42.037 -17.198 488 HG12 ILE 66 2HG1 ILE 66 -13.377 39.983 -17.306 489 HG13 ILE 66 3HG1 ILE 66 -14.014 40.136 -15.672 490 HG21 ILE 66 1HG2 ILE 66 -16.883 42.307 -16.471 491 HG22 ILE 66 2HG2 ILE 66 -16.959 40.592 -16.030 492 HG23 ILE 66 3HG2 ILE 66 -15.843 41.675 -15.183 493 HD11 ILE 66 3HD1 ILE 66 -14.910 38.313 -17.832 494 HD12 ILE 66 1HD1 ILE 66 -14.238 37.897 -16.252 495 HD13 ILE 66 2HD1 ILE 66 -15.874 38.592 -16.361 496 H GLU 67 H GLU 67 -14.197 42.743 -19.601 497 HA GLU 67 HA GLU 67 -12.709 40.897 -21.386 498 HB2 GLU 67 2HB GLU 67 -11.576 42.849 -22.219 499 HB3 GLU 67 3HB GLU 67 -13.315 43.002 -22.390 500 HG2 GLU 67 2HG GLU 67 -11.775 44.323 -20.109 501 HG3 GLU 67 3HG GLU 67 -11.965 45.067 -21.683 502 H GLY 68 H GLY 68 -10.454 40.614 -21.243 503 HA2 GLY 68 HA2 GLY 68 -8.853 41.798 -19.157 504 HA3 GLY 68 HA3 GLY 68 -9.275 40.137 -18.740 505 H ASP 69 H ASP 69 -9.101 39.028 -21.493 506 HA ASP 69 HA ASP 69 -6.529 39.698 -22.583 507 HB2 ASP 69 2HB ASP 69 -5.560 37.529 -22.330 508 HB3 ASP 69 3HB ASP 69 -5.924 38.181 -20.738 509 H LEU 70 H LEU 70 -6.121 38.010 -24.347 510 HA LEU 70 HA LEU 70 -8.107 38.573 -26.309 511 HB2 LEU 70 2HB LEU 70 -5.424 37.199 -26.345 512 HB3 LEU 70 3HB LEU 70 -6.487 37.042 -27.728 513 HG LEU 70 HG LEU 70 -6.625 39.505 -27.961 514 HD11 LEU 70 1HD1 LEU 70 -4.472 39.529 -25.798 515 HD12 LEU 70 2HD1 LEU 70 -4.890 40.904 -26.843 516 HD13 LEU 70 3HD1 LEU 70 -6.084 40.283 -25.704 517 HD21 LEU 70 3HD2 LEU 70 -3.805 38.351 -27.971 518 HD22 LEU 70 1HD2 LEU 70 -5.016 38.161 -29.259 519 HD23 LEU 70 2HD2 LEU 70 -4.366 39.764 -28.894 520 HA PRO 71 HA PRO 71 -10.428 34.798 -25.765 521 HB2 PRO 71 2HB PRO 71 -12.578 35.314 -27.341 522 HB3 PRO 71 3HB PRO 71 -12.176 36.372 -25.961 523 HG2 PRO 71 2HG PRO 71 -11.346 36.788 -28.857 524 HG3 PRO 71 3HG PRO 71 -12.260 37.919 -27.800 525 HD2 PRO 71 2HD PRO 71 -9.560 38.088 -28.026 526 HD3 PRO 71 3HD PRO 71 -10.371 38.347 -26.455 527 H GLU 72 H GLU 72 -8.146 34.296 -27.419 528 HA GLU 72 HA GLU 72 -7.254 33.679 -29.426 529 HB2 GLU 72 2HB GLU 72 -9.375 31.656 -28.840 530 HB3 GLU 72 3HB GLU 72 -8.345 31.491 -30.286 531 HG2 GLU 72 2HG GLU 72 -6.339 31.667 -28.772 532 HG3 GLU 72 3HG GLU 72 -7.446 31.576 -27.398 533 HA PRO 73 HA PRO 73 -10.522 35.925 -31.895 534 HB2 PRO 73 2HB PRO 73 -9.236 38.267 -32.427 535 HB3 PRO 73 3HB PRO 73 -10.026 37.943 -30.852 536 HG2 PRO 73 2HG PRO 73 -7.089 37.598 -31.562 537 HG3 PRO 73 3HG PRO 73 -7.790 38.472 -30.161 538 HD2 PRO 73 2HD PRO 73 -6.918 35.895 -29.973 539 HD3 PRO 73 3HD PRO 73 -8.352 36.465 -29.077 540 H LYS 74 H LYS 74 -10.621 36.398 -34.142 541 HA LYS 74 HA LYS 74 -8.640 35.025 -35.829 542 HB2 LYS 74 2HB LYS 74 -11.108 34.810 -36.104 543 HB3 LYS 74 3HB LYS 74 -11.192 36.515 -36.573 544 HG2 LYS 74 2HG LYS 74 -9.786 36.051 -38.563 545 HG3 LYS 74 3HG LYS 74 -9.553 34.384 -38.019 546 HD2 LYS 74 2HD LYS 74 -11.191 34.346 -39.751 547 HD3 LYS 74 3HD LYS 74 -12.034 34.011 -38.232 548 HE2 LYS 74 2HE LYS 74 -12.774 36.393 -38.137 549 HE3 LYS 74 3HE LYS 74 -11.899 36.724 -39.638 550 HZ1 LYS 74 HZ1 LYS 74 -14.254 36.310 -40.058 551 HZ2 LYS 74 HZ2 LYS 74 -13.369 35.138 -40.764 552 HZ3 LYS 74 HZ3 LYS 74 -14.177 34.831 -39.377 553 H LYS 75 H LYS 75 -9.455 38.359 -35.109 554 HA LYS 75 HA LYS 75 -8.116 39.467 -37.433 555 HB2 LYS 75 2HB LYS 75 -10.273 40.254 -36.257 556 HB3 LYS 75 3HB LYS 75 -9.211 41.055 -35.096 557 HG2 LYS 75 2HG LYS 75 -8.180 42.336 -37.012 558 HG3 LYS 75 3HG LYS 75 -9.261 41.486 -38.127 559 HD2 LYS 75 2HD LYS 75 -11.226 42.456 -36.966 560 HD3 LYS 75 3HD LYS 75 -10.144 43.294 -35.831 561 HE2 LYS 75 2HE LYS 75 -9.103 44.512 -37.732 562 HE3 LYS 75 3HE LYS 75 -10.182 43.683 -38.860 563 HZ1 LYS 75 HZ1 LYS 75 -12.067 44.743 -37.731 564 HZ2 LYS 75 HZ2 LYS 75 -11.069 45.511 -36.688 565 HZ3 LYS 75 HZ3 LYS 75 -11.033 45.881 -38.277 566 H VAL 76 H VAL 76 -6.254 38.027 -36.034 567 HA VAL 76 HA VAL 76 -4.210 40.107 -35.415 568 HB VAL 76 HB VAL 76 -3.246 38.711 -33.629 569 HG11 VAL 76 1HG1 VAL 76 -4.754 40.590 -33.080 570 HG12 VAL 76 2HG1 VAL 76 -6.131 39.468 -33.045 571 HG13 VAL 76 3HG1 VAL 76 -4.806 39.292 -31.878 572 HG21 VAL 76 3HG2 VAL 76 -4.208 36.496 -34.241 573 HG22 VAL 76 1HG2 VAL 76 -4.546 36.932 -32.561 574 HG23 VAL 76 2HG2 VAL 76 -5.819 37.085 -33.785 575 H LYS 77 H LYS 77 -4.819 38.679 -37.837 576 HA LYS 77 HA LYS 77 -2.186 37.446 -38.412 577 HB2 LYS 77 2HB LYS 77 -3.799 35.645 -37.767 578 HB3 LYS 77 3HB LYS 77 -4.856 36.142 -39.094 579 HG2 LYS 77 2HG LYS 77 -3.071 35.567 -40.725 580 HG3 LYS 77 3HG LYS 77 -1.993 35.128 -39.383 581 HD2 LYS 77 2HD LYS 77 -3.582 33.328 -38.711 582 HD3 LYS 77 3HD LYS 77 -4.676 33.819 -40.008 583 HE2 LYS 77 2HE LYS 77 -3.509 31.903 -40.798 584 HE3 LYS 77 3HE LYS 77 -2.893 33.296 -41.689 585 HZ1 LYS 77 HZ1 LYS 77 -1.540 32.017 -39.366 586 HZ2 LYS 77 HZ2 LYS 77 -1.104 31.826 -40.924 587 HZ3 LYS 77 HZ3 LYS 77 -0.943 33.283 -40.213 588 HA PRO 78 HA PRO 78 -2.645 40.002 -42.055 589 HB2 PRO 78 2HB PRO 78 -1.012 37.861 -43.427 590 HB3 PRO 78 3HB PRO 78 -0.804 39.639 -43.479 591 HG2 PRO 78 2HG PRO 78 0.793 38.153 -41.890 592 HG3 PRO 78 3HG PRO 78 0.079 39.673 -41.250 593 HD2 PRO 78 2HD PRO 78 -0.877 36.827 -40.833 594 HD3 PRO 78 3HD PRO 78 -0.653 38.137 -39.633 595 HA PRO 79 HA PRO 79 -5.914 38.120 -44.477 596 HB2 PRO 79 2HB PRO 79 -6.071 39.750 -46.658 597 HB3 PRO 79 3HB PRO 79 -6.512 40.293 -45.010 598 HG2 PRO 79 2HG PRO 79 -3.865 40.690 -46.450 599 HG3 PRO 79 3HG PRO 79 -4.865 41.927 -45.621 600 HD2 PRO 79 2HD PRO 79 -2.762 40.720 -44.388 601 HD3 PRO 79 3HD PRO 79 -4.253 41.123 -43.486 602 H ARG 80 H ARG 80 -6.398 37.022 -46.480 603 HA ARG 80 HA ARG 80 -4.174 35.463 -47.585 604 HB2 ARG 80 2HB ARG 80 -7.163 35.449 -48.174 605 HB3 ARG 80 3HB ARG 80 -5.984 34.343 -48.888 606 HG2 ARG 80 2HG ARG 80 -5.386 33.499 -46.627 607 HG3 ARG 80 3HG ARG 80 -6.610 34.567 -45.910 608 HD2 ARG 80 2HD ARG 80 -8.372 33.442 -47.234 609 HD3 ARG 80 3HD ARG 80 -7.150 32.372 -47.950 610 HE ARG 80 HE ARG 80 -6.969 32.176 -45.119 611 HH11 ARG 80 2HH2 ARG 80 -9.209 31.230 -47.639 612 HH12 ARG 80 1HH2 ARG 80 -9.824 29.886 -46.713 613 HH21 ARG 80 1HH1 ARG 80 -7.797 30.450 -43.997 614 HH22 ARG 80 2HH1 ARG 80 -9.041 29.463 -44.708 Start of MODEL 11 1 H1 SER 1 1H SER 1 4.617 29.845 -11.345 2 H2 SER 1 2H SER 1 4.177 29.808 -12.923 3 H3 SER 1 3H SER 1 3.621 31.001 -11.954 4 HA SER 1 HA SER 1 6.423 30.537 -12.708 5 HB2 SER 1 2HB SER 1 4.597 32.747 -13.705 6 HB3 SER 1 3HB SER 1 6.309 32.503 -14.114 7 HG SER 1 HG SER 1 4.914 31.590 -15.688 8 H MET 2 H MET 2 4.418 33.351 -11.545 9 HA MET 2 HA MET 2 6.150 33.616 -9.179 10 HB2 MET 2 2HB MET 2 6.719 35.944 -9.640 11 HB3 MET 2 3HB MET 2 7.372 34.887 -10.890 12 HG2 MET 2 2HG MET 2 5.480 35.507 -12.387 13 HG3 MET 2 3HG MET 2 4.860 36.594 -11.140 14 HE1 MET 2 3HE MET 2 5.420 37.391 -14.191 15 HE2 MET 2 1HE MET 2 4.728 38.481 -12.967 16 HE3 MET 2 2HE MET 2 6.112 39.011 -13.952 17 H ALA 3 H ALA 3 5.256 34.897 -7.516 18 HA ALA 3 HA ALA 3 2.345 35.326 -7.612 19 HB1 ALA 3 3HB ALA 3 3.426 34.339 -5.632 20 HB2 ALA 3 1HB ALA 3 4.402 35.813 -5.415 21 HB3 ALA 3 2HB ALA 3 2.636 35.878 -5.236 22 H ASP 4 H ASP 4 5.292 37.295 -7.641 23 HA ASP 4 HA ASP 4 3.807 39.696 -8.525 24 HB2 ASP 4 2HB ASP 4 5.670 39.566 -6.117 25 HB3 ASP 4 3HB ASP 4 5.287 41.061 -6.954 26 H ARG 5 H ARG 5 6.691 40.370 -10.503 27 HA ARG 5 HA ARG 5 3.799 40.419 -10.521 28 HB2 ARG 5 2HB ARG 5 3.552 42.857 -10.205 29 HB3 ARG 5 3HB ARG 5 4.102 42.073 -8.735 30 HG2 ARG 5 2HG ARG 5 6.435 42.834 -9.194 31 HG3 ARG 5 3HG ARG 5 5.870 43.634 -10.675 32 HD2 ARG 5 2HD ARG 5 4.356 45.054 -9.334 33 HD3 ARG 5 3HD ARG 5 4.912 44.249 -7.851 34 HE ARG 5 HE ARG 5 7.196 45.247 -9.214 35 HH11 ARG 5 1HH1 ARG 5 4.445 46.583 -7.503 36 HH12 ARG 5 2HH1 ARG 5 5.311 48.025 -7.051 37 HH21 ARG 5 1HH2 ARG 5 8.242 47.110 -8.602 38 HH22 ARG 5 2HH2 ARG 5 7.405 48.308 -7.660 39 H VAL 6 H VAL 6 2.957 41.609 -12.336 40 HA VAL 6 HA VAL 6 4.802 41.648 -14.649 41 HB VAL 6 HB VAL 6 1.776 41.916 -14.539 42 HG11 VAL 6 1HG1 VAL 6 2.617 43.085 -16.515 43 HG12 VAL 6 2HG1 VAL 6 3.701 41.722 -16.906 44 HG13 VAL 6 3HG1 VAL 6 1.941 41.535 -17.006 45 HG21 VAL 6 3HG2 VAL 6 2.541 39.634 -13.981 46 HG22 VAL 6 1HG2 VAL 6 1.833 39.661 -15.599 47 HG23 VAL 6 2HG2 VAL 6 3.597 39.622 -15.410 48 H LEU 7 H LEU 7 5.535 43.416 -15.537 49 HA LEU 7 HA LEU 7 5.322 45.877 -14.040 50 HB2 LEU 7 2HB LEU 7 7.331 46.487 -15.095 51 HB3 LEU 7 3HB LEU 7 7.465 44.797 -14.653 52 HG LEU 7 HG LEU 7 6.830 45.790 -17.472 53 HD11 LEU 7 1HD1 LEU 7 9.474 44.842 -16.289 54 HD12 LEU 7 2HD1 LEU 7 9.186 45.298 -17.984 55 HD13 LEU 7 3HD1 LEU 7 9.070 46.521 -16.714 56 HD21 LEU 7 3HD2 LEU 7 6.118 43.496 -17.317 57 HD22 LEU 7 1HD2 LEU 7 7.653 43.520 -18.163 58 HD23 LEU 7 2HD2 LEU 7 7.619 43.032 -16.458 59 H ARG 8 H ARG 8 3.399 44.969 -16.525 60 HA ARG 8 HA ARG 8 2.970 47.755 -17.499 61 HB2 ARG 8 2HB ARG 8 4.462 46.405 -19.069 62 HB3 ARG 8 3HB ARG 8 3.090 45.322 -19.328 63 HG2 ARG 8 2HG ARG 8 1.769 47.324 -20.153 64 HG3 ARG 8 3HG ARG 8 3.234 48.305 -19.979 65 HD2 ARG 8 2HD ARG 8 4.410 46.822 -21.578 66 HD3 ARG 8 3HD ARG 8 2.952 45.818 -21.718 67 HE ARG 8 HE ARG 8 2.408 48.602 -22.355 68 HH11 ARG 8 1HH1 ARG 8 3.800 45.725 -23.809 69 HH12 ARG 8 2HH1 ARG 8 3.454 46.282 -25.423 70 HH21 ARG 8 1HH2 ARG 8 2.021 49.244 -24.376 71 HH22 ARG 8 2HH2 ARG 8 2.473 48.242 -25.748 72 H GLY 9 H GLY 9 0.884 48.311 -17.834 73 HA2 GLY 9 HA2 GLY 9 -1.414 48.183 -18.037 74 HA3 GLY 9 HA3 GLY 9 -1.311 46.433 -18.193 75 H SER 10 H SER 10 -3.361 47.654 -16.828 76 HA SER 10 HA SER 10 -2.837 47.676 -13.953 77 HB2 SER 10 2HB SER 10 -5.450 47.978 -15.470 78 HB3 SER 10 3HB SER 10 -5.165 48.366 -13.762 79 HG SER 10 HG SER 10 -5.024 50.225 -15.111 80 H ARG 11 H ARG 11 -4.050 45.271 -16.164 81 HA ARG 11 HA ARG 11 -4.694 43.432 -13.882 82 HB2 ARG 11 2HB ARG 11 -6.389 43.901 -16.366 83 HB3 ARG 11 3HB ARG 11 -6.684 42.622 -15.192 84 HG2 ARG 11 2HG ARG 11 -6.777 45.605 -14.533 85 HG3 ARG 11 3HG ARG 11 -8.164 44.606 -14.943 86 HD2 ARG 11 2HD ARG 11 -7.767 43.144 -13.017 87 HD3 ARG 11 3HD ARG 11 -6.337 44.065 -12.564 88 HE ARG 11 HE ARG 11 -9.163 44.855 -12.248 89 HH11 ARG 11 1HH2 ARG 11 -5.838 46.016 -12.003 90 HH12 ARG 11 2HH2 ARG 11 -6.303 47.296 -10.912 91 HH21 ARG 11 1HH1 ARG 11 -9.648 46.538 -10.902 92 HH22 ARG 11 2HH1 ARG 11 -8.391 47.600 -10.341 93 H LEU 12 H LEU 12 -2.586 43.727 -16.317 94 HA LEU 12 HA LEU 12 -2.815 41.248 -17.706 95 HB2 LEU 12 2HB LEU 12 -1.559 43.326 -18.410 96 HB3 LEU 12 3HB LEU 12 -0.327 42.923 -17.214 97 HG LEU 12 HG LEU 12 0.187 40.823 -18.452 98 HD11 LEU 12 1HD1 LEU 12 -0.741 40.555 -20.769 99 HD12 LEU 12 2HD1 LEU 12 -1.943 40.303 -19.508 100 HD13 LEU 12 3HD1 LEU 12 -1.923 41.834 -20.409 101 HD21 LEU 12 3HD2 LEU 12 1.232 41.875 -20.398 102 HD22 LEU 12 1HD2 LEU 12 0.182 43.297 -20.214 103 HD23 LEU 12 2HD2 LEU 12 1.390 42.921 -18.977 104 H GLY 13 H GLY 13 -1.579 41.893 -14.510 105 HA2 GLY 13 HA2 GLY 13 -0.002 39.521 -14.104 106 HA3 GLY 13 HA3 GLY 13 -0.787 40.498 -12.862 107 H ALA 14 H ALA 14 -3.443 39.845 -14.499 108 HA ALA 14 HA ALA 14 -4.008 37.289 -13.113 109 HB1 ALA 14 3HB ALA 14 -5.401 39.273 -12.598 110 HB2 ALA 14 1HB ALA 14 -5.907 39.347 -14.303 111 HB3 ALA 14 2HB ALA 14 -6.346 37.949 -13.299 112 H VAL 15 H VAL 15 -2.446 37.276 -15.537 113 HA VAL 15 HA VAL 15 -4.187 35.667 -17.372 114 HB VAL 15 HB VAL 15 -1.933 37.562 -18.127 115 HG11 VAL 15 1HG1 VAL 15 -3.556 35.682 -19.863 116 HG12 VAL 15 2HG1 VAL 15 -2.553 37.008 -20.479 117 HG13 VAL 15 3HG1 VAL 15 -1.795 35.674 -19.617 118 HG21 VAL 15 3HG2 VAL 15 -3.734 38.721 -19.409 119 HG22 VAL 15 1HG2 VAL 15 -4.927 37.620 -18.685 120 HG23 VAL 15 2HG2 VAL 15 -4.022 38.761 -17.668 121 H SER 16 H SER 16 -3.519 33.750 -17.953 122 HA SER 16 HA SER 16 -0.872 32.722 -17.004 123 HB2 SER 16 2HB SER 16 -3.577 31.358 -16.761 124 HB3 SER 16 3HB SER 16 -2.016 30.714 -16.223 125 HG SER 16 HG SER 16 -3.199 31.678 -14.506 126 H TYR 17 H TYR 17 -1.913 33.498 -19.743 127 HA TYR 17 HA TYR 17 -1.276 31.059 -21.286 128 HB2 TYR 17 2HB TYR 17 -3.420 31.484 -22.635 129 HB3 TYR 17 3HB TYR 17 -3.577 30.711 -21.073 130 HD1 TYR 17 HD1 TYR 17 -4.151 33.888 -22.917 131 HD2 TYR 17 HD2 TYR 17 -4.731 31.740 -19.225 132 HE1 TYR 17 HE1 TYR 17 -5.739 35.653 -22.136 133 HE2 TYR 17 HE2 TYR 17 -6.275 33.527 -18.426 134 HH TYR 17 HH TYR 17 -7.063 36.383 -20.417 135 H GLU 18 H GLU 18 -1.082 31.504 -23.595 136 HA GLU 18 HA GLU 18 0.601 33.830 -23.941 137 HB2 GLU 18 2HB GLU 18 1.304 32.742 -26.009 138 HB3 GLU 18 3HB GLU 18 1.396 31.695 -24.602 139 HG2 GLU 18 2HG GLU 18 -0.697 30.547 -25.278 140 HG3 GLU 18 3HG GLU 18 -0.828 31.590 -26.692 141 H THR 19 H THR 19 -1.778 34.932 -23.630 142 HA THR 19 HA THR 19 -3.346 36.375 -24.410 143 HB THR 19 HB THR 19 -1.481 36.846 -26.754 144 HG1 THR 19 HG1 THR 19 -0.447 37.085 -24.757 145 HG21 THR 19 1HG2 THR 19 -3.693 37.939 -27.038 146 HG22 THR 19 2HG2 THR 19 -3.555 38.643 -25.409 147 HG23 THR 19 3HG2 THR 19 -2.426 39.117 -26.700 148 H ASP 20 H ASP 20 -5.022 34.946 -24.672 149 HA ASP 20 HA ASP 20 -5.388 33.393 -27.087 150 HB2 ASP 20 2HB ASP 20 -7.252 32.429 -25.990 151 HB3 ASP 20 3HB ASP 20 -5.946 32.576 -24.821 152 H ARG 21 H ARG 21 -5.361 36.256 -27.513 153 HA ARG 21 HA ARG 21 -7.995 36.670 -28.900 154 HB2 ARG 21 2HB ARG 21 -6.378 38.470 -27.280 155 HB3 ARG 21 3HB ARG 21 -6.326 39.027 -28.937 156 HG2 ARG 21 2HG ARG 21 -8.143 40.162 -28.079 157 HG3 ARG 21 3HG ARG 21 -8.915 38.830 -28.929 158 HD2 ARG 21 2HD ARG 21 -8.425 39.064 -25.920 159 HD3 ARG 21 3HD ARG 21 -9.965 39.264 -26.763 160 HE ARG 21 HE ARG 21 -8.539 36.665 -26.978 161 HH11 ARG 21 1HH2 ARG 21 -11.352 38.279 -25.482 162 HH12 ARG 21 2HH2 ARG 21 -12.028 36.700 -25.112 163 HH21 ARG 21 1HH1 ARG 21 -9.540 34.864 -26.507 164 HH22 ARG 21 2HH1 ARG 21 -11.062 34.894 -25.604 165 H ASN 22 H ASN 22 -4.843 35.684 -29.472 166 HA ASN 22 HA ASN 22 -4.584 36.690 -32.199 167 HB2 ASN 22 2HB ASN 22 -2.656 36.201 -30.677 168 HB3 ASN 22 3HB ASN 22 -3.084 34.489 -30.708 169 HD21 ASN 22 2HD2 ASN 22 -2.262 37.226 -32.929 170 HD22 ASN 22 1HD2 ASN 22 -1.402 36.196 -34.062 171 H HIS 23 H HIS 23 -4.579 35.332 -34.118 172 HA HIS 23 HA HIS 23 -6.968 33.756 -34.338 173 HB2 HIS 23 2HB HIS 23 -6.065 35.229 -36.113 174 HB3 HIS 23 3HB HIS 23 -4.695 34.133 -36.320 175 HD2 HIS 23 HD2 HIS 23 -5.045 32.688 -38.432 176 HE1 HIS 23 HE1 HIS 23 -9.238 31.949 -38.162 177 HE2 HIS 23 HE2 HIS 23 -7.126 31.473 -39.502 178 H ASP 24 H ASP 24 -7.222 31.598 -35.123 179 HA ASP 24 HA ASP 24 -5.058 29.672 -34.798 180 HB2 ASP 24 2HB ASP 24 -6.246 30.203 -32.474 181 HB3 ASP 24 3HB ASP 24 -7.517 29.163 -33.109 182 H LEU 25 H LEU 25 -5.779 27.429 -35.088 183 HA LEU 25 HA LEU 25 -7.865 27.002 -37.139 184 HB2 LEU 25 2HB LEU 25 -6.046 25.070 -35.638 185 HB3 LEU 25 3HB LEU 25 -7.180 24.617 -36.906 186 HG LEU 25 HG LEU 25 -4.731 26.402 -37.276 187 HD11 LEU 25 1HD1 LEU 25 -4.199 24.025 -36.880 188 HD12 LEU 25 2HD1 LEU 25 -5.300 23.553 -38.194 189 HD13 LEU 25 3HD1 LEU 25 -3.839 24.504 -38.547 190 HD21 LEU 25 3HD2 LEU 25 -5.191 26.134 -39.708 191 HD22 LEU 25 1HD2 LEU 25 -6.732 25.335 -39.321 192 HD23 LEU 25 2HD2 LEU 25 -6.464 27.043 -38.892 193 H ALA 26 H ALA 26 -9.560 25.439 -36.655 194 HA ALA 26 HA ALA 26 -11.500 24.945 -35.603 195 HB1 ALA 26 3HB ALA 26 -11.387 24.037 -33.338 196 HB2 ALA 26 1HB ALA 26 -10.060 23.435 -34.358 197 HB3 ALA 26 2HB ALA 26 -9.743 24.686 -33.144 198 HA PRO 27 HA PRO 27 -11.895 29.454 -34.664 199 HB2 PRO 27 2HB PRO 27 -14.463 28.905 -36.171 200 HB3 PRO 27 3HB PRO 27 -13.415 30.360 -36.207 201 HG2 PRO 27 2HG PRO 27 -13.209 28.524 -38.168 202 HG3 PRO 27 3HG PRO 27 -11.710 29.171 -37.419 203 HD2 PRO 27 2HD PRO 27 -13.145 26.570 -36.803 204 HD3 PRO 27 3HD PRO 27 -11.404 26.862 -37.101 205 H ARG 28 H ARG 28 -12.257 29.767 -32.668 206 HA ARG 28 HA ARG 28 -14.928 29.430 -31.426 207 HB2 ARG 28 2HB ARG 28 -14.037 28.331 -29.477 208 HB3 ARG 28 3HB ARG 28 -13.577 27.433 -30.923 209 HG2 ARG 28 2HG ARG 28 -11.327 28.737 -30.803 210 HG3 ARG 28 3HG ARG 28 -11.827 29.179 -29.165 211 HD2 ARG 28 2HD ARG 28 -11.996 26.798 -28.555 212 HD3 ARG 28 3HD ARG 28 -11.621 26.313 -30.212 213 HE ARG 28 HE ARG 28 -9.743 27.136 -28.156 214 HH11 ARG 28 1HH2 ARG 28 -10.096 26.999 -31.679 215 HH12 ARG 28 2HH2 ARG 28 -8.377 27.016 -31.912 216 HH21 ARG 28 1HH1 ARG 28 -7.549 27.228 -28.597 217 HH22 ARG 28 2HH1 ARG 28 -7.016 27.267 -30.270 218 H GLN 29 H GLN 29 -14.984 30.462 -29.253 219 HA GLN 29 HA GLN 29 -13.524 33.067 -29.113 220 HB2 GLN 29 2HB GLN 29 -16.503 32.692 -28.630 221 HB3 GLN 29 3HB GLN 29 -15.598 34.200 -28.547 222 HG2 GLN 29 2HG GLN 29 -15.987 34.609 -30.720 223 HG3 GLN 29 3HG GLN 29 -15.259 33.076 -31.197 224 HE21 GLN 29 1HE2 GLN 29 -16.872 31.148 -30.224 225 HE22 GLN 29 2HE2 GLN 29 -18.479 31.296 -30.936 226 H ILE 30 H ILE 30 -12.361 32.715 -27.324 227 HA ILE 30 HA ILE 30 -13.527 31.403 -24.934 228 HB ILE 30 HB ILE 30 -10.806 32.713 -25.030 229 HG12 ILE 30 2HG1 ILE 30 -10.675 31.243 -26.905 230 HG13 ILE 30 3HG1 ILE 30 -9.780 30.562 -25.561 231 HG21 ILE 30 1HG2 ILE 30 -12.024 30.463 -23.363 232 HG22 ILE 30 2HG2 ILE 30 -10.352 31.055 -23.242 233 HG23 ILE 30 3HG2 ILE 30 -11.697 32.122 -22.829 234 HD11 ILE 30 3HD1 ILE 30 -11.609 28.960 -25.132 235 HD12 ILE 30 1HD1 ILE 30 -12.535 29.649 -26.495 236 HD13 ILE 30 2HD1 ILE 30 -10.991 28.831 -26.783 237 H ALA 31 H ALA 31 -14.997 32.695 -23.922 238 HA ALA 31 HA ALA 31 -14.355 35.573 -23.445 239 HB1 ALA 31 3HB ALA 31 -16.918 33.972 -23.124 240 HB2 ALA 31 1HB ALA 31 -16.721 35.679 -22.668 241 HB3 ALA 31 2HB ALA 31 -16.544 35.197 -24.363 242 H ARG 32 H ARG 32 -14.515 36.403 -21.313 243 HA ARG 32 HA ARG 32 -14.127 34.432 -19.088 244 HB2 ARG 32 2HB ARG 32 -12.804 37.055 -19.743 245 HB3 ARG 32 3HB ARG 32 -13.063 36.664 -18.039 246 HG2 ARG 32 2HG ARG 32 -11.771 34.726 -18.121 247 HG3 ARG 32 3HG ARG 32 -11.872 34.554 -19.872 248 HD2 ARG 32 2HD ARG 32 -10.367 36.812 -18.488 249 HD3 ARG 32 3HD ARG 32 -9.635 35.274 -18.933 250 HE ARG 32 HE ARG 32 -10.171 37.489 -20.703 251 HH11 ARG 32 1HH1 ARG 32 -9.790 33.982 -20.762 252 HH12 ARG 32 2HH1 ARG 32 -9.185 34.033 -22.411 253 HH21 ARG 32 1HH2 ARG 32 -9.258 37.423 -22.635 254 HH22 ARG 32 2HH2 ARG 32 -8.811 35.895 -23.377 255 H TYR 33 H TYR 33 -15.125 34.794 -17.139 256 HA TYR 33 HA TYR 33 -17.165 36.932 -17.011 257 HB2 TYR 33 2HB TYR 33 -17.798 34.011 -16.551 258 HB3 TYR 33 3HB TYR 33 -18.844 35.345 -16.163 259 HD1 TYR 33 HD2 TYR 33 -17.187 33.592 -19.029 260 HD2 TYR 33 HD1 TYR 33 -20.321 36.228 -17.728 261 HE1 TYR 33 HE2 TYR 33 -18.317 33.371 -21.246 262 HE2 TYR 33 HE1 TYR 33 -21.414 36.043 -19.951 263 HH TYR 33 HH TYR 33 -21.427 35.028 -21.926 264 H ARG 34 H ARG 34 -17.523 37.709 -14.986 265 HA ARG 34 HA ARG 34 -15.927 36.630 -12.707 266 HB2 ARG 34 2HB ARG 34 -15.335 38.873 -13.542 267 HB3 ARG 34 3HB ARG 34 -16.983 39.437 -13.269 268 HG2 ARG 34 2HG ARG 34 -16.780 39.307 -10.902 269 HG3 ARG 34 3HG ARG 34 -15.400 38.202 -10.995 270 HD2 ARG 34 2HD ARG 34 -14.633 40.377 -10.290 271 HD3 ARG 34 3HD ARG 34 -13.978 39.956 -11.861 272 HE ARG 34 HE ARG 34 -16.304 41.816 -11.494 273 HH11 ARG 34 2HH2 ARG 34 -13.254 41.151 -13.206 274 HH12 ARG 34 1HH2 ARG 34 -13.278 42.735 -13.930 275 HH21 ARG 34 1HH1 ARG 34 -16.247 43.746 -12.552 276 HH22 ARG 34 2HH1 ARG 34 -14.932 44.123 -13.624 277 H THR 35 H THR 35 -16.874 35.867 -10.981 278 HA THR 35 HA THR 35 -19.796 35.639 -10.843 279 HB THR 35 HB THR 35 -19.427 34.193 -8.910 280 HG1 THR 35 HG1 THR 35 -16.700 34.571 -9.351 281 HG21 THR 35 1HG2 THR 35 -18.129 32.432 -9.951 282 HG22 THR 35 2HG2 THR 35 -19.311 33.149 -11.069 283 HG23 THR 35 3HG2 THR 35 -17.583 33.538 -11.226 284 H ASP 36 H ASP 36 -20.660 35.726 -8.428 285 HA ASP 36 HA ASP 36 -20.599 38.510 -7.778 286 HB2 ASP 36 2HB ASP 36 -22.625 37.014 -7.698 287 HB3 ASP 36 3HB ASP 36 -21.931 36.196 -6.299 288 H ASN 37 H ASN 37 -18.617 35.896 -6.618 289 HA ASN 37 HA ASN 37 -17.860 37.476 -4.205 290 HB2 ASN 37 2HB ASN 37 -16.434 35.009 -5.020 291 HB3 ASN 37 3HB ASN 37 -16.613 35.721 -3.455 292 HD21 ASN 37 1HD2 ASN 37 -17.063 33.023 -4.490 293 HD22 ASN 37 2HD2 ASN 37 -18.686 32.611 -3.883 294 H GLY 38 H GLY 38 -17.236 37.867 -7.395 295 HA2 GLY 38 HA2 GLY 38 -15.572 39.038 -8.522 296 HA3 GLY 38 HA3 GLY 38 -14.503 38.957 -7.118 297 H GLU 39 H GLU 39 -15.741 35.843 -7.834 298 HA GLU 39 HA GLU 39 -13.046 34.984 -8.575 299 HB2 GLU 39 2HB GLU 39 -15.456 33.184 -8.742 300 HB3 GLU 39 3HB GLU 39 -13.795 32.790 -8.389 301 HG2 GLU 39 2HG GLU 39 -14.366 34.419 -6.262 302 HG3 GLU 39 3HG GLU 39 -16.007 33.898 -6.717 303 H GLU 40 H GLU 40 -12.282 35.140 -10.591 304 HA GLU 40 HA GLU 40 -14.130 35.317 -12.902 305 HB2 GLU 40 2HB GLU 40 -11.157 35.892 -12.705 306 HB3 GLU 40 3HB GLU 40 -12.190 36.169 -14.119 307 HG2 GLU 40 2HG GLU 40 -13.601 37.693 -12.744 308 HG3 GLU 40 3HG GLU 40 -12.473 37.526 -11.406 309 H PHE 41 H PHE 41 -14.394 33.831 -14.388 310 HA PHE 41 HA PHE 41 -12.447 31.585 -14.734 311 HB2 PHE 41 2HB PHE 41 -15.475 31.450 -14.650 312 HB3 PHE 41 3HB PHE 41 -14.429 30.127 -15.098 313 HD1 PHE 41 HD1 PHE 41 -13.090 28.920 -13.449 314 HD2 PHE 41 HD2 PHE 41 -15.623 32.197 -12.211 315 HE1 PHE 41 HE1 PHE 41 -12.787 28.263 -11.082 316 HE2 PHE 41 HE2 PHE 41 -15.370 31.492 -9.906 317 HZ PHE 41 HZ PHE 41 -13.923 29.555 -9.288 318 H GLU 42 H GLU 42 -12.693 30.442 -16.765 319 HA GLU 42 HA GLU 42 -13.324 32.271 -19.019 320 HB2 GLU 42 2HB GLU 42 -11.485 29.882 -19.255 321 HB3 GLU 42 3HB GLU 42 -11.659 31.286 -20.285 322 HG2 GLU 42 2HG GLU 42 -9.717 31.841 -19.264 323 HG3 GLU 42 3HG GLU 42 -10.843 32.646 -18.183 324 H VAL 43 H VAL 43 -14.732 31.692 -20.563 325 HA VAL 43 HA VAL 43 -15.777 28.879 -20.676 326 HB VAL 43 HB VAL 43 -17.417 31.360 -21.167 327 HG11 VAL 43 1HG1 VAL 43 -18.120 29.301 -22.403 328 HG12 VAL 43 2HG1 VAL 43 -18.227 28.444 -20.852 329 HG13 VAL 43 3HG1 VAL 43 -19.284 29.834 -21.204 330 HG21 VAL 43 3HG2 VAL 43 -17.548 29.524 -18.749 331 HG22 VAL 43 1HG2 VAL 43 -16.821 31.148 -18.730 332 HG23 VAL 43 2HG2 VAL 43 -18.523 30.976 -19.093 333 HA PRO 44 HA PRO 44 -14.481 29.476 -25.016 334 HB2 PRO 44 2HB PRO 44 -14.809 26.516 -24.987 335 HB3 PRO 44 3HB PRO 44 -13.466 27.480 -25.631 336 HG2 PRO 44 2HG PRO 44 -13.226 26.103 -23.287 337 HG3 PRO 44 3HG PRO 44 -12.521 27.744 -23.445 338 HD2 PRO 44 2HD PRO 44 -15.154 26.957 -22.170 339 HD3 PRO 44 3HD PRO 44 -13.887 28.097 -21.602 340 H PHE 45 H PHE 45 -15.915 29.971 -26.479 341 HA PHE 45 HA PHE 45 -18.461 28.416 -26.867 342 HB2 PHE 45 2HB PHE 45 -17.786 31.329 -27.308 343 HB3 PHE 45 3HB PHE 45 -19.150 30.593 -28.084 344 HD1 PHE 45 HD2 PHE 45 -17.683 31.571 -24.815 345 HD2 PHE 45 HD1 PHE 45 -21.187 30.048 -26.816 346 HE1 PHE 45 HE2 PHE 45 -19.038 32.018 -22.794 347 HE2 PHE 45 HE1 PHE 45 -22.535 30.485 -24.767 348 HZ PHE 45 HZ PHE 45 -21.439 31.462 -22.743 349 H ALA 46 H ALA 46 -18.989 27.732 -28.901 350 HA ALA 46 HA ALA 46 -16.819 27.584 -30.911 351 HB1 ALA 46 3HB ALA 46 -19.592 26.312 -30.838 352 HB2 ALA 46 1HB ALA 46 -18.306 25.963 -32.014 353 HB3 ALA 46 2HB ALA 46 -18.077 25.542 -30.308 354 H ASP 47 H ASP 47 -17.264 28.105 -33.189 355 HA ASP 47 HA ASP 47 -18.281 30.712 -33.627 356 HB2 ASP 47 2HB ASP 47 -16.567 29.594 -34.985 357 HB3 ASP 47 3HB ASP 47 -17.761 28.442 -35.584 358 H ASP 48 H ASP 48 -20.024 27.719 -33.531 359 HA ASP 48 HA ASP 48 -22.407 28.556 -34.978 360 HB2 ASP 48 2HB ASP 48 -21.637 26.197 -34.597 361 HB3 ASP 48 3HB ASP 48 -22.018 26.388 -32.888 362 H ALA 49 H ALA 49 -21.142 29.454 -31.946 363 HA ALA 49 HA ALA 49 -23.777 30.420 -30.910 364 HB1 ALA 49 3HB ALA 49 -21.402 29.359 -29.328 365 HB2 ALA 49 1HB ALA 49 -22.928 29.972 -28.655 366 HB3 ALA 49 2HB ALA 49 -22.924 28.483 -29.620 367 H GLU 50 H GLU 50 -23.623 32.290 -29.471 368 HA GLU 50 HA GLU 50 -21.210 34.010 -29.757 369 HB2 GLU 50 2HB GLU 50 -24.073 34.836 -30.355 370 HB3 GLU 50 3HB GLU 50 -22.811 35.994 -29.917 371 HG2 GLU 50 2HG GLU 50 -21.431 35.298 -31.818 372 HG3 GLU 50 3HG GLU 50 -22.626 34.083 -32.270 373 H ILE 51 H ILE 51 -20.725 35.190 -28.061 374 HA ILE 51 HA ILE 51 -21.202 34.289 -25.514 375 HB ILE 51 HB ILE 51 -20.223 37.095 -26.051 376 HG12 ILE 51 2HG1 ILE 51 -19.054 35.727 -27.672 377 HG13 ILE 51 3HG1 ILE 51 -17.963 36.245 -26.391 378 HG21 ILE 51 1HG2 ILE 51 -18.792 36.664 -24.097 379 HG22 ILE 51 2HG2 ILE 51 -20.487 36.414 -23.661 380 HG23 ILE 51 3HG2 ILE 51 -19.429 35.029 -23.956 381 HD11 ILE 51 3HD1 ILE 51 -19.172 33.476 -26.776 382 HD12 ILE 51 1HD1 ILE 51 -17.484 33.960 -27.008 383 HD13 ILE 51 2HD1 ILE 51 -18.162 33.937 -25.387 384 HA PRO 52 HA PRO 52 -24.972 36.650 -24.480 385 HB2 PRO 52 2HB PRO 52 -25.666 35.147 -22.321 386 HB3 PRO 52 3HB PRO 52 -25.996 34.628 -24.003 387 HG2 PRO 52 2HG PRO 52 -23.751 33.780 -22.168 388 HG3 PRO 52 3HG PRO 52 -24.751 32.766 -23.267 389 HD2 PRO 52 2HD PRO 52 -22.209 33.750 -23.864 390 HD3 PRO 52 3HD PRO 52 -23.395 33.332 -25.102 391 H GLY 53 H GLY 53 -25.250 38.195 -22.891 392 HA2 GLY 53 HA2 GLY 53 -23.141 39.535 -21.756 393 HA3 GLY 53 HA3 GLY 53 -24.802 39.652 -21.167 394 H THR 54 H THR 54 -24.863 36.835 -20.170 395 HA THR 54 HA THR 54 -22.644 36.723 -18.259 396 HB THR 54 HB THR 54 -24.204 36.163 -16.375 397 HG1 THR 54 HG1 THR 54 -26.394 36.372 -16.625 398 HG21 THR 54 1HG2 THR 54 -23.660 38.591 -16.706 399 HG22 THR 54 2HG2 THR 54 -25.184 38.780 -17.576 400 HG23 THR 54 3HG2 THR 54 -25.180 38.295 -15.865 401 H TRP 55 H TRP 55 -22.450 34.585 -17.176 402 HA TRP 55 HA TRP 55 -23.844 32.276 -18.324 403 HB2 TRP 55 2HB TRP 55 -22.085 32.931 -20.018 404 HB3 TRP 55 3HB TRP 55 -20.866 32.623 -18.790 405 HD1 TRP 55 HD1 TRP 55 -20.301 30.133 -18.241 406 HE1 TRP 55 HE1 TRP 55 -20.635 27.950 -19.504 407 HE3 TRP 55 HE3 TRP 55 -23.951 31.658 -21.434 408 HZ2 TRP 55 HZ2 TRP 55 -22.437 26.914 -21.548 409 HZ3 TRP 55 HZ3 TRP 55 -25.005 30.048 -23.028 410 HH2 TRP 55 HH2 TRP 55 -24.246 27.682 -23.094 411 H LEU 56 H LEU 56 -23.482 30.328 -17.114 412 HA LEU 56 HA LEU 56 -22.780 30.752 -14.357 413 HB2 LEU 56 2HB LEU 56 -24.359 28.952 -15.771 414 HB3 LEU 56 3HB LEU 56 -22.991 27.963 -15.258 415 HG LEU 56 HG LEU 56 -24.651 29.686 -13.375 416 HD11 LEU 56 1HD1 LEU 56 -25.723 27.577 -12.680 417 HD12 LEU 56 2HD1 LEU 56 -26.031 27.913 -14.392 418 HD13 LEU 56 3HD1 LEU 56 -24.820 26.694 -13.934 419 HD21 LEU 56 3HD2 LEU 56 -22.417 29.144 -12.482 420 HD22 LEU 56 1HD2 LEU 56 -23.660 28.229 -11.623 421 HD23 LEU 56 2HD2 LEU 56 -22.659 27.429 -12.858 422 H CYS 57 H CYS 57 -20.914 30.559 -13.353 423 HA CYS 57 HA CYS 57 -18.520 29.614 -14.836 424 HB2 CYS 57 2HB CYS 57 -18.937 31.380 -12.397 425 HB3 CYS 57 3HB CYS 57 -17.347 30.813 -12.926 426 HG CYS 57 HG CYS 57 -19.587 32.298 -14.853 427 H ARG 58 H ARG 58 -16.807 28.538 -13.591 428 HA ARG 58 HA ARG 58 -17.766 26.030 -12.692 429 HB2 ARG 58 2HB ARG 58 -14.951 27.049 -12.182 430 HB3 ARG 58 3HB ARG 58 -15.470 25.386 -12.424 431 HG2 ARG 58 2HG ARG 58 -16.001 25.920 -14.816 432 HG3 ARG 58 3HG ARG 58 -15.426 27.575 -14.545 433 HD2 ARG 58 2HD ARG 58 -13.218 26.513 -13.754 434 HD3 ARG 58 3HD ARG 58 -13.803 25.017 -14.490 435 HE ARG 58 HE ARG 58 -14.063 26.380 -16.633 436 HH11 ARG 58 2HH2 ARG 58 -11.434 27.237 -14.397 437 HH12 ARG 58 1HH2 ARG 58 -10.753 28.313 -15.619 438 HH21 ARG 58 2HH1 ARG 58 -13.040 27.885 -17.979 439 HH22 ARG 58 1HH1 ARG 58 -11.486 28.505 -17.449 440 H ASN 59 H ASN 59 -17.151 28.858 -10.819 441 HA ASN 59 HA ASN 59 -16.873 27.687 -8.243 442 HB2 ASN 59 2HB ASN 59 -16.291 29.955 -8.723 443 HB3 ASN 59 3HB ASN 59 -17.952 30.348 -9.197 444 HD21 ASN 59 1HD2 ASN 59 -17.979 32.105 -7.728 445 HD22 ASN 59 2HD2 ASN 59 -18.009 31.833 -5.997 446 H GLY 60 H GLY 60 -19.616 27.874 -10.341 447 HA2 GLY 60 HA2 GLY 60 -21.723 26.861 -10.054 448 HA3 GLY 60 HA3 GLY 60 -21.515 26.839 -8.301 449 H MET 61 H MET 61 -20.726 29.839 -9.846 450 HA MET 61 HA MET 61 -23.341 31.061 -9.109 451 HB2 MET 61 2HB MET 61 -21.371 31.615 -7.622 452 HB3 MET 61 3HB MET 61 -20.573 32.326 -9.001 453 HG2 MET 61 2HG MET 61 -21.656 34.018 -7.583 454 HG3 MET 61 3HG MET 61 -22.286 34.024 -9.224 455 HE1 MET 61 3HE MET 61 -23.169 31.735 -6.039 456 HE2 MET 61 1HE MET 61 -22.960 33.402 -5.451 457 HE3 MET 61 2HE MET 61 -24.567 32.645 -5.431 458 H GLU 62 H GLU 62 -24.170 32.664 -10.504 459 HA GLU 62 HA GLU 62 -23.448 32.451 -13.305 460 HB2 GLU 62 2HB GLU 62 -25.764 32.848 -12.502 461 HB3 GLU 62 3HB GLU 62 -25.289 34.483 -12.006 462 HG2 GLU 62 2HG GLU 62 -24.603 34.970 -14.359 463 HG3 GLU 62 3HG GLU 62 -25.071 33.339 -14.836 464 H GLY 63 H GLY 63 -21.667 33.271 -14.110 465 HA2 GLY 63 HA2 GLY 63 -20.303 35.578 -12.951 466 HA3 GLY 63 HA3 GLY 63 -19.726 34.589 -14.268 467 H THR 64 H THR 64 -19.973 37.563 -14.066 468 HA THR 64 HA THR 64 -21.671 38.023 -16.478 469 HB THR 64 HB THR 64 -20.496 40.062 -14.548 470 HG1 THR 64 HG1 THR 64 -22.178 38.873 -13.632 471 HG21 THR 64 1HG2 THR 64 -22.170 41.619 -15.650 472 HG22 THR 64 2HG2 THR 64 -20.808 41.160 -16.676 473 HG23 THR 64 3HG2 THR 64 -22.390 40.394 -16.920 474 H LEU 65 H LEU 65 -20.864 38.832 -18.336 475 HA LEU 65 HA LEU 65 -18.305 37.994 -19.091 476 HB2 LEU 65 2HB LEU 65 -20.401 38.180 -20.405 477 HB3 LEU 65 3HB LEU 65 -20.242 39.915 -20.416 478 HG LEU 65 HG LEU 65 -18.630 37.787 -21.868 479 HD11 LEU 65 1HD1 LEU 65 -20.795 38.594 -22.798 480 HD12 LEU 65 2HD1 LEU 65 -20.164 40.252 -22.813 481 HD13 LEU 65 3HD1 LEU 65 -19.432 39.011 -23.849 482 HD21 LEU 65 3HD2 LEU 65 -16.868 39.303 -21.313 483 HD22 LEU 65 1HD2 LEU 65 -17.330 39.634 -22.972 484 HD23 LEU 65 2HD2 LEU 65 -17.883 40.729 -21.686 485 H ILE 66 H ILE 66 -16.330 38.867 -18.782 486 HA ILE 66 HA ILE 66 -15.937 41.797 -18.981 487 HB ILE 66 HB ILE 66 -14.362 41.901 -17.233 488 HG12 ILE 66 2HG1 ILE 66 -13.214 39.807 -17.222 489 HG13 ILE 66 3HG1 ILE 66 -13.899 40.066 -15.624 490 HG21 ILE 66 1HG2 ILE 66 -16.706 42.220 -16.608 491 HG22 ILE 66 2HG2 ILE 66 -16.823 40.512 -16.142 492 HG23 ILE 66 3HG2 ILE 66 -15.736 41.588 -15.264 493 HD11 ILE 66 3HD1 ILE 66 -15.765 38.542 -16.235 494 HD12 ILE 66 1HD1 ILE 66 -14.817 38.161 -17.686 495 HD13 ILE 66 2HD1 ILE 66 -14.153 37.804 -16.085 496 H GLU 67 H GLU 67 -13.844 42.465 -19.672 497 HA GLU 67 HA GLU 67 -11.928 40.399 -20.510 498 HB2 GLU 67 2HB GLU 67 -13.460 40.990 -22.493 499 HB3 GLU 67 3HB GLU 67 -12.681 42.578 -22.486 500 HG2 GLU 67 2HG GLU 67 -10.469 41.453 -22.794 501 HG3 GLU 67 3HG GLU 67 -11.273 39.876 -22.738 502 H GLY 68 H GLY 68 -9.871 40.987 -20.079 503 HA2 GLY 68 HA2 GLY 68 -8.966 43.772 -19.922 504 HA3 GLY 68 HA3 GLY 68 -9.183 43.003 -18.346 505 H ASP 69 H ASP 69 -8.144 40.972 -20.980 506 HA ASP 69 HA ASP 69 -5.641 40.412 -19.543 507 HB2 ASP 69 2HB ASP 69 -5.674 38.375 -21.017 508 HB3 ASP 69 3HB ASP 69 -7.091 38.591 -20.001 509 H LEU 70 H LEU 70 -5.949 42.813 -21.429 510 HA LEU 70 HA LEU 70 -3.260 42.511 -22.605 511 HB2 LEU 70 2HB LEU 70 -5.744 43.466 -24.011 512 HB3 LEU 70 3HB LEU 70 -4.197 44.199 -24.428 513 HG LEU 70 HG LEU 70 -4.604 41.181 -24.497 514 HD11 LEU 70 1HD1 LEU 70 -4.815 43.135 -26.822 515 HD12 LEU 70 2HD1 LEU 70 -4.921 41.365 -26.898 516 HD13 LEU 70 3HD1 LEU 70 -6.186 42.283 -26.069 517 HD21 LEU 70 3HD2 LEU 70 -2.645 41.360 -26.068 518 HD22 LEU 70 1HD2 LEU 70 -2.560 43.098 -25.721 519 HD23 LEU 70 2HD2 LEU 70 -2.251 41.905 -24.439 520 HA PRO 71 HA PRO 71 -2.646 46.144 -20.200 521 HB2 PRO 71 2HB PRO 71 -0.275 47.106 -21.140 522 HB3 PRO 71 3HB PRO 71 -0.410 45.569 -20.237 523 HG2 PRO 71 2HG PRO 71 -0.218 45.969 -23.233 524 HG3 PRO 71 3HG PRO 71 0.642 44.779 -22.215 525 HD2 PRO 71 2HD PRO 71 -1.647 44.188 -23.638 526 HD3 PRO 71 3HD PRO 71 -1.224 43.379 -22.103 527 H GLU 72 H GLU 72 -2.064 46.751 -23.689 528 HA GLU 72 HA GLU 72 -3.672 49.260 -23.581 529 HB2 GLU 72 2HB GLU 72 -0.950 48.952 -24.920 530 HB3 GLU 72 3HB GLU 72 -1.984 50.391 -24.932 531 HG2 GLU 72 2HG GLU 72 -1.776 50.464 -22.418 532 HG3 GLU 72 3HG GLU 72 -0.600 49.156 -22.514 533 HA PRO 73 HA PRO 73 -4.640 46.295 -27.121 534 HB2 PRO 73 2HB PRO 73 -7.344 45.909 -26.666 535 HB3 PRO 73 3HB PRO 73 -6.042 44.919 -25.962 536 HG2 PRO 73 2HG PRO 73 -7.513 47.238 -24.694 537 HG3 PRO 73 3HG PRO 73 -7.100 45.640 -23.979 538 HD2 PRO 73 2HD PRO 73 -5.595 47.851 -23.488 539 HD3 PRO 73 3HD PRO 73 -4.865 46.240 -23.671 540 H LYS 74 H LYS 74 -5.379 46.847 -29.078 541 HA LYS 74 HA LYS 74 -6.667 49.441 -29.615 542 HB2 LYS 74 2HB LYS 74 -4.883 48.449 -31.049 543 HB3 LYS 74 3HB LYS 74 -5.979 47.130 -31.485 544 HG2 LYS 74 2HG LYS 74 -7.516 48.730 -32.560 545 HG3 LYS 74 3HG LYS 74 -6.512 50.090 -32.018 546 HD2 LYS 74 2HD LYS 74 -4.625 49.239 -33.386 547 HD3 LYS 74 3HD LYS 74 -5.624 47.865 -33.913 548 HE2 LYS 74 2HE LYS 74 -7.261 49.446 -34.915 549 HE3 LYS 74 3HE LYS 74 -6.269 50.813 -34.389 550 HZ1 LYS 74 HZ1 LYS 74 -5.395 48.716 -36.308 551 HZ2 LYS 74 HZ2 LYS 74 -5.825 50.237 -36.706 552 HZ3 LYS 74 HZ3 LYS 74 -4.480 49.979 -35.822 553 H LYS 75 H LYS 75 -7.701 46.182 -29.098 554 HA LYS 75 HA LYS 75 -10.309 46.264 -30.325 555 HB2 LYS 75 2HB LYS 75 -9.043 44.209 -29.807 556 HB3 LYS 75 3HB LYS 75 -9.182 44.539 -28.077 557 HG2 LYS 75 2HG LYS 75 -11.653 44.326 -28.238 558 HG3 LYS 75 3HG LYS 75 -11.510 44.013 -29.980 559 HD2 LYS 75 2HD LYS 75 -10.115 42.011 -29.501 560 HD3 LYS 75 3HD LYS 75 -10.269 42.303 -27.765 561 HE2 LYS 75 2HE LYS 75 -12.589 41.725 -29.669 562 HE3 LYS 75 3HE LYS 75 -11.783 40.525 -28.653 563 HZ1 LYS 75 HZ1 LYS 75 -13.321 42.858 -27.663 564 HZ2 LYS 75 HZ2 LYS 75 -13.723 41.280 -27.509 565 HZ3 LYS 75 HZ3 LYS 75 -12.434 41.881 -26.696 566 H VAL 76 H VAL 76 -11.889 47.548 -29.764 567 HA VAL 76 HA VAL 76 -12.774 47.832 -26.959 568 HB VAL 76 HB VAL 76 -12.633 50.287 -28.738 569 HG11 VAL 76 1HG1 VAL 76 -13.157 49.940 -25.757 570 HG12 VAL 76 2HG1 VAL 76 -13.019 51.497 -26.600 571 HG13 VAL 76 3HG1 VAL 76 -14.344 50.415 -26.998 572 HG21 VAL 76 3HG2 VAL 76 -10.708 49.583 -26.477 573 HG22 VAL 76 1HG2 VAL 76 -10.287 49.748 -28.198 574 HG23 VAL 76 2HG2 VAL 76 -10.814 51.159 -27.290 575 H LYS 77 H LYS 77 -15.034 48.006 -26.824 576 HA LYS 77 HA LYS 77 -16.569 47.040 -29.021 577 HB2 LYS 77 2HB LYS 77 -17.051 46.756 -26.541 578 HB3 LYS 77 3HB LYS 77 -17.566 48.445 -26.506 579 HG2 LYS 77 2HG LYS 77 -19.311 47.800 -28.298 580 HG3 LYS 77 3HG LYS 77 -18.812 46.129 -28.050 581 HD2 LYS 77 2HD LYS 77 -20.787 46.483 -26.745 582 HD3 LYS 77 3HD LYS 77 -19.435 46.357 -25.626 583 HE2 LYS 77 2HE LYS 77 -20.856 48.131 -24.864 584 HE3 LYS 77 3HE LYS 77 -19.369 48.866 -25.461 585 HZ1 LYS 77 HZ1 LYS 77 -21.360 50.043 -26.235 586 HZ2 LYS 77 HZ2 LYS 77 -20.562 49.443 -27.525 587 HZ3 LYS 77 HZ3 LYS 77 -21.923 48.709 -26.983 588 HA PRO 78 HA PRO 78 -17.549 50.931 -31.077 589 HB2 PRO 78 2HB PRO 78 -19.765 50.197 -32.549 590 HB3 PRO 78 3HB PRO 78 -18.085 49.743 -32.965 591 HG2 PRO 78 2HG PRO 78 -20.127 48.118 -31.409 592 HG3 PRO 78 3HG PRO 78 -19.139 47.596 -32.814 593 HD2 PRO 78 2HD PRO 78 -18.372 47.025 -30.296 594 HD3 PRO 78 3HD PRO 78 -17.159 47.527 -31.505 595 HA PRO 79 HA PRO 79 -19.451 52.516 -32.345 596 HB2 PRO 79 2HB PRO 79 -19.786 55.048 -30.758 597 HB3 PRO 79 3HB PRO 79 -20.392 54.646 -32.394 598 HG2 PRO 79 2HG PRO 79 -22.077 54.588 -30.281 599 HG3 PRO 79 3HG PRO 79 -22.125 53.255 -31.485 600 HD2 PRO 79 2HD PRO 79 -20.686 53.309 -28.807 601 HD3 PRO 79 3HD PRO 79 -21.778 52.056 -29.468 602 H ARG 80 H ARG 80 -17.669 53.624 -33.224 603 HA ARG 80 HA ARG 80 -15.344 54.190 -31.458 604 HB2 ARG 80 2HB ARG 80 -15.437 51.737 -32.218 605 HB3 ARG 80 3HB ARG 80 -15.245 52.324 -33.865 606 HG2 ARG 80 2HG ARG 80 -13.098 51.632 -33.105 607 HG3 ARG 80 3HG ARG 80 -13.052 53.397 -33.141 608 HD2 ARG 80 2HD ARG 80 -13.465 53.450 -30.687 609 HD3 ARG 80 3HD ARG 80 -13.553 51.691 -30.651 610 HE ARG 80 HE ARG 80 -11.169 53.380 -30.813 611 HH11 ARG 80 2HH1 ARG 80 -12.261 50.074 -31.400 612 HH12 ARG 80 1HH1 ARG 80 -10.636 49.459 -31.112 613 HH21 ARG 80 1HH2 ARG 80 -9.171 52.427 -30.499 614 HH22 ARG 80 2HH2 ARG 80 -9.046 50.680 -30.618 Start of MODEL 12 1 H1 SER 1 1H SER 1 16.994 39.627 -61.417 2 H2 SER 1 2H SER 1 18.450 39.780 -60.671 3 H3 SER 1 3H SER 1 17.068 40.089 -59.846 4 HA SER 1 HA SER 1 17.848 37.468 -60.926 5 HB2 SER 1 2HB SER 1 17.885 38.401 -58.029 6 HB3 SER 1 3HB SER 1 18.308 36.784 -58.630 7 HG SER 1 HG SER 1 20.163 38.102 -58.335 8 H MET 2 H MET 2 16.496 35.694 -60.249 9 HA MET 2 HA MET 2 13.685 36.202 -60.302 10 HB2 MET 2 2HB MET 2 14.936 34.178 -61.156 11 HB3 MET 2 3HB MET 2 15.166 33.675 -59.482 12 HG2 MET 2 2HG MET 2 13.355 32.434 -60.368 13 HG3 MET 2 3HG MET 2 12.660 33.582 -59.237 14 HE1 MET 2 3HE MET 2 10.849 31.974 -61.214 15 HE2 MET 2 1HE MET 2 10.263 33.235 -60.104 16 HE3 MET 2 2HE MET 2 9.777 33.259 -61.811 17 H ALA 3 H ALA 3 12.714 36.215 -56.793 18 HA ALA 3 HA ALA 3 11.547 35.463 -59.297 19 HB1 ALA 3 3HB ALA 3 10.405 36.952 -56.923 20 HB2 ALA 3 1HB ALA 3 9.480 36.222 -58.252 21 HB3 ALA 3 2HB ALA 3 10.421 35.188 -57.161 22 H ASP 4 H ASP 4 11.190 36.547 -61.077 23 HA ASP 4 HA ASP 4 10.912 39.499 -61.114 24 HB2 ASP 4 2HB ASP 4 13.318 38.841 -61.522 25 HB3 ASP 4 3HB ASP 4 12.790 37.969 -62.958 26 H ARG 5 H ARG 5 9.036 37.246 -61.384 27 HA ARG 5 HA ARG 5 7.915 37.711 -64.114 28 HB2 ARG 5 2HB ARG 5 8.248 34.977 -62.800 29 HB3 ARG 5 3HB ARG 5 7.432 35.307 -64.333 30 HG2 ARG 5 2HG ARG 5 9.592 36.151 -65.278 31 HG3 ARG 5 3HG ARG 5 10.401 35.686 -63.769 32 HD2 ARG 5 2HD ARG 5 9.628 33.336 -64.109 33 HD3 ARG 5 3HD ARG 5 8.927 33.796 -65.657 34 HE ARG 5 HE ARG 5 11.777 33.458 -64.976 35 HH11 ARG 5 1HH1 ARG 5 9.604 34.707 -67.434 36 HH12 ARG 5 2HH1 ARG 5 10.839 34.673 -68.662 37 HH21 ARG 5 1HH2 ARG 5 13.291 33.443 -66.591 38 HH22 ARG 5 2HH2 ARG 5 12.866 33.978 -68.191 39 H VAL 6 H VAL 6 5.697 37.086 -64.336 40 HA VAL 6 HA VAL 6 4.103 37.884 -61.997 41 HB VAL 6 HB VAL 6 2.266 38.179 -63.581 42 HG11 VAL 6 1HG1 VAL 6 3.864 40.009 -63.151 43 HG12 VAL 6 2HG1 VAL 6 4.835 39.489 -64.547 44 HG13 VAL 6 3HG1 VAL 6 3.178 40.074 -64.781 45 HG21 VAL 6 3HG2 VAL 6 2.838 36.398 -65.236 46 HG22 VAL 6 1HG2 VAL 6 2.584 37.978 -65.988 47 HG23 VAL 6 2HG2 VAL 6 4.232 37.364 -65.772 48 H LEU 7 H LEU 7 5.222 35.143 -62.068 49 HA LEU 7 HA LEU 7 3.115 33.261 -62.638 50 HB2 LEU 7 2HB LEU 7 5.646 32.961 -60.974 51 HB3 LEU 7 3HB LEU 7 4.619 31.633 -61.505 52 HG LEU 7 HG LEU 7 6.177 33.491 -63.354 53 HD11 LEU 7 1HD1 LEU 7 7.613 31.974 -62.041 54 HD12 LEU 7 2HD1 LEU 7 6.655 30.584 -62.595 55 HD13 LEU 7 3HD1 LEU 7 7.601 31.539 -63.759 56 HD21 LEU 7 3HD2 LEU 7 4.183 32.654 -64.506 57 HD22 LEU 7 1HD2 LEU 7 5.619 31.829 -65.115 58 HD23 LEU 7 2HD2 LEU 7 4.544 30.993 -63.973 59 H ARG 8 H ARG 8 1.902 32.002 -61.299 60 HA ARG 8 HA ARG 8 1.246 33.053 -58.562 61 HB2 ARG 8 2HB ARG 8 -0.472 32.136 -60.882 62 HB3 ARG 8 3HB ARG 8 -1.020 31.793 -59.256 63 HG2 ARG 8 2HG ARG 8 -2.051 33.795 -59.888 64 HG3 ARG 8 3HG ARG 8 -0.857 34.200 -58.655 65 HD2 ARG 8 2HD ARG 8 0.644 35.117 -60.356 66 HD3 ARG 8 3HD ARG 8 -0.423 34.541 -61.654 67 HE ARG 8 HE ARG 8 -1.871 36.231 -59.831 68 HH11 ARG 8 1HH2 ARG 8 0.522 36.584 -62.377 69 HH12 ARG 8 2HH2 ARG 8 -0.146 38.116 -62.889 70 HH21 ARG 8 1HH1 ARG 8 -2.590 38.219 -60.482 71 HH22 ARG 8 2HH1 ARG 8 -1.813 39.038 -61.804 72 H GLY 9 H GLY 9 0.148 31.431 -57.185 73 HA2 GLY 9 HA2 GLY 9 -0.258 29.195 -56.501 74 HA3 GLY 9 HA3 GLY 9 1.049 28.614 -57.526 75 H SER 10 H SER 10 2.462 31.169 -56.003 76 HA SER 10 HA SER 10 3.715 29.526 -53.907 77 HB2 SER 10 2HB SER 10 4.948 31.172 -55.399 78 HB3 SER 10 3HB SER 10 4.181 32.466 -54.468 79 HG SER 10 HG SER 10 6.085 30.535 -53.703 80 H ARG 11 H ARG 11 1.786 30.824 -51.141 81 HA ARG 11 HA ARG 11 2.723 28.350 -52.460 82 HB2 ARG 11 2HB ARG 11 4.496 27.943 -50.793 83 HB3 ARG 11 3HB ARG 11 4.802 29.351 -51.774 84 HG2 ARG 11 2HG ARG 11 3.732 30.710 -49.759 85 HG3 ARG 11 3HG ARG 11 3.994 29.219 -48.850 86 HD2 ARG 11 2HD ARG 11 5.848 30.734 -48.513 87 HD3 ARG 11 3HD ARG 11 6.424 29.338 -49.447 88 HE ARG 11 HE ARG 11 5.703 31.153 -51.401 89 HH11 ARG 11 1HH2 ARG 11 7.957 31.451 -48.728 90 HH12 ARG 11 2HH2 ARG 11 8.933 32.609 -49.592 91 HH21 ARG 11 1HH1 ARG 11 6.947 32.531 -52.421 92 HH22 ARG 11 2HH1 ARG 11 8.364 33.227 -51.664 93 H LEU 12 H LEU 12 0.212 29.288 -51.335 94 HA LEU 12 HA LEU 12 -1.467 28.764 -49.944 95 HB2 LEU 12 2HB LEU 12 -1.125 26.766 -51.470 96 HB3 LEU 12 3HB LEU 12 -0.380 25.940 -50.109 97 HG LEU 12 HG LEU 12 -2.542 26.084 -48.854 98 HD11 LEU 12 1HD1 LEU 12 -4.602 26.726 -50.099 99 HD12 LEU 12 2HD1 LEU 12 -3.548 28.105 -49.803 100 HD13 LEU 12 3HD1 LEU 12 -3.592 27.358 -51.418 101 HD21 LEU 12 3HD2 LEU 12 -2.808 24.938 -51.661 102 HD22 LEU 12 1HD2 LEU 12 -2.029 24.136 -50.278 103 HD23 LEU 12 2HD2 LEU 12 -3.766 24.477 -50.234 104 H GLY 13 H GLY 13 0.676 29.815 -48.543 105 HA2 GLY 13 HA2 GLY 13 -0.013 29.516 -45.842 106 HA3 GLY 13 HA3 GLY 13 1.369 28.448 -46.127 107 H ALA 14 H ALA 14 1.579 30.557 -44.371 108 HA ALA 14 HA ALA 14 2.648 32.454 -43.799 109 HB1 ALA 14 3HB ALA 14 4.509 30.907 -44.263 110 HB2 ALA 14 1HB ALA 14 4.635 31.556 -45.914 111 HB3 ALA 14 2HB ALA 14 4.967 32.599 -44.516 112 H VAL 15 H VAL 15 0.583 32.935 -45.716 113 HA VAL 15 HA VAL 15 1.295 35.639 -46.638 114 HB VAL 15 HB VAL 15 1.879 34.079 -48.511 115 HG11 VAL 15 1HG1 VAL 15 0.076 32.385 -48.191 116 HG12 VAL 15 2HG1 VAL 15 -1.104 33.573 -48.776 117 HG13 VAL 15 3HG1 VAL 15 0.188 33.002 -49.847 118 HG21 VAL 15 3HG2 VAL 15 0.872 35.369 -50.272 119 HG22 VAL 15 1HG2 VAL 15 -0.422 35.938 -49.207 120 HG23 VAL 15 2HG2 VAL 15 1.263 36.445 -48.922 121 H SER 16 H SER 16 -0.439 37.003 -46.952 122 HA SER 16 HA SER 16 -2.657 36.361 -45.177 123 HB2 SER 16 2HB SER 16 -1.965 38.945 -46.612 124 HB3 SER 16 3HB SER 16 -3.128 38.733 -45.291 125 HG SER 16 HG SER 16 -1.083 39.474 -44.540 126 H TYR 17 H TYR 17 -4.698 35.925 -45.676 127 HA TYR 17 HA TYR 17 -6.060 36.952 -48.025 128 HB2 TYR 17 2HB TYR 17 -6.807 34.676 -48.803 129 HB3 TYR 17 3HB TYR 17 -5.141 35.064 -49.138 130 HD1 TYR 17 HD1 TYR 17 -7.348 33.056 -46.866 131 HD2 TYR 17 HD2 TYR 17 -3.352 33.733 -48.339 132 HE1 TYR 17 HE1 TYR 17 -6.596 30.937 -45.804 133 HE2 TYR 17 HE2 TYR 17 -2.596 31.609 -47.279 134 HH TYR 17 HH TYR 17 -4.842 29.505 -45.432 135 H GLU 18 H GLU 18 -8.383 36.194 -48.059 136 HA GLU 18 HA GLU 18 -9.586 36.925 -45.598 137 HB2 GLU 18 2HB GLU 18 -10.543 37.303 -47.841 138 HB3 GLU 18 3HB GLU 18 -10.852 35.571 -48.011 139 HG2 GLU 18 2HG GLU 18 -12.378 35.648 -46.056 140 HG3 GLU 18 3HG GLU 18 -11.998 37.354 -45.813 141 H THR 19 H THR 19 -9.511 35.798 -43.833 142 HA THR 19 HA THR 19 -9.866 32.821 -43.805 143 HB THR 19 HB THR 19 -8.273 34.598 -41.920 144 HG1 THR 19 HG1 THR 19 -7.304 34.360 -43.941 145 HG21 THR 19 1HG2 THR 19 -8.519 31.561 -42.080 146 HG22 THR 19 2HG2 THR 19 -7.316 32.441 -41.112 147 HG23 THR 19 3HG2 THR 19 -9.031 32.601 -40.730 148 H ASP 20 H ASP 20 -11.294 31.902 -42.391 149 HA ASP 20 HA ASP 20 -13.376 33.640 -41.288 150 HB2 ASP 20 2HB ASP 20 -13.147 30.629 -41.595 151 HB3 ASP 20 3HB ASP 20 -14.542 31.453 -40.889 152 H ARG 21 H ARG 21 -11.468 34.391 -39.847 153 HA ARG 21 HA ARG 21 -10.448 34.614 -37.830 154 HB2 ARG 21 2HB ARG 21 -11.938 34.900 -35.971 155 HB3 ARG 21 3HB ARG 21 -12.620 35.557 -37.448 156 HG2 ARG 21 2HG ARG 21 -14.212 33.742 -37.637 157 HG3 ARG 21 3HG ARG 21 -13.427 32.839 -36.324 158 HD2 ARG 21 2HD ARG 21 -14.007 34.614 -34.733 159 HD3 ARG 21 3HD ARG 21 -14.774 35.552 -36.030 160 HE ARG 21 HE ARG 21 -16.032 33.021 -36.047 161 HH11 ARG 21 1HH2 ARG 21 -15.769 35.578 -33.640 162 HH12 ARG 21 2HH2 ARG 21 -17.245 35.030 -32.858 163 HH21 ARG 21 1HH1 ARG 21 -17.821 32.512 -35.071 164 HH22 ARG 21 2HH1 ARG 21 -18.341 33.335 -33.588 165 H ASN 22 H ASN 22 -9.978 31.982 -38.827 166 HA ASN 22 HA ASN 22 -9.623 30.453 -36.293 167 HB2 ASN 22 2HB ASN 22 -10.213 28.468 -37.425 168 HB3 ASN 22 3HB ASN 22 -11.439 29.653 -37.843 169 HD21 ASN 22 2HD2 ASN 22 -9.843 27.153 -39.155 170 HD22 ASN 22 1HD2 ASN 22 -9.746 27.728 -40.818 171 H HIS 23 H HIS 23 -7.846 29.291 -35.915 172 HA HIS 23 HA HIS 23 -5.739 28.988 -38.003 173 HB2 HIS 23 2HB HIS 23 -5.123 30.714 -36.256 174 HB3 HIS 23 3HB HIS 23 -5.167 29.429 -35.052 175 HD2 HIS 23 HD2 HIS 23 -2.761 28.638 -34.529 176 HE1 HIS 23 HE1 HIS 23 -0.951 29.061 -38.369 177 HE2 HIS 23 HE2 HIS 23 -0.556 28.369 -35.950 178 H ASP 24 H ASP 24 -8.039 27.405 -37.173 179 HA ASP 24 HA ASP 24 -6.927 24.774 -36.626 180 HB2 ASP 24 2HB ASP 24 -7.398 26.167 -34.395 181 HB3 ASP 24 3HB ASP 24 -9.076 25.775 -34.722 182 H LEU 25 H LEU 25 -8.755 23.166 -36.437 183 HA LEU 25 HA LEU 25 -11.084 23.796 -38.148 184 HB2 LEU 25 2HB LEU 25 -11.597 21.452 -38.095 185 HB3 LEU 25 3HB LEU 25 -9.934 21.736 -38.584 186 HG LEU 25 HG LEU 25 -9.283 21.182 -36.138 187 HD11 LEU 25 1HD1 LEU 25 -10.802 19.497 -35.068 188 HD12 LEU 25 2HD1 LEU 25 -11.489 21.112 -35.058 189 HD13 LEU 25 3HD1 LEU 25 -12.065 19.920 -36.243 190 HD21 LEU 25 3HD2 LEU 25 -9.230 18.774 -36.676 191 HD22 LEU 25 1HD2 LEU 25 -10.420 19.031 -37.973 192 HD23 LEU 25 2HD2 LEU 25 -8.798 19.751 -38.083 193 H ALA 26 H ALA 26 -13.250 23.422 -37.234 194 HA ALA 26 HA ALA 26 -14.845 24.098 -35.749 195 HB1 ALA 26 3HB ALA 26 -13.180 22.372 -33.886 196 HB2 ALA 26 1HB ALA 26 -14.900 22.781 -33.689 197 HB3 ALA 26 2HB ALA 26 -14.372 21.789 -35.065 198 HA PRO 27 HA PRO 27 -12.081 27.506 -34.016 199 HB2 PRO 27 2HB PRO 27 -13.565 29.636 -35.102 200 HB3 PRO 27 3HB PRO 27 -12.096 28.884 -35.783 201 HG2 PRO 27 2HG PRO 27 -14.995 28.274 -36.432 202 HG3 PRO 27 3HG PRO 27 -13.627 28.489 -37.569 203 HD2 PRO 27 2HD PRO 27 -14.446 26.030 -36.892 204 HD3 PRO 27 3HD PRO 27 -12.685 26.398 -36.949 205 H ARG 28 H ARG 28 -12.410 28.967 -32.475 206 HA ARG 28 HA ARG 28 -14.998 29.073 -31.034 207 HB2 ARG 28 2HB ARG 28 -14.071 28.152 -29.011 208 HB3 ARG 28 3HB ARG 28 -13.860 27.050 -30.363 209 HG2 ARG 28 2HG ARG 28 -11.438 28.262 -30.515 210 HG3 ARG 28 3HG ARG 28 -11.806 28.615 -28.829 211 HD2 ARG 28 2HD ARG 28 -10.565 26.590 -28.853 212 HD3 ARG 28 3HD ARG 28 -12.227 26.125 -28.501 213 HE ARG 28 HE ARG 28 -12.480 25.420 -30.858 214 HH11 ARG 28 1HH2 ARG 28 -9.069 25.761 -29.900 215 HH12 ARG 28 2HH2 ARG 28 -8.596 24.826 -31.325 216 HH21 ARG 28 2HH1 ARG 28 -11.641 24.375 -32.605 217 HH22 ARG 28 1HH1 ARG 28 -9.908 24.073 -32.659 218 H GLN 29 H GLN 29 -14.902 30.301 -29.012 219 HA GLN 29 HA GLN 29 -13.318 32.831 -29.128 220 HB2 GLN 29 2HB GLN 29 -16.320 32.655 -28.648 221 HB3 GLN 29 3HB GLN 29 -15.348 34.117 -28.692 222 HG2 GLN 29 2HG GLN 29 -15.696 34.345 -30.896 223 HG3 GLN 29 3HG GLN 29 -15.065 32.728 -31.226 224 HE21 GLN 29 1HE2 GLN 29 -16.759 31.002 -30.105 225 HE22 GLN 29 2HE2 GLN 29 -18.359 31.167 -30.827 226 H ILE 30 H ILE 30 -12.184 32.487 -27.225 227 HA ILE 30 HA ILE 30 -13.512 31.689 -24.752 228 HB ILE 30 HB ILE 30 -10.711 32.722 -25.284 229 HG12 ILE 30 2HG1 ILE 30 -9.982 30.458 -24.829 230 HG13 ILE 30 3HG1 ILE 30 -11.638 29.932 -24.516 231 HG21 ILE 30 1HG2 ILE 30 -11.382 33.229 -22.954 232 HG22 ILE 30 2HG2 ILE 30 -11.990 31.576 -22.753 233 HG23 ILE 30 3HG2 ILE 30 -10.251 31.881 -22.959 234 HD11 ILE 30 3HD1 ILE 30 -10.665 30.821 -27.246 235 HD12 ILE 30 1HD1 ILE 30 -10.619 29.144 -26.662 236 HD13 ILE 30 2HD1 ILE 30 -12.179 29.952 -26.834 237 H ALA 31 H ALA 31 -14.971 33.015 -23.993 238 HA ALA 31 HA ALA 31 -14.268 35.869 -23.470 239 HB1 ALA 31 3HB ALA 31 -16.891 34.347 -23.263 240 HB2 ALA 31 1HB ALA 31 -16.634 36.010 -22.702 241 HB3 ALA 31 2HB ALA 31 -16.461 35.634 -24.422 242 H ARG 32 H ARG 32 -14.646 36.624 -21.261 243 HA ARG 32 HA ARG 32 -14.240 34.560 -19.123 244 HB2 ARG 32 2HB ARG 32 -12.776 37.123 -19.715 245 HB3 ARG 32 3HB ARG 32 -13.034 36.700 -18.028 246 HG2 ARG 32 2HG ARG 32 -11.667 34.901 -18.044 247 HG3 ARG 32 3HG ARG 32 -12.047 34.434 -19.705 248 HD2 ARG 32 2HD ARG 32 -10.393 36.894 -19.099 249 HD3 ARG 32 3HD ARG 32 -9.687 35.271 -19.237 250 HE ARG 32 HE ARG 32 -11.396 36.366 -21.441 251 HH11 ARG 32 1HH2 ARG 32 -8.195 35.212 -20.581 252 HH12 ARG 32 2HH2 ARG 32 -7.765 34.961 -22.250 253 HH21 ARG 32 1HH1 ARG 32 -10.835 35.971 -23.466 254 HH22 ARG 32 2HH1 ARG 32 -9.224 35.420 -23.862 255 H TYR 33 H TYR 33 -15.115 34.921 -17.140 256 HA TYR 33 HA TYR 33 -17.202 37.027 -16.914 257 HB2 TYR 33 2HB TYR 33 -17.720 34.078 -16.566 258 HB3 TYR 33 3HB TYR 33 -18.821 35.355 -16.142 259 HD1 TYR 33 HD1 TYR 33 -17.073 33.760 -19.040 260 HD2 TYR 33 HD2 TYR 33 -20.293 36.273 -17.709 261 HE1 TYR 33 HE1 TYR 33 -18.143 33.600 -21.288 262 HE2 TYR 33 HE2 TYR 33 -21.353 36.117 -19.961 263 HH TYR 33 HH TYR 33 -21.284 35.196 -21.978 264 H ARG 34 H ARG 34 -17.512 37.779 -14.909 265 HA ARG 34 HA ARG 34 -15.909 36.695 -12.624 266 HB2 ARG 34 2HB ARG 34 -15.452 39.016 -13.391 267 HB3 ARG 34 3HB ARG 34 -17.137 39.444 -13.120 268 HG2 ARG 34 2HG ARG 34 -16.866 39.100 -10.701 269 HG3 ARG 34 3HG ARG 34 -15.207 38.518 -10.941 270 HD2 ARG 34 2HD ARG 34 -14.602 40.730 -11.935 271 HD3 ARG 34 3HD ARG 34 -16.261 41.265 -11.698 272 HE ARG 34 HE ARG 34 -15.943 41.408 -9.372 273 HH11 ARG 34 2HH2 ARG 34 -12.868 40.429 -10.877 274 HH12 ARG 34 1HH2 ARG 34 -11.998 40.826 -9.424 275 HH21 ARG 34 1HH1 ARG 34 -14.702 41.899 -7.622 276 HH22 ARG 34 2HH1 ARG 34 -12.984 41.642 -7.667 277 H THR 35 H THR 35 -16.869 35.819 -10.926 278 HA THR 35 HA THR 35 -19.793 35.575 -10.802 279 HB THR 35 HB THR 35 -19.448 34.058 -8.918 280 HG1 THR 35 HG1 THR 35 -16.714 34.408 -9.396 281 HG21 THR 35 1HG2 THR 35 -19.373 33.193 -11.201 282 HG22 THR 35 2HG2 THR 35 -17.607 33.431 -11.241 283 HG23 THR 35 3HG2 THR 35 -18.333 32.303 -10.077 284 H ASP 36 H ASP 36 -20.648 35.584 -8.362 285 HA ASP 36 HA ASP 36 -20.546 38.353 -7.613 286 HB2 ASP 36 2HB ASP 36 -22.595 36.916 -7.593 287 HB3 ASP 36 3HB ASP 36 -21.921 36.009 -6.235 288 H ASN 37 H ASN 37 -18.587 35.674 -6.580 289 HA ASN 37 HA ASN 37 -17.803 37.136 -4.102 290 HB2 ASN 37 2HB ASN 37 -16.379 34.729 -5.079 291 HB3 ASN 37 3HB ASN 37 -16.509 35.359 -3.476 292 HD21 ASN 37 1HD2 ASN 37 -16.939 32.710 -4.538 293 HD22 ASN 37 2HD2 ASN 37 -18.542 32.253 -3.919 294 H GLY 38 H GLY 38 -17.226 37.660 -7.290 295 HA2 GLY 38 HA2 GLY 38 -15.604 38.878 -8.404 296 HA3 GLY 38 HA3 GLY 38 -14.508 38.781 -7.019 297 H GLU 39 H GLU 39 -15.704 35.668 -7.792 298 HA GLU 39 HA GLU 39 -13.018 34.869 -8.603 299 HB2 GLU 39 2HB GLU 39 -15.393 33.040 -8.847 300 HB3 GLU 39 3HB GLU 39 -13.724 32.670 -8.491 301 HG2 GLU 39 2HG GLU 39 -14.354 34.188 -6.309 302 HG3 GLU 39 3HG GLU 39 -15.981 33.656 -6.801 303 H GLU 40 H GLU 40 -12.272 35.104 -10.614 304 HA GLU 40 HA GLU 40 -14.145 35.291 -12.910 305 HB2 GLU 40 2HB GLU 40 -11.299 36.180 -12.435 306 HB3 GLU 40 3HB GLU 40 -11.960 36.046 -14.078 307 HG2 GLU 40 2HG GLU 40 -13.737 37.570 -13.612 308 HG3 GLU 40 3HG GLU 40 -13.360 37.597 -11.885 309 H PHE 41 H PHE 41 -14.376 33.874 -14.421 310 HA PHE 41 HA PHE 41 -12.427 31.638 -14.812 311 HB2 PHE 41 2HB PHE 41 -15.462 31.526 -14.785 312 HB3 PHE 41 3HB PHE 41 -14.422 30.208 -15.276 313 HD1 PHE 41 HD2 PHE 41 -15.594 32.184 -12.298 314 HD2 PHE 41 HD1 PHE 41 -13.194 28.855 -13.691 315 HE1 PHE 41 HE2 PHE 41 -15.360 31.372 -10.035 316 HE2 PHE 41 HE1 PHE 41 -12.904 28.099 -11.354 317 HZ PHE 41 HZ PHE 41 -13.985 29.357 -9.502 318 H GLU 42 H GLU 42 -12.694 30.546 -16.920 319 HA GLU 42 HA GLU 42 -13.286 32.486 -19.094 320 HB2 GLU 42 2HB GLU 42 -11.359 30.179 -19.396 321 HB3 GLU 42 3HB GLU 42 -11.558 31.618 -20.378 322 HG2 GLU 42 2HG GLU 42 -9.675 32.279 -19.335 323 HG3 GLU 42 3HG GLU 42 -10.777 32.823 -18.083 324 H VAL 43 H VAL 43 -14.683 31.903 -20.624 325 HA VAL 43 HA VAL 43 -15.701 29.084 -20.698 326 HB VAL 43 HB VAL 43 -17.324 31.556 -21.254 327 HG11 VAL 43 1HG1 VAL 43 -18.148 28.645 -20.942 328 HG12 VAL 43 2HG1 VAL 43 -19.198 30.037 -21.304 329 HG13 VAL 43 3HG1 VAL 43 -18.024 29.502 -22.493 330 HG21 VAL 43 3HG2 VAL 43 -16.742 31.341 -18.811 331 HG22 VAL 43 1HG2 VAL 43 -18.445 31.199 -19.184 332 HG23 VAL 43 2HG2 VAL 43 -17.493 29.732 -18.830 333 HA PRO 44 HA PRO 44 -14.417 29.672 -25.044 334 HB2 PRO 44 2HB PRO 44 -14.048 27.046 -25.682 335 HB3 PRO 44 3HB PRO 44 -12.850 28.008 -24.773 336 HG2 PRO 44 2HG PRO 44 -14.876 26.052 -23.689 337 HG3 PRO 44 3HG PRO 44 -13.160 26.256 -23.223 338 HD2 PRO 44 2HD PRO 44 -15.304 27.332 -21.839 339 HD3 PRO 44 3HD PRO 44 -13.676 28.074 -21.817 340 H PHE 45 H PHE 45 -16.004 30.189 -26.357 341 HA PHE 45 HA PHE 45 -18.465 28.523 -26.706 342 HB2 PHE 45 2HB PHE 45 -17.739 31.400 -27.335 343 HB3 PHE 45 3HB PHE 45 -19.136 30.646 -28.044 344 HD1 PHE 45 HD1 PHE 45 -17.577 31.795 -24.873 345 HD2 PHE 45 HD2 PHE 45 -21.142 30.182 -26.698 346 HE1 PHE 45 HE1 PHE 45 -18.883 32.335 -22.839 347 HE2 PHE 45 HE2 PHE 45 -22.429 30.704 -24.636 348 HZ PHE 45 HZ PHE 45 -21.282 31.776 -22.694 349 H ALA 46 H ALA 46 -19.062 27.800 -28.774 350 HA ALA 46 HA ALA 46 -16.865 27.478 -30.734 351 HB1 ALA 46 3HB ALA 46 -19.666 26.305 -30.625 352 HB2 ALA 46 1HB ALA 46 -18.396 25.881 -31.796 353 HB3 ALA 46 2HB ALA 46 -18.173 25.510 -30.076 354 H ASP 47 H ASP 47 -17.143 27.983 -32.979 355 HA ASP 47 HA ASP 47 -17.908 30.609 -33.523 356 HB2 ASP 47 2HB ASP 47 -16.265 29.364 -34.782 357 HB3 ASP 47 3HB ASP 47 -17.481 28.216 -35.350 358 H ASP 48 H ASP 48 -20.009 27.858 -33.452 359 HA ASP 48 HA ASP 48 -22.141 29.122 -35.076 360 HB2 ASP 48 2HB ASP 48 -23.373 27.124 -34.740 361 HB3 ASP 48 3HB ASP 48 -21.724 26.709 -35.207 362 H ALA 49 H ALA 49 -21.085 29.348 -31.919 363 HA ALA 49 HA ALA 49 -23.724 30.221 -30.815 364 HB1 ALA 49 3HB ALA 49 -22.762 29.807 -28.611 365 HB2 ALA 49 1HB ALA 49 -22.647 28.345 -29.608 366 HB3 ALA 49 2HB ALA 49 -21.208 29.355 -29.340 367 H GLU 50 H GLU 50 -23.673 32.086 -29.372 368 HA GLU 50 HA GLU 50 -21.509 34.069 -29.898 369 HB2 GLU 50 2HB GLU 50 -24.510 34.480 -30.176 370 HB3 GLU 50 3HB GLU 50 -23.383 35.820 -29.925 371 HG2 GLU 50 2HG GLU 50 -22.232 35.386 -31.986 372 HG3 GLU 50 3HG GLU 50 -23.071 33.853 -32.211 373 H ILE 51 H ILE 51 -20.933 35.243 -28.203 374 HA ILE 51 HA ILE 51 -21.249 34.381 -25.605 375 HB ILE 51 HB ILE 51 -20.396 37.198 -26.273 376 HG12 ILE 51 2HG1 ILE 51 -19.225 35.773 -27.877 377 HG13 ILE 51 3HG1 ILE 51 -18.132 36.459 -26.681 378 HG21 ILE 51 1HG2 ILE 51 -20.572 36.598 -23.837 379 HG22 ILE 51 2HG2 ILE 51 -19.464 35.249 -24.119 380 HG23 ILE 51 3HG2 ILE 51 -18.908 36.902 -24.356 381 HD11 ILE 51 3HD1 ILE 51 -17.558 34.144 -27.213 382 HD12 ILE 51 1HD1 ILE 51 -18.042 34.266 -25.520 383 HD13 ILE 51 2HD1 ILE 51 -19.175 33.603 -26.727 384 HA PRO 52 HA PRO 52 -25.028 36.685 -24.447 385 HB2 PRO 52 2HB PRO 52 -25.600 35.196 -22.244 386 HB3 PRO 52 3HB PRO 52 -25.993 34.651 -23.904 387 HG2 PRO 52 2HG PRO 52 -23.669 33.844 -22.151 388 HG3 PRO 52 3HG PRO 52 -24.691 32.820 -23.220 389 HD2 PRO 52 2HD PRO 52 -22.176 33.873 -23.889 390 HD3 PRO 52 3HD PRO 52 -23.386 33.368 -25.069 391 H GLY 53 H GLY 53 -25.266 38.237 -22.866 392 HA2 GLY 53 HA2 GLY 53 -23.156 39.599 -21.736 393 HA3 GLY 53 HA3 GLY 53 -24.818 39.687 -21.142 394 H THR 54 H THR 54 -24.846 36.855 -20.189 395 HA THR 54 HA THR 54 -22.610 36.736 -18.307 396 HB THR 54 HB THR 54 -24.168 36.122 -16.411 397 HG1 THR 54 HG1 THR 54 -26.362 36.331 -16.659 398 HG21 THR 54 1HG2 THR 54 -23.657 38.561 -16.690 399 HG22 THR 54 2HG2 THR 54 -25.178 38.752 -17.565 400 HG23 THR 54 3HG2 THR 54 -25.177 38.231 -15.863 401 H TRP 55 H TRP 55 -22.405 34.603 -17.199 402 HA TRP 55 HA TRP 55 -23.738 32.290 -18.422 403 HB2 TRP 55 2HB TRP 55 -21.929 33.023 -20.041 404 HB3 TRP 55 3HB TRP 55 -20.752 32.687 -18.782 405 HD1 TRP 55 HD1 TRP 55 -20.155 30.201 -18.284 406 HE1 TRP 55 HE1 TRP 55 -20.442 28.034 -19.590 407 HE3 TRP 55 HE3 TRP 55 -23.835 31.699 -21.473 408 HZ2 TRP 55 HZ2 TRP 55 -22.201 27.000 -21.660 409 HZ3 TRP 55 HZ3 TRP 55 -24.840 30.097 -23.093 410 HH2 TRP 55 HH2 TRP 55 -24.021 27.752 -23.203 411 H LEU 56 H LEU 56 -23.433 30.337 -17.213 412 HA LEU 56 HA LEU 56 -22.744 30.713 -14.447 413 HB2 LEU 56 2HB LEU 56 -24.347 28.962 -15.887 414 HB3 LEU 56 3HB LEU 56 -22.997 27.941 -15.385 415 HG LEU 56 HG LEU 56 -24.619 29.674 -13.479 416 HD11 LEU 56 1HD1 LEU 56 -25.748 27.584 -12.815 417 HD12 LEU 56 2HD1 LEU 56 -26.049 27.957 -14.519 418 HD13 LEU 56 3HD1 LEU 56 -24.872 26.696 -14.084 419 HD21 LEU 56 3HD2 LEU 56 -22.699 27.348 -12.993 420 HD22 LEU 56 1HD2 LEU 56 -22.395 29.048 -12.602 421 HD23 LEU 56 2HD2 LEU 56 -23.666 28.171 -11.747 422 H CYS 57 H CYS 57 -20.903 30.505 -13.448 423 HA CYS 57 HA CYS 57 -18.503 29.521 -14.904 424 HB2 CYS 57 2HB CYS 57 -18.925 31.371 -12.526 425 HB3 CYS 57 3HB CYS 57 -17.332 30.805 -13.060 426 HG CYS 57 HG CYS 57 -19.627 32.207 -14.996 427 H ARG 58 H ARG 58 -16.784 28.456 -13.651 428 HA ARG 58 HA ARG 58 -17.816 26.005 -12.609 429 HB2 ARG 58 2HB ARG 58 -14.929 26.948 -12.511 430 HB3 ARG 58 3HB ARG 58 -15.513 25.294 -12.393 431 HG2 ARG 58 2HG ARG 58 -16.420 25.505 -14.751 432 HG3 ARG 58 3HG ARG 58 -15.675 27.112 -14.837 433 HD2 ARG 58 2HD ARG 58 -14.190 25.588 -15.906 434 HD3 ARG 58 3HD ARG 58 -13.450 26.093 -14.377 435 HE ARG 58 HE ARG 58 -14.958 23.649 -14.040 436 HH11 ARG 58 1HH2 ARG 58 -11.904 24.725 -15.379 437 HH12 ARG 58 2HH2 ARG 58 -11.151 23.171 -15.146 438 HH21 ARG 58 2HH1 ARG 58 -13.935 21.697 -13.764 439 HH22 ARG 58 1HH1 ARG 58 -12.279 21.505 -14.260 440 H ASN 59 H ASN 59 -17.103 28.873 -10.873 441 HA ASN 59 HA ASN 59 -16.767 27.731 -8.269 442 HB2 ASN 59 2HB ASN 59 -16.172 29.973 -8.660 443 HB3 ASN 59 3HB ASN 59 -17.776 30.379 -9.293 444 HD21 ASN 59 1HD2 ASN 59 -17.932 32.184 -7.877 445 HD22 ASN 59 2HD2 ASN 59 -18.134 31.946 -6.152 446 H GLY 60 H GLY 60 -19.499 27.868 -10.382 447 HA2 GLY 60 HA2 GLY 60 -21.558 26.766 -10.118 448 HA3 GLY 60 HA3 GLY 60 -21.367 26.747 -8.363 449 H MET 61 H MET 61 -20.732 29.753 -10.014 450 HA MET 61 HA MET 61 -23.402 30.852 -9.277 451 HB2 MET 61 2HB MET 61 -21.511 31.508 -7.706 452 HB3 MET 61 3HB MET 61 -20.722 32.284 -9.057 453 HG2 MET 61 2HG MET 61 -21.984 33.864 -7.626 454 HG3 MET 61 3HG MET 61 -22.522 33.885 -9.302 455 HE1 MET 61 3HE MET 61 -25.851 34.750 -7.490 456 HE2 MET 61 1HE MET 61 -24.239 35.262 -6.956 457 HE3 MET 61 2HE MET 61 -24.637 35.238 -8.693 458 H GLU 62 H GLU 62 -24.231 32.502 -10.642 459 HA GLU 62 HA GLU 62 -23.442 32.397 -13.426 460 HB2 GLU 62 2HB GLU 62 -25.767 32.782 -12.644 461 HB3 GLU 62 3HB GLU 62 -25.290 34.395 -12.087 462 HG2 GLU 62 2HG GLU 62 -24.576 34.968 -14.404 463 HG3 GLU 62 3HG GLU 62 -25.022 33.350 -14.950 464 H GLY 63 H GLY 63 -21.635 33.221 -14.153 465 HA2 GLY 63 HA2 GLY 63 -20.268 35.506 -12.939 466 HA3 GLY 63 HA3 GLY 63 -19.701 34.536 -14.271 467 H THR 64 H THR 64 -20.012 37.525 -13.971 468 HA THR 64 HA THR 64 -21.669 38.001 -16.400 469 HB THR 64 HB THR 64 -20.607 40.010 -14.380 470 HG1 THR 64 HG1 THR 64 -22.739 40.118 -13.708 471 HG21 THR 64 1HG2 THR 64 -20.902 41.178 -16.466 472 HG22 THR 64 2HG2 THR 64 -22.429 40.348 -16.813 473 HG23 THR 64 3HG2 THR 64 -22.330 41.539 -15.494 474 H LEU 65 H LEU 65 -20.911 38.855 -18.218 475 HA LEU 65 HA LEU 65 -18.281 38.269 -18.967 476 HB2 LEU 65 2HB LEU 65 -20.355 38.349 -20.369 477 HB3 LEU 65 3HB LEU 65 -20.332 40.104 -20.263 478 HG LEU 65 HG LEU 65 -17.989 39.940 -21.423 479 HD11 LEU 65 1HD1 LEU 65 -18.998 37.149 -21.983 480 HD12 LEU 65 2HD1 LEU 65 -17.608 37.971 -22.747 481 HD13 LEU 65 3HD1 LEU 65 -17.575 37.573 -21.027 482 HD21 LEU 65 3HD2 LEU 65 -19.030 39.682 -23.647 483 HD22 LEU 65 1HD2 LEU 65 -20.478 38.969 -22.897 484 HD23 LEU 65 2HD2 LEU 65 -20.051 40.667 -22.587 485 H ILE 66 H ILE 66 -16.441 39.259 -18.640 486 HA ILE 66 HA ILE 66 -16.269 42.225 -18.374 487 HB ILE 66 HB ILE 66 -14.337 42.049 -16.995 488 HG12 ILE 66 2HG1 ILE 66 -13.445 39.824 -17.714 489 HG13 ILE 66 3HG1 ILE 66 -13.422 40.121 -15.982 490 HG21 ILE 66 1HG2 ILE 66 -16.495 42.289 -15.917 491 HG22 ILE 66 2HG2 ILE 66 -16.672 40.530 -15.796 492 HG23 ILE 66 3HG2 ILE 66 -15.384 41.353 -14.897 493 HD11 ILE 66 3HD1 ILE 66 -14.025 37.836 -16.496 494 HD12 ILE 66 1HD1 ILE 66 -15.227 38.698 -15.536 495 HD13 ILE 66 2HD1 ILE 66 -15.522 38.439 -17.245 496 H GLU 67 H GLU 67 -14.320 43.198 -19.206 497 HA GLU 67 HA GLU 67 -13.884 42.534 -21.892 498 HB2 GLU 67 2HB GLU 67 -12.188 44.225 -20.020 499 HB3 GLU 67 3HB GLU 67 -11.985 44.148 -21.776 500 HG2 GLU 67 2HG GLU 67 -14.324 44.937 -22.082 501 HG3 GLU 67 3HG GLU 67 -14.506 45.072 -20.332 502 H GLY 68 H GLY 68 -13.190 40.648 -22.507 503 HA2 GLY 68 HA2 GLY 68 -10.511 39.690 -22.501 504 HA3 GLY 68 HA3 GLY 68 -11.383 38.941 -21.144 505 H ASP 69 H ASP 69 -12.281 39.876 -24.496 506 HA ASP 69 HA ASP 69 -13.341 37.275 -25.237 507 HB2 ASP 69 2HB ASP 69 -15.623 38.139 -25.398 508 HB3 ASP 69 3HB ASP 69 -15.074 38.196 -23.730 509 H LEU 70 H LEU 70 -13.861 37.252 -27.409 510 HA LEU 70 HA LEU 70 -12.258 38.930 -29.091 511 HB2 LEU 70 2HB LEU 70 -14.273 36.731 -29.702 512 HB3 LEU 70 3HB LEU 70 -13.428 37.632 -30.950 513 HG LEU 70 HG LEU 70 -11.233 36.881 -30.041 514 HD11 LEU 70 1HD1 LEU 70 -11.704 36.251 -27.749 515 HD12 LEU 70 2HD1 LEU 70 -12.967 35.108 -28.263 516 HD13 LEU 70 3HD1 LEU 70 -11.252 34.795 -28.621 517 HD21 LEU 70 3HD2 LEU 70 -12.332 35.769 -31.945 518 HD22 LEU 70 1HD2 LEU 70 -11.428 34.607 -30.968 519 HD23 LEU 70 2HD2 LEU 70 -13.197 34.688 -30.829 520 HA PRO 71 HA PRO 71 -15.320 42.058 -30.015 521 HB2 PRO 71 2HB PRO 71 -14.086 43.478 -31.961 522 HB3 PRO 71 3HB PRO 71 -13.373 43.311 -30.333 523 HG2 PRO 71 2HG PRO 71 -12.749 41.625 -32.789 524 HG3 PRO 71 3HG PRO 71 -11.593 42.516 -31.747 525 HD2 PRO 71 2HD PRO 71 -12.146 39.868 -31.362 526 HD3 PRO 71 3HD PRO 71 -11.832 40.974 -29.992 527 H GLU 72 H GLU 72 -16.246 39.686 -30.876 528 HA GLU 72 HA GLU 72 -17.083 38.278 -32.505 529 HB2 GLU 72 2HB GLU 72 -18.538 40.910 -32.741 530 HB3 GLU 72 3HB GLU 72 -19.172 39.385 -33.395 531 HG2 GLU 72 2HG GLU 72 -19.333 38.415 -31.196 532 HG3 GLU 72 3HG GLU 72 -18.489 39.770 -30.451 533 HA PRO 73 HA PRO 73 -14.805 40.304 -36.042 534 HB2 PRO 73 2HB PRO 73 -12.439 39.006 -36.196 535 HB3 PRO 73 3HB PRO 73 -12.816 40.136 -34.866 536 HG2 PRO 73 2HG PRO 73 -13.140 37.106 -34.840 537 HG3 PRO 73 3HG PRO 73 -12.232 38.127 -33.680 538 HD2 PRO 73 2HD PRO 73 -14.793 37.388 -33.166 539 HD3 PRO 73 3HD PRO 73 -14.175 39.003 -32.745 540 H LYS 74 H LYS 74 -16.788 39.026 -36.724 541 HA LYS 74 HA LYS 74 -16.283 37.889 -39.347 542 HB2 LYS 74 2HB LYS 74 -15.970 35.796 -38.102 543 HB3 LYS 74 3HB LYS 74 -17.442 36.077 -37.181 544 HG2 LYS 74 2HG LYS 74 -17.907 34.379 -38.761 545 HG3 LYS 74 3HG LYS 74 -18.784 35.804 -39.296 546 HD2 LYS 74 2HD LYS 74 -16.916 36.248 -40.952 547 HD3 LYS 74 3HD LYS 74 -16.142 34.737 -40.423 548 HE2 LYS 74 2HE LYS 74 -18.173 33.470 -41.082 549 HE3 LYS 74 3HE LYS 74 -18.969 34.977 -41.556 550 HZ1 LYS 74 HZ1 LYS 74 -16.547 33.812 -42.843 551 HZ2 LYS 74 HZ2 LYS 74 -18.040 33.883 -43.487 552 HZ3 LYS 74 HZ3 LYS 74 -17.203 35.262 -43.247 553 H LYS 75 H LYS 75 -18.548 38.550 -36.755 554 HA LYS 75 HA LYS 75 -21.010 38.416 -38.171 555 HB2 LYS 75 2HB LYS 75 -20.679 38.129 -35.765 556 HB3 LYS 75 3HB LYS 75 -20.153 39.807 -35.606 557 HG2 LYS 75 2HG LYS 75 -22.396 40.623 -36.123 558 HG3 LYS 75 3HG LYS 75 -22.960 38.964 -36.461 559 HD2 LYS 75 2HD LYS 75 -22.491 38.278 -34.170 560 HD3 LYS 75 3HD LYS 75 -21.720 39.833 -33.815 561 HE2 LYS 75 2HE LYS 75 -23.831 41.007 -34.010 562 HE3 LYS 75 3HE LYS 75 -24.662 39.517 -34.507 563 HZ1 LYS 75 HZ1 LYS 75 -24.242 38.556 -32.390 564 HZ2 LYS 75 HZ2 LYS 75 -23.218 39.737 -31.924 565 HZ3 LYS 75 HZ3 LYS 75 -24.837 40.053 -32.061 566 H VAL 76 H VAL 76 -22.144 39.803 -39.312 567 HA VAL 76 HA VAL 76 -21.609 42.732 -39.271 568 HB VAL 76 HB VAL 76 -21.936 41.116 -41.835 569 HG11 VAL 76 1HG1 VAL 76 -21.527 44.110 -41.389 570 HG12 VAL 76 2HG1 VAL 76 -21.489 43.290 -42.964 571 HG13 VAL 76 3HG1 VAL 76 -22.989 43.330 -42.044 572 HG21 VAL 76 3HG2 VAL 76 -19.512 42.621 -40.757 573 HG22 VAL 76 1HG2 VAL 76 -19.646 40.864 -40.995 574 HG23 VAL 76 2HG2 VAL 76 -19.654 41.937 -42.391 575 H LYS 77 H LYS 77 -23.428 43.918 -39.223 576 HA LYS 77 HA LYS 77 -26.057 42.771 -40.001 577 HB2 LYS 77 2HB LYS 77 -25.451 44.095 -37.316 578 HB3 LYS 77 3HB LYS 77 -27.072 43.785 -37.938 579 HG2 LYS 77 2HG LYS 77 -26.549 41.326 -38.008 580 HG3 LYS 77 3HG LYS 77 -24.968 41.672 -37.304 581 HD2 LYS 77 2HD LYS 77 -26.400 40.938 -35.528 582 HD3 LYS 77 3HD LYS 77 -26.046 42.646 -35.302 583 HE2 LYS 77 2HE LYS 77 -28.348 42.320 -34.768 584 HE3 LYS 77 3HE LYS 77 -28.293 43.212 -36.286 585 HZ1 LYS 77 HZ1 LYS 77 -28.743 41.097 -37.448 586 HZ2 LYS 77 HZ2 LYS 77 -28.765 40.282 -36.030 587 HZ3 LYS 77 HZ3 LYS 77 -29.912 41.390 -36.350 588 HA PRO 78 HA PRO 78 -26.489 46.811 -41.796 589 HB2 PRO 78 2HB PRO 78 -29.199 47.092 -42.060 590 HB3 PRO 78 3HB PRO 78 -28.240 45.925 -43.023 591 HG2 PRO 78 2HG PRO 78 -29.795 45.391 -40.467 592 HG3 PRO 78 3HG PRO 78 -29.858 44.476 -42.008 593 HD2 PRO 78 2HD PRO 78 -28.303 43.664 -39.934 594 HD3 PRO 78 3HD PRO 78 -27.741 43.499 -41.624 595 HA PRO 79 HA PRO 79 -27.175 49.673 -38.422 596 HB2 PRO 79 2HB PRO 79 -27.570 52.053 -39.702 597 HB3 PRO 79 3HB PRO 79 -25.990 51.211 -39.678 598 HG2 PRO 79 2HG PRO 79 -28.107 51.132 -41.856 599 HG3 PRO 79 3HG PRO 79 -26.349 51.435 -42.033 600 HD2 PRO 79 2HD PRO 79 -27.434 48.968 -42.438 601 HD3 PRO 79 3HD PRO 79 -25.825 49.162 -41.681 602 H ARG 80 H ARG 80 -28.806 50.547 -37.209 603 HA ARG 80 HA ARG 80 -31.555 50.897 -38.269 604 HB2 ARG 80 2HB ARG 80 -30.839 49.062 -35.939 605 HB3 ARG 80 3HB ARG 80 -32.469 49.623 -36.326 606 HG2 ARG 80 2HG ARG 80 -32.286 48.538 -38.578 607 HG3 ARG 80 3HG ARG 80 -30.713 47.871 -38.099 608 HD2 ARG 80 2HD ARG 80 -31.768 46.688 -36.213 609 HD3 ARG 80 3HD ARG 80 -33.345 47.343 -36.652 610 HE ARG 80 HE ARG 80 -31.870 45.165 -37.955 611 HH11 ARG 80 1HH1 ARG 80 -34.544 47.393 -38.394 612 HH12 ARG 80 2HH1 ARG 80 -35.272 46.405 -39.631 613 HH21 ARG 80 1HH2 ARG 80 -32.865 43.962 -39.526 614 HH22 ARG 80 2HH2 ARG 80 -34.344 44.523 -40.248 Start of MODEL 13 1 H1 SER 1 1H SER 1 9.546 5.947 -17.752 2 H2 SER 1 2H SER 1 9.541 5.576 -19.348 3 H3 SER 1 3H SER 1 8.540 4.782 -18.323 4 HA SER 1 HA SER 1 7.284 6.745 -17.871 5 HB2 SER 1 2HB SER 1 9.157 8.112 -19.842 6 HB3 SER 1 3HB SER 1 7.766 8.844 -19.016 7 HG SER 1 HG SER 1 9.738 9.285 -17.930 8 H MET 2 H MET 2 5.511 7.456 -19.203 9 HA MET 2 HA MET 2 5.340 6.383 -21.976 10 HB2 MET 2 2HB MET 2 3.302 5.890 -19.764 11 HB3 MET 2 3HB MET 2 3.032 5.573 -21.481 12 HG2 MET 2 2HG MET 2 4.969 4.002 -21.476 13 HG3 MET 2 3HG MET 2 5.112 4.213 -19.730 14 HE1 MET 2 3HE MET 2 2.141 4.201 -18.605 15 HE2 MET 2 1HE MET 2 1.946 2.463 -18.307 16 HE3 MET 2 2HE MET 2 3.495 3.253 -17.946 17 H ALA 3 H ALA 3 3.677 7.377 -23.258 18 HA ALA 3 HA ALA 3 3.287 10.208 -22.734 19 HB1 ALA 3 3HB ALA 3 2.205 8.399 -24.934 20 HB2 ALA 3 1HB ALA 3 2.157 10.173 -24.918 21 HB3 ALA 3 2HB ALA 3 3.718 9.336 -24.993 22 H ASP 4 H ASP 4 1.312 11.316 -22.592 23 HA ASP 4 HA ASP 4 -0.839 9.899 -21.091 24 HB2 ASP 4 2HB ASP 4 0.340 11.829 -20.066 25 HB3 ASP 4 3HB ASP 4 -0.197 12.854 -21.396 26 H ARG 5 H ARG 5 -0.257 11.533 -24.124 27 HA ARG 5 HA ARG 5 -3.020 12.098 -24.786 28 HB2 ARG 5 2HB ARG 5 -2.223 12.747 -26.936 29 HB3 ARG 5 3HB ARG 5 -1.082 13.336 -25.731 30 HG2 ARG 5 2HG ARG 5 0.439 11.424 -26.240 31 HG3 ARG 5 3HG ARG 5 -0.695 10.838 -27.461 32 HD2 ARG 5 2HD ARG 5 0.755 13.510 -27.531 33 HD3 ARG 5 3HD ARG 5 1.172 12.079 -28.458 34 HE ARG 5 HE ARG 5 -0.913 12.250 -29.700 35 HH11 ARG 5 1HH1 ARG 5 -0.277 15.209 -27.845 36 HH12 ARG 5 2HH1 ARG 5 -1.177 16.144 -29.037 37 HH21 ARG 5 1HH2 ARG 5 -2.093 13.531 -30.955 38 HH22 ARG 5 2HH2 ARG 5 -2.129 15.281 -30.680 39 H VAL 6 H VAL 6 -4.240 11.240 -26.537 40 HA VAL 6 HA VAL 6 -3.736 8.405 -27.292 41 HB VAL 6 HB VAL 6 -5.160 8.613 -25.242 42 HG11 VAL 6 1HG1 VAL 6 -7.501 9.189 -25.406 43 HG12 VAL 6 2HG1 VAL 6 -6.515 10.579 -25.882 44 HG13 VAL 6 3HG1 VAL 6 -7.336 9.601 -27.121 45 HG21 VAL 6 3HG2 VAL 6 -6.668 6.849 -25.780 46 HG22 VAL 6 1HG2 VAL 6 -6.562 7.181 -27.514 47 HG23 VAL 6 2HG2 VAL 6 -5.140 6.576 -26.633 48 H LEU 7 H LEU 7 -3.575 11.024 -28.702 49 HA LEU 7 HA LEU 7 -5.313 10.468 -31.066 50 HB2 LEU 7 2HB LEU 7 -4.910 13.144 -29.660 51 HB3 LEU 7 3HB LEU 7 -5.682 12.962 -31.228 52 HG LEU 7 HG LEU 7 -6.758 11.772 -28.635 53 HD11 LEU 7 1HD1 LEU 7 -8.458 13.536 -28.793 54 HD12 LEU 7 2HD1 LEU 7 -6.836 14.233 -28.655 55 HD13 LEU 7 3HD1 LEU 7 -7.655 14.203 -30.233 56 HD21 LEU 7 3HD2 LEU 7 -8.837 11.444 -29.951 57 HD22 LEU 7 1HD2 LEU 7 -7.998 11.994 -31.419 58 HD23 LEU 7 2HD2 LEU 7 -7.509 10.488 -30.610 59 H ARG 8 H ARG 8 -4.602 11.640 -33.008 60 HA ARG 8 HA ARG 8 -1.620 11.870 -33.218 61 HB2 ARG 8 2HB ARG 8 -3.763 11.433 -35.338 62 HB3 ARG 8 3HB ARG 8 -2.033 11.604 -35.664 63 HG2 ARG 8 2HG ARG 8 -1.564 9.613 -34.243 64 HG3 ARG 8 3HG ARG 8 -3.299 9.379 -34.001 65 HD2 ARG 8 2HD ARG 8 -1.863 9.348 -36.690 66 HD3 ARG 8 3HD ARG 8 -2.332 7.916 -35.787 67 HE ARG 8 HE ARG 8 -4.057 9.670 -37.382 68 HH11 ARG 8 1HH2 ARG 8 -4.132 7.184 -34.907 69 HH12 ARG 8 2HH2 ARG 8 -5.796 6.785 -35.240 70 HH21 ARG 8 1HH1 ARG 8 -6.169 9.111 -37.742 71 HH22 ARG 8 2HH1 ARG 8 -6.911 7.849 -36.803 72 H GLY 9 H GLY 9 -0.825 13.471 -34.821 73 HA2 GLY 9 HA2 GLY 9 -0.847 15.425 -36.032 74 HA3 GLY 9 HA3 GLY 9 -2.517 15.705 -35.565 75 H SER 10 H SER 10 -0.553 15.376 -32.762 76 HA SER 10 HA SER 10 0.511 18.091 -32.758 77 HB2 SER 10 2HB SER 10 -0.648 18.892 -30.774 78 HB3 SER 10 3HB SER 10 -1.781 18.563 -32.085 79 HG SER 10 HG SER 10 -2.621 17.757 -30.197 80 H ARG 11 H ARG 11 1.676 18.590 -30.670 81 HA ARG 11 HA ARG 11 3.344 16.213 -30.012 82 HB2 ARG 11 2HB ARG 11 3.861 19.195 -29.710 83 HB3 ARG 11 3HB ARG 11 5.021 17.911 -29.355 84 HG2 ARG 11 2HG ARG 11 4.974 17.165 -31.705 85 HG3 ARG 11 3HG ARG 11 3.823 18.439 -32.109 86 HD2 ARG 11 2HD ARG 11 6.665 18.834 -31.077 87 HD3 ARG 11 3HD ARG 11 6.137 19.057 -32.741 88 HE ARG 11 HE ARG 11 5.928 20.951 -30.579 89 HH11 ARG 11 1HH2 ARG 11 4.264 20.117 -33.582 90 HH12 ARG 11 2HH2 ARG 11 3.557 21.721 -33.666 91 HH21 ARG 11 1HH1 ARG 11 5.021 22.937 -30.886 92 HH22 ARG 11 2HH1 ARG 11 3.870 23.154 -32.214 93 H LEU 12 H LEU 12 1.053 18.178 -28.362 94 HA LEU 12 HA LEU 12 2.259 18.229 -25.766 95 HB2 LEU 12 2HB LEU 12 -0.675 18.438 -26.549 96 HB3 LEU 12 3HB LEU 12 -0.007 18.873 -24.980 97 HG LEU 12 HG LEU 12 0.636 20.256 -27.623 98 HD11 LEU 12 1HD1 LEU 12 -0.620 22.132 -26.668 99 HD12 LEU 12 2HD1 LEU 12 -1.641 20.689 -26.781 100 HD13 LEU 12 3HD1 LEU 12 -0.972 21.180 -25.208 101 HD21 LEU 12 3HD2 LEU 12 1.532 20.913 -24.781 102 HD22 LEU 12 1HD2 LEU 12 2.578 20.416 -26.133 103 HD23 LEU 12 2HD2 LEU 12 1.743 21.969 -26.194 104 H GLY 13 H GLY 13 1.863 17.051 -23.861 105 HA2 GLY 13 HA2 GLY 13 1.398 15.196 -22.571 106 HA3 GLY 13 HA3 GLY 13 0.148 14.738 -23.730 107 H ALA 14 H ALA 14 3.360 15.074 -25.034 108 HA ALA 14 HA ALA 14 4.178 12.293 -24.564 109 HB1 ALA 14 3HB ALA 14 4.385 11.832 -27.006 110 HB2 ALA 14 1HB ALA 14 2.707 12.076 -26.513 111 HB3 ALA 14 2HB ALA 14 3.579 13.378 -27.357 112 H VAL 15 H VAL 15 6.346 11.863 -25.563 113 HA VAL 15 HA VAL 15 8.030 14.251 -26.012 114 HB VAL 15 HB VAL 15 9.845 13.101 -24.706 115 HG11 VAL 15 1HG1 VAL 15 9.127 13.977 -22.546 116 HG12 VAL 15 2HG1 VAL 15 8.641 15.073 -23.847 117 HG13 VAL 15 3HG1 VAL 15 7.437 14.010 -23.087 118 HG21 VAL 15 3HG2 VAL 15 7.586 11.504 -23.435 119 HG22 VAL 15 1HG2 VAL 15 8.849 10.837 -24.494 120 HG23 VAL 15 2HG2 VAL 15 9.284 11.542 -22.932 121 H SER 16 H SER 16 9.947 12.331 -28.370 122 HA SER 16 HA SER 16 10.105 14.650 -26.566 123 HB2 SER 16 2HB SER 16 11.953 15.325 -28.041 124 HB3 SER 16 3HB SER 16 12.161 13.709 -27.350 125 HG SER 16 HG SER 16 12.659 13.748 -29.587 126 H TYR 17 H TYR 17 9.842 16.800 -27.242 127 HA TYR 17 HA TYR 17 8.087 17.286 -29.620 128 HB2 TYR 17 2HB TYR 17 6.982 19.007 -28.287 129 HB3 TYR 17 3HB TYR 17 6.826 17.406 -27.583 130 HD1 TYR 17 HD1 TYR 17 8.412 20.734 -27.214 131 HD2 TYR 17 HD2 TYR 17 7.775 16.868 -25.415 132 HE1 TYR 17 HE1 TYR 17 9.325 21.586 -25.042 133 HE2 TYR 17 HE2 TYR 17 8.683 17.717 -23.257 134 HH TYR 17 HH TYR 17 9.567 19.510 -22.135 135 H GLU 18 H GLU 18 11.112 17.794 -28.585 136 HA GLU 18 HA GLU 18 12.844 19.162 -29.069 137 HB2 GLU 18 2HB GLU 18 11.289 19.549 -31.647 138 HB3 GLU 18 3HB GLU 18 13.023 19.806 -31.422 139 HG2 GLU 18 2HG GLU 18 13.273 17.400 -30.774 140 HG3 GLU 18 3HG GLU 18 11.569 17.142 -31.161 141 H THR 19 H THR 19 10.646 20.591 -27.671 142 HA THR 19 HA THR 19 9.880 22.638 -27.107 143 HB THR 19 HB THR 19 12.508 23.907 -27.858 144 HG1 THR 19 HG1 THR 19 12.992 21.938 -26.860 145 HG21 THR 19 1HG2 THR 19 10.819 25.356 -26.728 146 HG22 THR 19 2HG2 THR 19 10.667 24.159 -25.425 147 HG23 THR 19 3HG2 THR 19 12.194 25.036 -25.670 148 H ASP 20 H ASP 20 9.354 21.827 -29.868 149 HA ASP 20 HA ASP 20 9.507 24.225 -31.506 150 HB2 ASP 20 2HB ASP 20 9.654 21.990 -32.482 151 HB3 ASP 20 3HB ASP 20 8.021 21.615 -31.924 152 H ARG 21 H ARG 21 8.034 25.753 -31.896 153 HA ARG 21 HA ARG 21 5.375 25.698 -30.525 154 HB2 ARG 21 2HB ARG 21 7.224 26.694 -29.110 155 HB3 ARG 21 3HB ARG 21 7.372 27.985 -30.305 156 HG2 ARG 21 2HG ARG 21 4.966 28.595 -29.880 157 HG3 ARG 21 3HG ARG 21 4.863 27.275 -28.702 158 HD2 ARG 21 2HD ARG 21 6.666 28.365 -27.355 159 HD3 ARG 21 3HD ARG 21 6.755 29.660 -28.547 160 HE ARG 21 HE ARG 21 4.773 30.589 -27.761 161 HH11 ARG 21 1HH1 ARG 21 5.196 27.515 -26.121 162 HH12 ARG 21 2HH1 ARG 21 3.946 27.865 -24.960 163 HH21 ARG 21 2HH2 ARG 21 3.200 30.963 -26.249 164 HH22 ARG 21 1HH2 ARG 21 2.851 29.767 -25.035 165 H ASN 22 H ASN 22 5.056 25.173 -32.924 166 HA ASN 22 HA ASN 22 4.938 27.328 -34.825 167 HB2 ASN 22 2HB ASN 22 3.714 25.812 -36.192 168 HB3 ASN 22 3HB ASN 22 4.892 24.833 -35.330 169 HD21 ASN 22 1HD2 ASN 22 1.445 25.558 -35.727 170 HD22 ASN 22 2HD2 ASN 22 0.871 24.313 -34.647 171 H HIS 23 H HIS 23 2.949 28.266 -35.731 172 HA HIS 23 HA HIS 23 0.983 29.095 -33.679 173 HB2 HIS 23 2HB HIS 23 2.012 30.765 -35.181 174 HB3 HIS 23 3HB HIS 23 1.331 29.932 -36.579 175 HD2 HIS 23 HD2 HIS 23 0.008 31.602 -33.287 176 HE1 HIS 23 HE1 HIS 23 -2.852 32.347 -36.362 177 HE2 HIS 23 HE2 HIS 23 -2.268 32.770 -33.919 178 H ASP 24 H ASP 24 -1.216 28.714 -33.791 179 HA ASP 24 HA ASP 24 -2.424 27.083 -35.914 180 HB2 ASP 24 2HB ASP 24 -2.210 26.176 -33.020 181 HB3 ASP 24 3HB ASP 24 -3.574 25.705 -34.014 182 H LEU 25 H LEU 25 -4.720 27.069 -35.816 183 HA LEU 25 HA LEU 25 -6.068 29.037 -34.063 184 HB2 LEU 25 2HB LEU 25 -6.248 28.953 -37.104 185 HB3 LEU 25 3HB LEU 25 -7.404 29.804 -36.089 186 HG LEU 25 HG LEU 25 -4.432 30.464 -36.229 187 HD11 LEU 25 1HD1 LEU 25 -5.167 32.446 -37.491 188 HD12 LEU 25 2HD1 LEU 25 -5.615 30.955 -38.333 189 HD13 LEU 25 3HD1 LEU 25 -6.848 31.871 -37.438 190 HD21 LEU 25 3HD2 LEU 25 -5.146 32.578 -35.089 191 HD22 LEU 25 1HD2 LEU 25 -6.776 31.898 -34.896 192 HD23 LEU 25 2HD2 LEU 25 -5.388 31.158 -34.070 193 H ALA 26 H ALA 26 -8.317 28.721 -33.852 194 HA ALA 26 HA ALA 26 -9.554 26.294 -34.970 195 HB1 ALA 26 3HB ALA 26 -8.544 25.530 -32.854 196 HB2 ALA 26 1HB ALA 26 -9.348 26.851 -31.976 197 HB3 ALA 26 2HB ALA 26 -10.312 25.557 -32.719 198 HA PRO 27 HA PRO 27 -12.930 29.176 -35.111 199 HB2 PRO 27 2HB PRO 27 -15.040 27.604 -35.769 200 HB3 PRO 27 3HB PRO 27 -13.610 27.757 -36.825 201 HG2 PRO 27 2HG PRO 27 -14.180 25.567 -34.793 202 HG3 PRO 27 3HG PRO 27 -13.734 25.381 -36.520 203 HD2 PRO 27 2HD PRO 27 -11.882 25.267 -34.509 204 HD3 PRO 27 3HD PRO 27 -11.502 25.970 -36.109 205 H ARG 28 H ARG 28 -12.405 29.457 -32.714 206 HA ARG 28 HA ARG 28 -14.929 29.252 -31.186 207 HB2 ARG 28 2HB ARG 28 -13.896 28.394 -29.218 208 HB3 ARG 28 3HB ARG 28 -13.535 27.330 -30.579 209 HG2 ARG 28 2HG ARG 28 -11.247 28.291 -30.745 210 HG3 ARG 28 3HG ARG 28 -11.639 29.404 -29.423 211 HD2 ARG 28 2HD ARG 28 -10.402 27.637 -28.457 212 HD3 ARG 28 3HD ARG 28 -12.065 27.433 -27.931 213 HE ARG 28 HE ARG 28 -12.336 25.624 -29.569 214 HH11 ARG 28 2HH2 ARG 28 -8.985 26.413 -28.872 215 HH12 ARG 28 1HH2 ARG 28 -8.430 24.846 -29.389 216 HH21 ARG 28 1HH1 ARG 28 -11.548 23.669 -30.213 217 HH22 ARG 28 2HH1 ARG 28 -9.843 23.346 -30.127 218 H GLN 29 H GLN 29 -14.887 30.478 -29.180 219 HA GLN 29 HA GLN 29 -13.420 33.069 -29.238 220 HB2 GLN 29 2HB GLN 29 -16.402 32.782 -28.680 221 HB3 GLN 29 3HB GLN 29 -15.469 34.271 -28.715 222 HG2 GLN 29 2HG GLN 29 -15.985 34.553 -30.870 223 HG3 GLN 29 3HG GLN 29 -15.195 33.036 -31.301 224 HE21 GLN 29 1HE2 GLN 29 -16.754 31.099 -30.187 225 HE22 GLN 29 2HE2 GLN 29 -18.362 31.172 -30.910 226 H ILE 30 H ILE 30 -12.348 33.019 -27.358 227 HA ILE 30 HA ILE 30 -13.456 31.714 -24.932 228 HB ILE 30 HB ILE 30 -10.818 33.205 -25.160 229 HG12 ILE 30 2HG1 ILE 30 -10.621 31.515 -26.814 230 HG13 ILE 30 3HG1 ILE 30 -9.714 31.016 -25.393 231 HG21 ILE 30 1HG2 ILE 30 -11.607 32.876 -22.869 232 HG22 ILE 30 2HG2 ILE 30 -11.886 31.150 -23.168 233 HG23 ILE 30 3HG2 ILE 30 -10.237 31.809 -23.181 234 HD11 ILE 30 3HD1 ILE 30 -10.832 29.108 -26.343 235 HD12 ILE 30 1HD1 ILE 30 -11.593 29.480 -24.789 236 HD13 ILE 30 2HD1 ILE 30 -12.399 29.933 -26.316 237 H ALA 31 H ALA 31 -14.988 32.949 -23.952 238 HA ALA 31 HA ALA 31 -14.445 35.837 -23.408 239 HB1 ALA 31 3HB ALA 31 -16.656 35.502 -24.261 240 HB2 ALA 31 1HB ALA 31 -16.955 34.139 -23.154 241 HB3 ALA 31 2HB ALA 31 -16.792 35.786 -22.520 242 H ARG 32 H ARG 32 -14.701 36.569 -21.209 243 HA ARG 32 HA ARG 32 -14.207 34.527 -19.065 244 HB2 ARG 32 2HB ARG 32 -12.831 37.127 -19.647 245 HB3 ARG 32 3HB ARG 32 -13.234 36.817 -17.953 246 HG2 ARG 32 2HG ARG 32 -12.072 34.735 -17.938 247 HG3 ARG 32 3HG ARG 32 -11.748 34.805 -19.683 248 HD2 ARG 32 2HD ARG 32 -10.287 36.730 -19.374 249 HD3 ARG 32 3HD ARG 32 -10.767 36.863 -17.670 250 HE ARG 32 HE ARG 32 -9.498 34.314 -18.498 251 HH11 ARG 32 1HH1 ARG 32 -8.937 37.400 -16.966 252 HH12 ARG 32 2HH1 ARG 32 -7.432 36.868 -16.251 253 HH21 ARG 32 2HH2 ARG 32 -7.690 33.662 -17.492 254 HH22 ARG 32 1HH2 ARG 32 -6.775 34.796 -16.511 255 H TYR 33 H TYR 33 -15.227 34.848 -17.079 256 HA TYR 33 HA TYR 33 -17.269 36.973 -16.906 257 HB2 TYR 33 2HB TYR 33 -17.942 34.047 -16.500 258 HB3 TYR 33 3HB TYR 33 -18.972 35.398 -16.139 259 HD1 TYR 33 HD1 TYR 33 -17.258 33.650 -18.976 260 HD2 TYR 33 HD2 TYR 33 -20.394 36.310 -17.734 261 HE1 TYR 33 HE1 TYR 33 -18.312 33.484 -21.237 262 HE2 TYR 33 HE2 TYR 33 -21.412 36.182 -20.002 263 HH TYR 33 HH TYR 33 -21.366 35.206 -22.003 264 H ARG 34 H ARG 34 -17.699 37.661 -14.890 265 HA ARG 34 HA ARG 34 -15.996 36.691 -12.635 266 HB2 ARG 34 2HB ARG 34 -15.610 38.982 -13.567 267 HB3 ARG 34 3HB ARG 34 -17.268 39.412 -13.170 268 HG2 ARG 34 2HG ARG 34 -16.825 39.120 -10.775 269 HG3 ARG 34 3HG ARG 34 -15.188 38.524 -11.111 270 HD2 ARG 34 2HD ARG 34 -14.609 40.705 -12.146 271 HD3 ARG 34 3HD ARG 34 -16.258 41.263 -11.873 272 HE ARG 34 HE ARG 34 -15.878 41.444 -9.559 273 HH11 ARG 34 1HH1 ARG 34 -12.837 40.476 -11.137 274 HH12 ARG 34 2HH1 ARG 34 -11.934 40.882 -9.706 275 HH21 ARG 34 1HH2 ARG 34 -14.598 41.955 -7.846 276 HH22 ARG 34 2HH2 ARG 34 -12.880 41.706 -7.932 277 H THR 35 H THR 35 -16.900 35.850 -10.907 278 HA THR 35 HA THR 35 -19.801 35.523 -10.710 279 HB THR 35 HB THR 35 -19.351 34.092 -8.777 280 HG1 THR 35 HG1 THR 35 -16.644 34.535 -9.295 281 HG21 THR 35 1HG2 THR 35 -18.058 32.357 -9.849 282 HG22 THR 35 2HG2 THR 35 -19.259 33.073 -10.947 283 HG23 THR 35 3HG2 THR 35 -17.539 33.476 -11.127 284 H ASP 36 H ASP 36 -20.593 35.582 -8.229 285 HA ASP 36 HA ASP 36 -20.560 38.383 -7.574 286 HB2 ASP 36 2HB ASP 36 -22.569 36.885 -7.443 287 HB3 ASP 36 3HB ASP 36 -21.823 36.046 -6.081 288 H ASN 37 H ASN 37 -18.533 35.761 -6.487 289 HA ASN 37 HA ASN 37 -17.698 37.343 -4.106 290 HB2 ASN 37 2HB ASN 37 -16.285 34.889 -4.980 291 HB3 ASN 37 3HB ASN 37 -16.403 35.599 -3.408 292 HD21 ASN 37 1HD2 ASN 37 -16.930 32.892 -4.500 293 HD22 ASN 37 2HD2 ASN 37 -18.527 32.487 -3.832 294 H GLY 38 H GLY 38 -17.199 37.764 -7.308 295 HA2 GLY 38 HA2 GLY 38 -15.607 38.938 -8.510 296 HA3 GLY 38 HA3 GLY 38 -14.497 38.934 -7.133 297 H GLU 39 H GLU 39 -15.661 35.778 -7.795 298 HA GLU 39 HA GLU 39 -12.971 34.955 -8.609 299 HB2 GLU 39 2HB GLU 39 -15.364 33.123 -8.758 300 HB3 GLU 39 3HB GLU 39 -13.693 32.753 -8.429 301 HG2 GLU 39 2HG GLU 39 -14.234 34.329 -6.270 302 HG3 GLU 39 3HG GLU 39 -15.878 33.805 -6.695 303 H GLU 40 H GLU 40 -12.275 35.176 -10.659 304 HA GLU 40 HA GLU 40 -14.219 35.308 -12.900 305 HB2 GLU 40 2HB GLU 40 -11.323 36.144 -12.608 306 HB3 GLU 40 3HB GLU 40 -12.146 36.058 -14.179 307 HG2 GLU 40 2HG GLU 40 -13.862 37.598 -13.441 308 HG3 GLU 40 3HG GLU 40 -13.176 37.658 -11.813 309 H PHE 41 H PHE 41 -14.510 33.819 -14.359 310 HA PHE 41 HA PHE 41 -12.518 31.615 -14.748 311 HB2 PHE 41 2HB PHE 41 -15.547 31.444 -14.699 312 HB3 PHE 41 3HB PHE 41 -14.484 30.152 -15.200 313 HD1 PHE 41 HD2 PHE 41 -15.561 32.170 -12.205 314 HD2 PHE 41 HD1 PHE 41 -13.337 28.735 -13.655 315 HE1 PHE 41 HE2 PHE 41 -15.235 31.374 -9.918 316 HE2 PHE 41 HE1 PHE 41 -12.948 28.015 -11.322 317 HZ PHE 41 HZ PHE 41 -13.877 29.342 -9.439 318 H GLU 42 H GLU 42 -12.732 30.536 -16.829 319 HA GLU 42 HA GLU 42 -13.400 32.449 -19.022 320 HB2 GLU 42 2HB GLU 42 -11.396 30.182 -19.120 321 HB3 GLU 42 3HB GLU 42 -11.750 31.363 -20.376 322 HG2 GLU 42 2HG GLU 42 -10.363 32.883 -19.563 323 HG3 GLU 42 3HG GLU 42 -11.017 32.774 -17.942 324 H VAL 43 H VAL 43 -14.729 31.858 -20.589 325 HA VAL 43 HA VAL 43 -15.724 29.027 -20.730 326 HB VAL 43 HB VAL 43 -17.395 31.486 -21.230 327 HG11 VAL 43 1HG1 VAL 43 -18.157 28.549 -20.990 328 HG12 VAL 43 2HG1 VAL 43 -19.240 29.923 -21.319 329 HG13 VAL 43 3HG1 VAL 43 -18.048 29.449 -22.517 330 HG21 VAL 43 3HG2 VAL 43 -18.530 31.070 -19.188 331 HG22 VAL 43 1HG2 VAL 43 -17.572 29.601 -18.853 332 HG23 VAL 43 2HG2 VAL 43 -16.836 31.218 -18.780 333 HA PRO 44 HA PRO 44 -14.411 29.706 -25.042 334 HB2 PRO 44 2HB PRO 44 -14.607 26.762 -25.142 335 HB3 PRO 44 3HB PRO 44 -13.254 27.788 -25.626 336 HG2 PRO 44 2HG PRO 44 -13.175 26.256 -23.347 337 HG3 PRO 44 3HG PRO 44 -12.412 27.875 -23.406 338 HD2 PRO 44 2HD PRO 44 -15.107 27.117 -22.259 339 HD3 PRO 44 3HD PRO 44 -13.843 28.219 -21.620 340 H PHE 45 H PHE 45 -15.846 30.124 -26.492 341 HA PHE 45 HA PHE 45 -18.394 28.537 -26.814 342 HB2 PHE 45 2HB PHE 45 -17.728 31.441 -27.332 343 HB3 PHE 45 3HB PHE 45 -19.086 30.680 -28.101 344 HD1 PHE 45 HD2 PHE 45 -17.645 31.702 -24.817 345 HD2 PHE 45 HD1 PHE 45 -21.138 30.220 -26.869 346 HE1 PHE 45 HE2 PHE 45 -19.031 32.199 -22.832 347 HE2 PHE 45 HE1 PHE 45 -22.518 30.728 -24.865 348 HZ PHE 45 HZ PHE 45 -21.443 31.686 -22.820 349 H ALA 46 H ALA 46 -18.959 27.857 -28.914 350 HA ALA 46 HA ALA 46 -16.696 27.636 -30.831 351 HB1 ALA 46 3HB ALA 46 -18.107 25.944 -31.908 352 HB2 ALA 46 1HB ALA 46 -17.883 25.589 -30.185 353 HB3 ALA 46 2HB ALA 46 -19.418 26.285 -30.755 354 H ASP 47 H ASP 47 -16.994 28.117 -33.096 355 HA ASP 47 HA ASP 47 -17.968 30.707 -33.595 356 HB2 ASP 47 2HB ASP 47 -16.189 29.556 -34.839 357 HB3 ASP 47 3HB ASP 47 -17.373 28.447 -35.541 358 H ASP 48 H ASP 48 -19.817 27.776 -33.604 359 HA ASP 48 HA ASP 48 -22.032 28.867 -35.238 360 HB2 ASP 48 2HB ASP 48 -23.141 26.803 -34.855 361 HB3 ASP 48 3HB ASP 48 -21.472 26.486 -35.319 362 H ALA 49 H ALA 49 -21.006 29.194 -32.074 363 HA ALA 49 HA ALA 49 -23.665 30.050 -31.011 364 HB1 ALA 49 3HB ALA 49 -21.139 29.278 -29.495 365 HB2 ALA 49 1HB ALA 49 -22.725 29.661 -28.799 366 HB3 ALA 49 2HB ALA 49 -22.527 28.200 -29.781 367 H GLU 50 H GLU 50 -23.361 31.830 -29.289 368 HA GLU 50 HA GLU 50 -21.247 33.805 -29.875 369 HB2 GLU 50 2HB GLU 50 -22.786 35.629 -30.069 370 HB3 GLU 50 3HB GLU 50 -23.211 34.399 -31.262 371 HG2 GLU 50 2HG GLU 50 -25.045 33.601 -29.743 372 HG3 GLU 50 3HG GLU 50 -24.648 34.903 -28.618 373 H ILE 51 H ILE 51 -21.097 35.461 -28.159 374 HA ILE 51 HA ILE 51 -21.240 34.355 -25.521 375 HB ILE 51 HB ILE 51 -20.344 37.142 -26.246 376 HG12 ILE 51 2HG1 ILE 51 -19.201 35.689 -27.821 377 HG13 ILE 51 3HG1 ILE 51 -18.088 36.369 -26.635 378 HG21 ILE 51 1HG2 ILE 51 -18.880 36.872 -24.326 379 HG22 ILE 51 2HG2 ILE 51 -20.549 36.587 -23.813 380 HG23 ILE 51 3HG2 ILE 51 -19.445 35.226 -24.057 381 HD11 ILE 51 3HD1 ILE 51 -17.527 34.059 -27.117 382 HD12 ILE 51 1HD1 ILE 51 -18.095 34.152 -25.450 383 HD13 ILE 51 2HD1 ILE 51 -19.173 33.531 -26.724 384 HA PRO 52 HA PRO 52 -25.007 36.790 -24.538 385 HB2 PRO 52 2HB PRO 52 -25.668 35.355 -22.312 386 HB3 PRO 52 3HB PRO 52 -26.071 34.811 -23.972 387 HG2 PRO 52 2HG PRO 52 -23.788 33.946 -22.190 388 HG3 PRO 52 3HG PRO 52 -24.853 32.936 -23.232 389 HD2 PRO 52 2HD PRO 52 -22.310 33.821 -23.940 390 HD3 PRO 52 3HD PRO 52 -23.573 33.448 -25.124 391 H GLY 53 H GLY 53 -25.256 38.344 -22.946 392 HA2 GLY 53 HA2 GLY 53 -23.134 39.676 -21.799 393 HA3 GLY 53 HA3 GLY 53 -24.799 39.788 -21.217 394 H THR 54 H THR 54 -24.869 36.955 -20.269 395 HA THR 54 HA THR 54 -22.676 36.822 -18.337 396 HB THR 54 HB THR 54 -24.298 36.242 -16.473 397 HG1 THR 54 HG1 THR 54 -26.519 36.591 -16.840 398 HG21 THR 54 1HG2 THR 54 -25.279 38.374 -15.974 399 HG22 THR 54 2HG2 THR 54 -23.740 38.679 -16.775 400 HG23 THR 54 3HG2 THR 54 -25.241 38.873 -17.682 401 H TRP 55 H TRP 55 -22.490 34.699 -17.226 402 HA TRP 55 HA TRP 55 -23.822 32.379 -18.402 403 HB2 TRP 55 2HB TRP 55 -22.048 33.088 -20.082 404 HB3 TRP 55 3HB TRP 55 -20.847 32.726 -18.855 405 HD1 TRP 55 HD1 TRP 55 -20.304 30.225 -18.364 406 HE1 TRP 55 HE1 TRP 55 -20.651 28.069 -19.683 407 HE3 TRP 55 HE3 TRP 55 -24.027 31.806 -21.459 408 HZ2 TRP 55 HZ2 TRP 55 -22.462 27.085 -21.727 409 HZ3 TRP 55 HZ3 TRP 55 -25.082 30.233 -23.080 410 HH2 TRP 55 HH2 TRP 55 -24.300 27.878 -23.227 411 H LEU 56 H LEU 56 -23.408 30.412 -17.244 412 HA LEU 56 HA LEU 56 -22.780 30.799 -14.470 413 HB2 LEU 56 2HB LEU 56 -24.263 28.978 -15.957 414 HB3 LEU 56 3HB LEU 56 -22.875 28.021 -15.432 415 HG LEU 56 HG LEU 56 -24.641 29.646 -13.555 416 HD11 LEU 56 1HD1 LEU 56 -25.649 27.486 -12.929 417 HD12 LEU 56 2HD1 LEU 56 -25.927 27.843 -14.641 418 HD13 LEU 56 3HD1 LEU 56 -24.682 26.661 -14.175 419 HD21 LEU 56 3HD2 LEU 56 -23.641 28.196 -11.807 420 HD22 LEU 56 1HD2 LEU 56 -22.580 27.455 -13.030 421 HD23 LEU 56 2HD2 LEU 56 -22.412 29.170 -12.617 422 H CYS 57 H CYS 57 -20.944 30.663 -13.437 423 HA CYS 57 HA CYS 57 -18.467 29.893 -14.855 424 HB2 CYS 57 2HB CYS 57 -19.038 31.376 -12.280 425 HB3 CYS 57 3HB CYS 57 -17.415 30.859 -12.735 426 HG CYS 57 HG CYS 57 -19.496 32.540 -14.670 427 H ARG 58 H ARG 58 -16.812 28.658 -13.676 428 HA ARG 58 HA ARG 58 -17.894 26.064 -13.044 429 HB2 ARG 58 2HB ARG 58 -15.077 27.187 -12.932 430 HB3 ARG 58 3HB ARG 58 -15.453 25.515 -12.638 431 HG2 ARG 58 2HG ARG 58 -14.518 25.902 -14.805 432 HG3 ARG 58 3HG ARG 58 -16.093 25.116 -14.889 433 HD2 ARG 58 2HD ARG 58 -15.617 28.074 -15.467 434 HD3 ARG 58 3HD ARG 58 -15.442 26.835 -16.689 435 HE ARG 58 HE ARG 58 -17.896 28.022 -15.867 436 HH11 ARG 58 1HH1 ARG 58 -16.731 24.937 -17.036 437 HH12 ARG 58 2HH1 ARG 58 -18.297 24.508 -17.666 438 HH21 ARG 58 2HH2 ARG 58 -19.838 27.421 -16.644 439 HH22 ARG 58 1HH2 ARG 58 -20.009 25.868 -17.420 440 H ASN 59 H ASN 59 -17.061 28.722 -11.005 441 HA ASN 59 HA ASN 59 -16.832 27.385 -8.497 442 HB2 ASN 59 2HB ASN 59 -16.176 29.677 -8.858 443 HB3 ASN 59 3HB ASN 59 -17.824 30.144 -9.299 444 HD21 ASN 59 1HD2 ASN 59 -17.823 31.816 -7.716 445 HD22 ASN 59 2HD2 ASN 59 -17.809 31.434 -6.007 446 H GLY 60 H GLY 60 -19.569 27.810 -10.573 447 HA2 GLY 60 HA2 GLY 60 -21.674 26.787 -10.350 448 HA3 GLY 60 HA3 GLY 60 -21.472 26.667 -8.601 449 H MET 61 H MET 61 -20.636 29.775 -9.887 450 HA MET 61 HA MET 61 -23.294 30.890 -9.149 451 HB2 MET 61 2HB MET 61 -21.303 31.432 -7.648 452 HB3 MET 61 3HB MET 61 -20.609 32.315 -8.985 453 HG2 MET 61 2HG MET 61 -21.805 33.792 -7.418 454 HG3 MET 61 3HG MET 61 -22.478 33.868 -9.044 455 HE1 MET 61 3HE MET 61 -25.671 34.556 -6.931 456 HE2 MET 61 1HE MET 61 -24.035 35.094 -6.508 457 HE3 MET 61 2HE MET 61 -24.574 35.130 -8.207 458 H GLU 62 H GLU 62 -24.168 32.527 -10.430 459 HA GLU 62 HA GLU 62 -23.578 32.465 -13.266 460 HB2 GLU 62 2HB GLU 62 -25.375 34.263 -11.601 461 HB3 GLU 62 3HB GLU 62 -25.251 34.316 -13.367 462 HG2 GLU 62 2HG GLU 62 -25.949 31.938 -13.496 463 HG3 GLU 62 3HG GLU 62 -26.114 31.883 -11.741 464 H GLY 63 H GLY 63 -21.811 33.322 -14.107 465 HA2 GLY 63 HA2 GLY 63 -20.459 35.634 -12.906 466 HA3 GLY 63 HA3 GLY 63 -19.848 34.651 -14.217 467 H THR 64 H THR 64 -20.124 37.605 -13.977 468 HA THR 64 HA THR 64 -21.778 38.086 -16.421 469 HB THR 64 HB THR 64 -20.631 40.109 -14.464 470 HG1 THR 64 HG1 THR 64 -22.339 38.927 -13.584 471 HG21 THR 64 1HG2 THR 64 -22.461 40.451 -16.888 472 HG22 THR 64 2HG2 THR 64 -22.302 41.667 -15.600 473 HG23 THR 64 3HG2 THR 64 -20.898 41.231 -16.578 474 H LEU 65 H LEU 65 -20.946 38.934 -18.259 475 HA LEU 65 HA LEU 65 -18.356 38.178 -18.970 476 HB2 LEU 65 2HB LEU 65 -20.384 38.388 -20.386 477 HB3 LEU 65 3HB LEU 65 -20.277 40.138 -20.277 478 HG LEU 65 HG LEU 65 -17.939 39.855 -21.427 479 HD11 LEU 65 1HD1 LEU 65 -19.065 37.109 -21.968 480 HD12 LEU 65 2HD1 LEU 65 -17.618 37.854 -22.713 481 HD13 LEU 65 3HD1 LEU 65 -17.645 37.474 -20.993 482 HD21 LEU 65 3HD2 LEU 65 -20.457 38.979 -22.911 483 HD22 LEU 65 1HD2 LEU 65 -19.956 40.660 -22.617 484 HD23 LEU 65 2HD2 LEU 65 -18.973 39.616 -23.657 485 H ILE 66 H ILE 66 -16.414 39.024 -18.585 486 HA ILE 66 HA ILE 66 -15.987 41.956 -18.671 487 HB ILE 66 HB ILE 66 -14.460 41.973 -16.876 488 HG12 ILE 66 2HG1 ILE 66 -13.330 39.882 -16.906 489 HG13 ILE 66 3HG1 ILE 66 -14.064 40.059 -15.319 490 HG21 ILE 66 1HG2 ILE 66 -16.948 40.577 -15.858 491 HG22 ILE 66 2HG2 ILE 66 -15.862 41.635 -14.943 492 HG23 ILE 66 3HG2 ILE 66 -16.817 42.294 -16.286 493 HD11 ILE 66 3HD1 ILE 66 -14.904 38.271 -17.519 494 HD12 ILE 66 1HD1 ILE 66 -14.311 37.824 -15.920 495 HD13 ILE 66 2HD1 ILE 66 -15.919 38.577 -16.100 496 H GLU 67 H GLU 67 -13.868 42.595 -19.343 497 HA GLU 67 HA GLU 67 -11.982 40.505 -20.225 498 HB2 GLU 67 2HB GLU 67 -13.210 42.625 -22.032 499 HB3 GLU 67 3HB GLU 67 -11.660 41.884 -22.375 500 HG2 GLU 67 2HG GLU 67 -14.322 40.409 -22.155 501 HG3 GLU 67 3HG GLU 67 -13.485 40.835 -23.636 502 H GLY 68 H GLY 68 -9.923 41.044 -19.864 503 HA2 GLY 68 HA2 GLY 68 -8.642 43.485 -20.087 504 HA3 GLY 68 HA3 GLY 68 -9.300 43.535 -18.453 505 H ASP 69 H ASP 69 -8.373 40.300 -19.213 506 HA ASP 69 HA ASP 69 -5.585 40.545 -18.463 507 HB2 ASP 69 2HB ASP 69 -6.591 40.668 -16.252 508 HB3 ASP 69 3HB ASP 69 -7.639 39.299 -16.596 509 H LEU 70 H LEU 70 -4.476 38.809 -19.013 510 HA LEU 70 HA LEU 70 -4.816 37.451 -21.300 511 HB2 LEU 70 2HB LEU 70 -3.181 37.008 -18.809 512 HB3 LEU 70 3HB LEU 70 -3.119 35.808 -20.068 513 HG LEU 70 HG LEU 70 -2.306 37.404 -21.705 514 HD11 LEU 70 1HD1 LEU 70 -1.645 39.707 -21.068 515 HD12 LEU 70 2HD1 LEU 70 -3.394 39.492 -21.029 516 HD13 LEU 70 3HD1 LEU 70 -2.463 39.509 -19.506 517 HD21 LEU 70 3HD2 LEU 70 -0.676 36.296 -20.168 518 HD22 LEU 70 1HD2 LEU 70 -0.118 37.883 -20.717 519 HD23 LEU 70 2HD2 LEU 70 -0.783 37.693 -19.080 520 HA PRO 71 HA PRO 71 -7.685 34.087 -20.121 521 HB2 PRO 71 2HB PRO 71 -8.305 34.083 -23.055 522 HB3 PRO 71 3HB PRO 71 -9.411 34.160 -21.654 523 HG2 PRO 71 2HG PRO 71 -8.911 36.341 -23.203 524 HG3 PRO 71 3HG PRO 71 -9.041 36.503 -21.418 525 HD2 PRO 71 2HD PRO 71 -6.508 36.170 -23.076 526 HD3 PRO 71 3HD PRO 71 -6.900 37.444 -21.889 527 H GLU 72 H GLU 72 -5.191 33.342 -19.962 528 HA GLU 72 HA GLU 72 -3.280 32.402 -20.610 529 HB2 GLU 72 2HB GLU 72 -5.328 30.408 -21.413 530 HB3 GLU 72 3HB GLU 72 -3.613 30.100 -21.801 531 HG2 GLU 72 2HG GLU 72 -3.073 30.468 -19.378 532 HG3 GLU 72 3HG GLU 72 -4.801 30.603 -19.041 533 HA PRO 73 HA PRO 73 -3.180 35.839 -23.369 534 HB2 PRO 73 2HB PRO 73 -1.918 33.742 -25.146 535 HB3 PRO 73 3HB PRO 73 -1.618 35.516 -25.144 536 HG2 PRO 73 2HG PRO 73 -0.222 33.673 -23.553 537 HG3 PRO 73 3HG PRO 73 -0.421 35.403 -23.133 538 HD2 PRO 73 2HD PRO 73 -1.465 33.210 -21.657 539 HD3 PRO 73 3HD PRO 73 -1.869 34.928 -21.455 540 H LYS 74 H LYS 74 -3.811 36.626 -25.523 541 HA LYS 74 HA LYS 74 -6.638 36.156 -25.667 542 HB2 LYS 74 2HB LYS 74 -6.726 37.940 -27.269 543 HB3 LYS 74 3HB LYS 74 -5.663 38.386 -25.937 544 HG2 LYS 74 2HG LYS 74 -3.675 37.952 -27.333 545 HG3 LYS 74 3HG LYS 74 -4.705 37.380 -28.668 546 HD2 LYS 74 2HD LYS 74 -5.735 39.550 -28.909 547 HD3 LYS 74 3HD LYS 74 -4.888 40.170 -27.476 548 HE2 LYS 74 2HE LYS 74 -2.751 40.025 -28.546 549 HE3 LYS 74 3HE LYS 74 -3.414 39.162 -29.942 550 HZ1 LYS 74 HZ1 LYS 74 -4.446 41.843 -29.235 551 HZ2 LYS 74 HZ2 LYS 74 -3.065 41.701 -30.134 552 HZ3 LYS 74 HZ3 LYS 74 -4.482 41.101 -30.679 553 H LYS 75 H LYS 75 -7.944 35.575 -27.313 554 HA LYS 75 HA LYS 75 -6.831 33.983 -29.596 555 HB2 LYS 75 2HB LYS 75 -9.350 33.512 -27.944 556 HB3 LYS 75 3HB LYS 75 -9.135 32.869 -29.565 557 HG2 LYS 75 2HG LYS 75 -8.586 31.129 -28.076 558 HG3 LYS 75 3HG LYS 75 -7.084 31.651 -28.833 559 HD2 LYS 75 2HD LYS 75 -6.352 32.745 -26.816 560 HD3 LYS 75 3HD LYS 75 -7.952 32.597 -26.061 561 HE2 LYS 75 2HE LYS 75 -7.682 30.133 -26.033 562 HE3 LYS 75 3HE LYS 75 -6.116 30.288 -26.841 563 HZ1 LYS 75 HZ1 LYS 75 -5.868 30.061 -24.424 564 HZ2 LYS 75 HZ2 LYS 75 -5.292 31.511 -24.888 565 HZ3 LYS 75 HZ3 LYS 75 -6.721 31.428 -24.146 566 H VAL 76 H VAL 76 -7.796 34.341 -31.590 567 HA VAL 76 HA VAL 76 -8.646 37.072 -32.038 568 HB VAL 76 HB VAL 76 -8.664 36.507 -34.411 569 HG11 VAL 76 1HG1 VAL 76 -6.212 35.357 -33.020 570 HG12 VAL 76 2HG1 VAL 76 -6.309 36.004 -34.668 571 HG13 VAL 76 3HG1 VAL 76 -6.540 37.085 -33.284 572 HG21 VAL 76 3HG2 VAL 76 -8.005 34.296 -35.232 573 HG22 VAL 76 1HG2 VAL 76 -8.017 33.643 -33.583 574 HG23 VAL 76 2HG2 VAL 76 -9.528 34.189 -34.342 575 H LYS 77 H LYS 77 -10.438 37.733 -33.354 576 HA LYS 77 HA LYS 77 -12.676 38.077 -33.718 577 HB2 LYS 77 2HB LYS 77 -12.418 35.173 -34.523 578 HB3 LYS 77 3HB LYS 77 -13.736 36.259 -34.983 579 HG2 LYS 77 2HG LYS 77 -12.064 37.798 -36.046 580 HG3 LYS 77 3HG LYS 77 -10.795 36.612 -35.718 581 HD2 LYS 77 2HD LYS 77 -13.269 36.127 -37.434 582 HD3 LYS 77 3HD LYS 77 -11.651 36.506 -38.039 583 HE2 LYS 77 2HE LYS 77 -10.765 34.437 -36.970 584 HE3 LYS 77 3HE LYS 77 -12.393 34.038 -36.404 585 HZ1 LYS 77 HZ1 LYS 77 -11.603 34.296 -39.258 586 HZ2 LYS 77 HZ2 LYS 77 -11.876 32.889 -38.480 587 HZ3 LYS 77 HZ3 LYS 77 -13.106 33.930 -38.733 588 HA PRO 78 HA PRO 78 -13.384 39.460 -32.245 589 HB2 PRO 78 2HB PRO 78 -13.708 39.726 -29.281 590 HB3 PRO 78 3HB PRO 78 -14.387 40.731 -30.596 591 HG2 PRO 78 2HG PRO 78 -15.950 38.951 -29.270 592 HG3 PRO 78 3HG PRO 78 -16.087 39.118 -31.054 593 HD2 PRO 78 2HD PRO 78 -14.490 37.057 -29.486 594 HD3 PRO 78 3HD PRO 78 -15.656 36.804 -30.819 595 HA PRO 79 HA PRO 79 -9.048 39.293 -30.833 596 HB2 PRO 79 2HB PRO 79 -8.166 41.729 -31.650 597 HB3 PRO 79 3HB PRO 79 -8.636 40.458 -32.818 598 HG2 PRO 79 2HG PRO 79 -10.341 42.762 -31.799 599 HG3 PRO 79 3HG PRO 79 -10.025 42.294 -33.503 600 HD2 PRO 79 2HD PRO 79 -12.252 41.472 -32.157 601 HD3 PRO 79 3HD PRO 79 -11.434 40.414 -33.346 602 H ARG 80 H ARG 80 -7.531 40.927 -29.536 603 HA ARG 80 HA ARG 80 -8.977 42.496 -27.506 604 HB2 ARG 80 2HB ARG 80 -8.385 39.872 -26.858 605 HB3 ARG 80 3HB ARG 80 -6.907 40.679 -26.359 606 HG2 ARG 80 2HG ARG 80 -8.291 40.681 -24.436 607 HG3 ARG 80 3HG ARG 80 -8.364 42.325 -25.062 608 HD2 ARG 80 2HD ARG 80 -10.584 41.880 -24.561 609 HD3 ARG 80 3HD ARG 80 -10.555 41.549 -26.284 610 HE ARG 80 HE ARG 80 -10.739 39.605 -24.028 611 HH11 ARG 80 2HH2 ARG 80 -10.774 39.932 -27.528 612 HH12 ARG 80 1HH2 ARG 80 -11.343 38.310 -27.758 613 HH21 ARG 80 2HH1 ARG 80 -11.865 37.785 -24.368 614 HH22 ARG 80 1HH1 ARG 80 -11.938 37.082 -25.955 Start of MODEL 14 1 H1 SER 1 1H SER 1 6.376 25.658 -26.034 2 H2 SER 1 2H SER 1 7.758 24.785 -25.874 3 H3 SER 1 3H SER 1 6.670 24.394 -27.036 4 HA SER 1 HA SER 1 8.193 26.906 -26.915 5 HB2 SER 1 2HB SER 1 8.612 24.533 -28.774 6 HB3 SER 1 3HB SER 1 9.520 26.060 -28.779 7 HG SER 1 HG SER 1 10.607 24.421 -27.598 8 H MET 2 H MET 2 7.989 28.259 -28.755 9 HA MET 2 HA MET 2 6.827 29.532 -30.183 10 HB2 MET 2 2HB MET 2 7.511 27.695 -31.681 11 HB3 MET 2 3HB MET 2 5.944 26.918 -31.441 12 HG2 MET 2 2HG MET 2 4.835 28.980 -32.352 13 HG3 MET 2 3HG MET 2 6.438 29.672 -32.633 14 HE1 MET 2 3HE MET 2 4.267 29.562 -34.886 15 HE2 MET 2 1HE MET 2 5.915 30.186 -35.115 16 HE3 MET 2 2HE MET 2 5.241 29.010 -36.266 17 H ALA 3 H ALA 3 5.455 30.561 -28.766 18 HA ALA 3 HA ALA 3 2.673 29.624 -28.433 19 HB1 ALA 3 3HB ALA 3 4.081 32.178 -27.545 20 HB2 ALA 3 1HB ALA 3 2.456 31.649 -27.060 21 HB3 ALA 3 2HB ALA 3 3.875 30.703 -26.569 22 H ASP 4 H ASP 4 4.463 31.650 -30.625 23 HA ASP 4 HA ASP 4 2.209 33.203 -31.616 24 HB2 ASP 4 2HB ASP 4 3.890 34.185 -33.095 25 HB3 ASP 4 3HB ASP 4 4.387 34.214 -31.410 26 H ARG 5 H ARG 5 1.309 30.789 -31.856 27 HA ARG 5 HA ARG 5 2.031 29.335 -34.266 28 HB2 ARG 5 2HB ARG 5 -0.341 28.885 -32.435 29 HB3 ARG 5 3HB ARG 5 0.400 27.724 -33.552 30 HG2 ARG 5 2HG ARG 5 2.539 27.906 -32.184 31 HG3 ARG 5 3HG ARG 5 1.633 28.886 -31.024 32 HD2 ARG 5 2HD ARG 5 1.486 26.829 -30.030 33 HD3 ARG 5 3HD ARG 5 -0.032 26.900 -30.914 34 HE ARG 5 HE ARG 5 0.707 25.179 -32.322 35 HH11 ARG 5 1HH2 ARG 5 3.496 26.294 -30.476 36 HH12 ARG 5 2HH2 ARG 5 4.396 24.845 -30.806 37 HH21 ARG 5 1HH1 ARG 5 1.974 23.413 -32.797 38 HH22 ARG 5 2HH1 ARG 5 3.587 23.298 -32.156 39 H VAL 6 H VAL 6 1.099 31.957 -34.821 40 HA VAL 6 HA VAL 6 -1.572 31.855 -35.980 41 HB VAL 6 HB VAL 6 -1.156 34.179 -36.636 42 HG11 VAL 6 1HG1 VAL 6 -0.379 33.661 -33.737 43 HG12 VAL 6 2HG1 VAL 6 -1.086 35.144 -34.408 44 HG13 VAL 6 3HG1 VAL 6 -2.034 33.648 -34.385 45 HG21 VAL 6 3HG2 VAL 6 0.842 35.394 -35.940 46 HG22 VAL 6 1HG2 VAL 6 1.585 33.911 -35.322 47 HG23 VAL 6 2HG2 VAL 6 1.290 34.105 -37.064 48 H LEU 7 H LEU 7 -2.017 32.453 -38.083 49 HA LEU 7 HA LEU 7 -0.784 30.851 -40.110 50 HB2 LEU 7 2HB LEU 7 -2.743 33.173 -40.334 51 HB3 LEU 7 3HB LEU 7 -2.316 32.103 -41.663 52 HG LEU 7 HG LEU 7 -3.708 31.223 -39.095 53 HD11 LEU 7 1HD1 LEU 7 -4.786 31.600 -41.921 54 HD12 LEU 7 2HD1 LEU 7 -5.692 30.984 -40.518 55 HD13 LEU 7 3HD1 LEU 7 -5.114 32.657 -40.530 56 HD21 LEU 7 3HD2 LEU 7 -4.147 29.119 -40.338 57 HD22 LEU 7 1HD2 LEU 7 -3.123 29.694 -41.674 58 HD23 LEU 7 2HD2 LEU 7 -2.423 29.363 -40.071 59 H ARG 8 H ARG 8 0.294 31.398 -41.978 60 HA ARG 8 HA ARG 8 1.818 33.956 -42.139 61 HB2 ARG 8 2HB ARG 8 2.949 31.146 -41.797 62 HB3 ARG 8 3HB ARG 8 3.897 32.463 -42.492 63 HG2 ARG 8 2HG ARG 8 3.837 33.744 -40.478 64 HG3 ARG 8 3HG ARG 8 2.634 32.684 -39.725 65 HD2 ARG 8 2HD ARG 8 4.162 30.862 -39.534 66 HD3 ARG 8 3HD ARG 8 5.326 31.636 -40.610 67 HE ARG 8 HE ARG 8 6.157 32.899 -38.898 68 HH11 ARG 8 1HH2 ARG 8 3.110 31.626 -37.609 69 HH12 ARG 8 2HH2 ARG 8 3.623 31.969 -35.969 70 HH21 ARG 8 1HH1 ARG 8 6.649 33.312 -36.838 71 HH22 ARG 8 2HH1 ARG 8 5.591 32.867 -35.536 72 H GLY 9 H GLY 9 2.558 34.445 -44.182 73 HA2 GLY 9 HA2 GLY 9 2.800 34.401 -46.478 74 HA3 GLY 9 HA3 GLY 9 2.436 32.677 -46.469 75 H SER 10 H SER 10 -0.139 32.523 -45.568 76 HA SER 10 HA SER 10 -1.809 33.184 -47.753 77 HB2 SER 10 2HB SER 10 -3.639 32.554 -46.161 78 HB3 SER 10 3HB SER 10 -2.300 31.390 -46.219 79 HG SER 10 HG SER 10 -2.882 31.830 -44.069 80 H ARG 11 H ARG 11 -1.104 35.003 -44.854 81 HA ARG 11 HA ARG 11 -3.197 36.979 -44.998 82 HB2 ARG 11 2HB ARG 11 -0.493 36.885 -43.602 83 HB3 ARG 11 3HB ARG 11 -1.666 38.180 -43.347 84 HG2 ARG 11 2HG ARG 11 -3.248 36.755 -42.304 85 HG3 ARG 11 3HG ARG 11 -2.498 35.287 -42.936 86 HD2 ARG 11 2HD ARG 11 -1.984 35.439 -40.601 87 HD3 ARG 11 3HD ARG 11 -0.510 35.652 -41.565 88 HE ARG 11 HE ARG 11 -1.730 38.190 -40.853 89 HH11 ARG 11 2HH2 ARG 11 0.326 35.659 -39.536 90 HH12 ARG 11 1HH2 ARG 11 1.104 36.761 -38.423 91 HH21 ARG 11 1HH1 ARG 11 -0.699 39.521 -39.395 92 HH22 ARG 11 2HH1 ARG 11 0.518 38.878 -38.334 93 H LEU 12 H LEU 12 -0.413 36.684 -46.970 94 HA LEU 12 HA LEU 12 0.050 39.478 -47.542 95 HB2 LEU 12 2HB LEU 12 1.576 37.511 -47.881 96 HB3 LEU 12 3HB LEU 12 0.621 37.028 -49.273 97 HG LEU 12 HG LEU 12 1.915 39.786 -49.080 98 HD11 LEU 12 1HD1 LEU 12 3.159 37.221 -50.165 99 HD12 LEU 12 2HD1 LEU 12 3.849 38.856 -50.301 100 HD13 LEU 12 3HD1 LEU 12 3.676 38.104 -48.710 101 HD21 LEU 12 3HD2 LEU 12 0.342 39.538 -50.961 102 HD22 LEU 12 1HD2 LEU 12 1.987 39.572 -51.570 103 HD23 LEU 12 2HD2 LEU 12 1.131 38.021 -51.452 104 H GLY 13 H GLY 13 -2.136 37.022 -48.899 105 HA2 GLY 13 HA2 GLY 13 -4.207 37.269 -49.805 106 HA3 GLY 13 HA3 GLY 13 -4.111 38.985 -49.418 107 H ALA 14 H ALA 14 -1.637 38.040 -51.621 108 HA ALA 14 HA ALA 14 -2.700 39.630 -53.757 109 HB1 ALA 14 3HB ALA 14 -0.682 38.845 -54.969 110 HB2 ALA 14 1HB ALA 14 -0.305 39.393 -53.333 111 HB3 ALA 14 2HB ALA 14 -0.384 37.649 -53.690 112 H VAL 15 H VAL 15 -2.756 38.811 -56.058 113 HA VAL 15 HA VAL 15 -4.299 36.277 -56.321 114 HB VAL 15 HB VAL 15 -5.538 37.336 -58.156 115 HG11 VAL 15 1HG1 VAL 15 -7.055 38.649 -56.782 116 HG12 VAL 15 2HG1 VAL 15 -6.475 37.259 -55.856 117 HG13 VAL 15 3HG1 VAL 15 -5.807 38.873 -55.541 118 HG21 VAL 15 3HG2 VAL 15 -5.612 39.762 -58.436 119 HG22 VAL 15 1HG2 VAL 15 -4.314 39.976 -57.248 120 HG23 VAL 15 2HG2 VAL 15 -3.992 39.160 -58.796 121 H SER 16 H SER 16 -2.443 35.400 -59.287 122 HA SER 16 HA SER 16 -5.110 35.042 -58.227 123 HB2 SER 16 2HB SER 16 -3.260 33.121 -59.680 124 HB3 SER 16 3HB SER 16 -4.994 32.879 -59.386 125 HG SER 16 HG SER 16 -4.570 33.758 -61.473 126 H TYR 17 H TYR 17 -5.825 33.112 -57.080 127 HA TYR 17 HA TYR 17 -3.954 31.814 -55.213 128 HB2 TYR 17 2HB TYR 17 -5.080 32.481 -53.244 129 HB3 TYR 17 3HB TYR 17 -4.692 33.944 -54.115 130 HD1 TYR 17 HD2 TYR 17 -6.630 34.943 -55.645 131 HD2 TYR 17 HD1 TYR 17 -7.244 32.168 -52.403 132 HE1 TYR 17 HE2 TYR 17 -9.017 35.637 -55.504 133 HE2 TYR 17 HE1 TYR 17 -9.649 32.847 -52.286 134 HH TYR 17 HH TYR 17 -11.296 34.180 -53.154 135 H GLU 18 H GLU 18 -5.076 30.087 -53.934 136 HA GLU 18 HA GLU 18 -7.205 28.734 -55.567 137 HB2 GLU 18 2HB GLU 18 -4.737 27.511 -54.278 138 HB3 GLU 18 3HB GLU 18 -6.054 26.614 -55.051 139 HG2 GLU 18 3HG GLU 18 -5.595 27.820 -57.192 140 HG3 GLU 18 2HG GLU 18 -4.205 28.602 -56.435 141 H THR 19 H THR 19 -8.162 30.267 -53.729 142 HA THR 19 HA THR 19 -9.325 30.594 -51.850 143 HB THR 19 HB THR 19 -10.621 28.908 -50.802 144 HG1 THR 19 HG1 THR 19 -8.781 27.191 -52.014 145 HG21 THR 19 1HG2 THR 19 -11.325 29.669 -53.053 146 HG22 THR 19 2HG2 THR 19 -10.462 28.294 -53.779 147 HG23 THR 19 3HG2 THR 19 -11.836 28.012 -52.691 148 H ASP 20 H ASP 20 -6.283 29.621 -51.620 149 HA ASP 20 HA ASP 20 -6.099 28.855 -48.852 150 HB2 ASP 20 2HB ASP 20 -3.751 28.601 -49.320 151 HB3 ASP 20 3HB ASP 20 -4.708 27.894 -50.608 152 H ARG 21 H ARG 21 -7.207 31.524 -49.259 153 HA ARG 21 HA ARG 21 -5.332 33.149 -47.583 154 HB2 ARG 21 2HB ARG 21 -6.699 35.074 -48.069 155 HB3 ARG 21 3HB ARG 21 -6.103 34.320 -49.543 156 HG2 ARG 21 2HG ARG 21 -8.323 33.312 -49.974 157 HG3 ARG 21 3HG ARG 21 -8.919 33.937 -48.429 158 HD2 ARG 21 2HD ARG 21 -9.707 35.405 -50.142 159 HD3 ARG 21 3HD ARG 21 -8.479 36.265 -49.217 160 HE ARG 21 HE ARG 21 -7.969 34.927 -51.874 161 HH11 ARG 21 1HH1 ARG 21 -7.526 37.821 -49.908 162 HH12 ARG 21 2HH1 ARG 21 -6.396 38.489 -51.073 163 HH21 ARG 21 1HH2 ARG 21 -6.525 35.889 -53.244 164 HH22 ARG 21 2HH2 ARG 21 -5.810 37.421 -52.807 165 H ASN 22 H ASN 22 -7.793 30.968 -47.181 166 HA ASN 22 HA ASN 22 -8.240 31.854 -44.386 167 HB2 ASN 22 2HB ASN 22 -10.208 32.529 -45.822 168 HB3 ASN 22 3HB ASN 22 -10.433 30.830 -46.243 169 HD21 ASN 22 2HD2 ASN 22 -12.631 31.241 -45.311 170 HD22 ASN 22 1HD2 ASN 22 -12.807 31.115 -43.565 171 H HIS 23 H HIS 23 -8.310 30.157 -42.910 172 HA HIS 23 HA HIS 23 -7.757 27.389 -43.866 173 HB2 HIS 23 2HB HIS 23 -5.876 29.114 -42.210 174 HB3 HIS 23 3HB HIS 23 -5.719 27.369 -42.376 175 HD2 HIS 23 HD2 HIS 23 -5.249 30.617 -44.391 176 HE1 HIS 23 HE1 HIS 23 -3.779 27.450 -46.843 177 HE2 HIS 23 HE2 HIS 23 -4.035 29.973 -46.649 178 H ASP 24 H ASP 24 -7.629 25.827 -42.169 179 HA ASP 24 HA ASP 24 -8.614 24.592 -40.586 180 HB2 ASP 24 2HB ASP 24 -8.716 27.117 -38.909 181 HB3 ASP 24 3HB ASP 24 -8.996 25.489 -38.331 182 H LEU 25 H LEU 25 -10.538 24.272 -39.121 183 HA LEU 25 HA LEU 25 -13.039 25.443 -40.212 184 HB2 LEU 25 2HB LEU 25 -12.427 22.491 -39.786 185 HB3 LEU 25 3HB LEU 25 -14.041 23.128 -40.069 186 HG LEU 25 HG LEU 25 -11.738 23.345 -42.059 187 HD11 LEU 25 1HD1 LEU 25 -12.947 21.614 -43.314 188 HD12 LEU 25 2HD1 LEU 25 -12.472 21.018 -41.717 189 HD13 LEU 25 3HD1 LEU 25 -14.158 21.495 -42.017 190 HD21 LEU 25 3HD2 LEU 25 -13.536 23.932 -43.672 191 HD22 LEU 25 1HD2 LEU 25 -14.722 23.940 -42.346 192 HD23 LEU 25 2HD2 LEU 25 -13.406 25.136 -42.390 193 H ALA 26 H ALA 26 -14.786 25.373 -38.821 194 HA ALA 26 HA ALA 26 -15.832 25.875 -36.881 195 HB1 ALA 26 3HB ALA 26 -15.949 24.025 -35.292 196 HB2 ALA 26 1HB ALA 26 -15.997 23.445 -36.968 197 HB3 ALA 26 2HB ALA 26 -14.504 23.287 -36.017 198 HA PRO 27 HA PRO 27 -12.277 27.970 -34.724 199 HB2 PRO 27 2HB PRO 27 -14.020 30.361 -35.240 200 HB3 PRO 27 3HB PRO 27 -12.242 30.203 -35.378 201 HG2 PRO 27 2HG PRO 27 -13.788 30.252 -37.602 202 HG3 PRO 27 3HG PRO 27 -12.434 29.077 -37.482 203 HD2 PRO 27 2HD PRO 27 -15.369 28.609 -36.856 204 HD3 PRO 27 3HD PRO 27 -14.290 27.671 -37.931 205 H ARG 28 H ARG 28 -12.433 29.492 -32.822 206 HA ARG 28 HA ARG 28 -14.920 29.308 -31.234 207 HB2 ARG 28 2HB ARG 28 -13.908 28.260 -29.354 208 HB3 ARG 28 3HB ARG 28 -13.561 27.280 -30.780 209 HG2 ARG 28 2HG ARG 28 -11.265 28.272 -30.884 210 HG3 ARG 28 3HG ARG 28 -11.629 29.195 -29.409 211 HD2 ARG 28 2HD ARG 28 -12.028 27.085 -28.184 212 HD3 ARG 28 3HD ARG 28 -11.656 26.159 -29.655 213 HE ARG 28 HE ARG 28 -9.447 27.841 -29.197 214 HH11 ARG 28 1HH1 ARG 28 -10.929 25.143 -27.523 215 HH12 ARG 28 2HH1 ARG 28 -9.436 24.685 -26.752 216 HH21 ARG 28 2HH2 ARG 28 -7.576 27.197 -28.186 217 HH22 ARG 28 1HH2 ARG 28 -7.590 25.818 -27.127 218 H GLN 29 H GLN 29 -14.820 30.429 -29.200 219 HA GLN 29 HA GLN 29 -13.281 32.987 -29.175 220 HB2 GLN 29 2HB GLN 29 -16.270 32.718 -28.661 221 HB3 GLN 29 3HB GLN 29 -15.326 34.200 -28.636 222 HG2 GLN 29 2HG GLN 29 -15.742 34.547 -30.816 223 HG3 GLN 29 3HG GLN 29 -15.033 32.991 -31.250 224 HE21 GLN 29 1HE2 GLN 29 -16.681 31.124 -30.179 225 HE22 GLN 29 2HE2 GLN 29 -18.276 31.262 -30.920 226 H ILE 30 H ILE 30 -12.183 32.782 -27.305 227 HA ILE 30 HA ILE 30 -13.379 31.460 -24.939 228 HB ILE 30 HB ILE 30 -10.658 32.777 -24.985 229 HG12 ILE 30 2HG1 ILE 30 -10.528 31.269 -26.842 230 HG13 ILE 30 3HG1 ILE 30 -9.633 30.625 -25.478 231 HG21 ILE 30 1HG2 ILE 30 -10.263 31.135 -23.155 232 HG22 ILE 30 2HG2 ILE 30 -11.613 32.218 -22.791 233 HG23 ILE 30 3HG2 ILE 30 -11.938 30.561 -23.312 234 HD11 ILE 30 3HD1 ILE 30 -10.826 28.863 -26.666 235 HD12 ILE 30 1HD1 ILE 30 -11.449 29.021 -25.022 236 HD13 ILE 30 2HD1 ILE 30 -12.377 29.674 -26.401 237 H ALA 31 H ALA 31 -14.922 32.732 -24.013 238 HA ALA 31 HA ALA 31 -14.314 35.592 -23.416 239 HB1 ALA 31 3HB ALA 31 -16.873 33.951 -23.255 240 HB2 ALA 31 1HB ALA 31 -16.706 35.636 -22.730 241 HB3 ALA 31 2HB ALA 31 -16.467 35.227 -24.434 242 H ARG 32 H ARG 32 -14.903 36.311 -21.211 243 HA ARG 32 HA ARG 32 -14.343 34.309 -19.060 244 HB2 ARG 32 2HB ARG 32 -12.887 36.877 -19.716 245 HB3 ARG 32 3HB ARG 32 -13.039 36.376 -18.038 246 HG2 ARG 32 2HG ARG 32 -11.600 34.691 -18.180 247 HG3 ARG 32 3HG ARG 32 -12.148 34.144 -19.767 248 HD2 ARG 32 2HD ARG 32 -10.556 36.688 -19.445 249 HD3 ARG 32 3HD ARG 32 -9.772 35.094 -19.582 250 HE ARG 32 HE ARG 32 -11.690 35.383 -21.692 251 HH11 ARG 32 2HH2 ARG 32 -8.473 36.497 -20.886 252 HH12 ARG 32 1HH2 ARG 32 -8.104 36.878 -22.546 253 HH21 ARG 32 2HH1 ARG 32 -11.050 35.631 -23.818 254 HH22 ARG 32 1HH1 ARG 32 -9.488 36.332 -24.147 255 H TYR 33 H TYR 33 -15.185 34.715 -17.108 256 HA TYR 33 HA TYR 33 -17.199 36.903 -16.911 257 HB2 TYR 33 2HB TYR 33 -17.794 33.974 -16.486 258 HB3 TYR 33 3HB TYR 33 -18.862 35.295 -16.098 259 HD1 TYR 33 HD1 TYR 33 -17.177 33.533 -18.927 260 HD2 TYR 33 HD2 TYR 33 -20.269 36.254 -17.710 261 HE1 TYR 33 HE1 TYR 33 -18.237 33.353 -21.182 262 HE2 TYR 33 HE2 TYR 33 -21.315 36.087 -19.974 263 HH TYR 33 HH TYR 33 -21.286 35.080 -21.958 264 H ARG 34 H ARG 34 -17.430 37.777 -14.967 265 HA ARG 34 HA ARG 34 -15.898 36.662 -12.658 266 HB2 ARG 34 2HB ARG 34 -15.410 38.988 -13.484 267 HB3 ARG 34 3HB ARG 34 -17.018 39.484 -12.956 268 HG2 ARG 34 2HG ARG 34 -16.466 39.036 -10.641 269 HG3 ARG 34 3HG ARG 34 -15.052 38.090 -11.104 270 HD2 ARG 34 2HD ARG 34 -14.246 40.383 -12.197 271 HD3 ARG 34 3HD ARG 34 -15.399 41.079 -11.043 272 HE ARG 34 HE ARG 34 -13.514 39.096 -9.931 273 HH11 ARG 34 1HH2 ARG 34 -13.833 42.536 -10.551 274 HH12 ARG 34 2HH2 ARG 34 -12.610 42.932 -9.375 275 HH21 ARG 34 2HH1 ARG 34 -12.011 39.647 -8.501 276 HH22 ARG 34 1HH1 ARG 34 -11.596 41.321 -8.231 277 H THR 35 H THR 35 -16.850 35.839 -10.954 278 HA THR 35 HA THR 35 -19.764 35.579 -10.821 279 HB THR 35 HB THR 35 -19.397 34.135 -8.897 280 HG1 THR 35 HG1 THR 35 -16.670 34.554 -9.300 281 HG21 THR 35 1HG2 THR 35 -19.247 33.083 -11.034 282 HG22 THR 35 2HG2 THR 35 -17.530 33.506 -11.198 283 HG23 THR 35 3HG2 THR 35 -18.047 32.392 -9.916 284 H ASP 36 H ASP 36 -20.658 35.665 -8.419 285 HA ASP 36 HA ASP 36 -20.599 38.442 -7.744 286 HB2 ASP 36 2HB ASP 36 -22.626 36.945 -7.700 287 HB3 ASP 36 3HB ASP 36 -21.951 36.122 -6.294 288 H ASN 37 H ASN 37 -18.621 35.830 -6.577 289 HA ASN 37 HA ASN 37 -17.916 37.384 -4.135 290 HB2 ASN 37 2HB ASN 37 -16.473 34.923 -4.934 291 HB3 ASN 37 3HB ASN 37 -16.695 35.622 -3.368 292 HD21 ASN 37 1HD2 ASN 37 -17.128 32.934 -4.474 293 HD22 ASN 37 2HD2 ASN 37 -18.766 32.515 -3.917 294 H GLY 38 H GLY 38 -17.238 37.800 -7.303 295 HA2 GLY 38 HA2 GLY 38 -15.563 39.022 -8.367 296 HA3 GLY 38 HA3 GLY 38 -14.501 38.871 -6.964 297 H GLU 39 H GLU 39 -15.724 35.800 -7.739 298 HA GLU 39 HA GLU 39 -13.041 34.950 -8.502 299 HB2 GLU 39 2HB GLU 39 -15.438 33.132 -8.688 300 HB3 GLU 39 3HB GLU 39 -13.781 32.758 -8.309 301 HG2 GLU 39 2HG GLU 39 -14.385 34.375 -6.187 302 HG3 GLU 39 3HG GLU 39 -16.018 33.854 -6.658 303 H GLU 40 H GLU 40 -12.283 35.118 -10.525 304 HA GLU 40 HA GLU 40 -14.135 35.294 -12.836 305 HB2 GLU 40 2HB GLU 40 -11.179 35.901 -12.505 306 HB3 GLU 40 3HB GLU 40 -12.059 36.031 -14.036 307 HG2 GLU 40 2HG GLU 40 -13.547 37.706 -13.125 308 HG3 GLU 40 3HG GLU 40 -12.862 37.528 -11.514 309 H PHE 41 H PHE 41 -14.411 33.799 -14.321 310 HA PHE 41 HA PHE 41 -12.461 31.556 -14.670 311 HB2 PHE 41 2HB PHE 41 -15.492 31.413 -14.630 312 HB3 PHE 41 3HB PHE 41 -14.439 30.099 -15.096 313 HD1 PHE 41 HD1 PHE 41 -15.536 32.171 -12.152 314 HD2 PHE 41 HD2 PHE 41 -13.300 28.720 -13.511 315 HE1 PHE 41 HE1 PHE 41 -15.265 31.410 -9.855 316 HE2 PHE 41 HE2 PHE 41 -12.995 28.000 -11.163 317 HZ PHE 41 HZ PHE 41 -13.957 29.357 -9.316 318 H GLU 42 H GLU 42 -12.675 30.446 -16.722 319 HA GLU 42 HA GLU 42 -13.337 32.291 -18.959 320 HB2 GLU 42 2HB GLU 42 -11.456 29.941 -19.219 321 HB3 GLU 42 3HB GLU 42 -11.655 31.346 -20.254 322 HG2 GLU 42 2HG GLU 42 -9.752 32.037 -19.264 323 HG3 GLU 42 3HG GLU 42 -10.825 32.618 -18.001 324 H VAL 43 H VAL 43 -14.643 31.680 -20.562 325 HA VAL 43 HA VAL 43 -15.683 28.867 -20.669 326 HB VAL 43 HB VAL 43 -17.344 31.341 -21.147 327 HG11 VAL 43 1HG1 VAL 43 -18.131 28.410 -20.912 328 HG12 VAL 43 2HG1 VAL 43 -19.204 29.797 -21.225 329 HG13 VAL 43 3HG1 VAL 43 -18.028 29.317 -22.436 330 HG21 VAL 43 3HG2 VAL 43 -16.776 31.079 -18.708 331 HG22 VAL 43 1HG2 VAL 43 -18.472 30.914 -19.097 332 HG23 VAL 43 2HG2 VAL 43 -17.497 29.457 -18.769 333 HA PRO 44 HA PRO 44 -14.353 29.527 -24.991 334 HB2 PRO 44 2HB PRO 44 -14.681 26.571 -25.014 335 HB3 PRO 44 3HB PRO 44 -13.327 27.540 -25.619 336 HG2 PRO 44 2HG PRO 44 -13.130 26.116 -23.297 337 HG3 PRO 44 3HG PRO 44 -12.401 27.747 -23.424 338 HD2 PRO 44 2HD PRO 44 -15.046 26.976 -22.174 339 HD3 PRO 44 3HD PRO 44 -13.776 28.104 -21.591 340 H PHE 45 H PHE 45 -15.778 30.026 -26.459 341 HA PHE 45 HA PHE 45 -18.359 28.508 -26.820 342 HB2 PHE 45 2HB PHE 45 -17.629 31.404 -27.284 343 HB3 PHE 45 3HB PHE 45 -18.995 30.691 -28.077 344 HD1 PHE 45 HD2 PHE 45 -17.556 31.649 -24.790 345 HD2 PHE 45 HD1 PHE 45 -21.070 30.210 -26.835 346 HE1 PHE 45 HE2 PHE 45 -18.921 32.092 -22.776 347 HE2 PHE 45 HE1 PHE 45 -22.428 30.657 -24.801 348 HZ PHE 45 HZ PHE 45 -21.333 31.580 -22.751 349 H ALA 46 H ALA 46 -18.917 27.839 -28.885 350 HA ALA 46 HA ALA 46 -16.727 27.664 -30.878 351 HB1 ALA 46 3HB ALA 46 -19.501 26.397 -30.823 352 HB2 ALA 46 1HB ALA 46 -18.209 26.052 -31.995 353 HB3 ALA 46 2HB ALA 46 -17.991 25.624 -30.288 354 H ASP 47 H ASP 47 -17.108 28.257 -33.127 355 HA ASP 47 HA ASP 47 -18.175 30.832 -33.550 356 HB2 ASP 47 2HB ASP 47 -16.414 29.748 -34.886 357 HB3 ASP 47 3HB ASP 47 -17.590 28.607 -35.542 358 H ASP 48 H ASP 48 -19.880 27.814 -33.543 359 HA ASP 48 HA ASP 48 -22.241 28.647 -35.034 360 HB2 ASP 48 2HB ASP 48 -21.462 26.291 -34.697 361 HB3 ASP 48 3HB ASP 48 -21.853 26.438 -32.986 362 H ALA 49 H ALA 49 -21.049 29.463 -31.941 363 HA ALA 49 HA ALA 49 -23.725 30.308 -30.902 364 HB1 ALA 49 3HB ALA 49 -21.227 29.512 -29.353 365 HB2 ALA 49 1HB ALA 49 -22.795 29.982 -28.666 366 HB3 ALA 49 2HB ALA 49 -22.658 28.481 -29.600 367 H GLU 50 H GLU 50 -23.690 32.213 -29.502 368 HA GLU 50 HA GLU 50 -21.443 34.127 -29.901 369 HB2 GLU 50 2HB GLU 50 -24.391 34.695 -30.357 370 HB3 GLU 50 3HB GLU 50 -23.219 35.964 -29.971 371 HG2 GLU 50 2HG GLU 50 -21.873 35.410 -31.934 372 HG3 GLU 50 3HG GLU 50 -22.946 34.072 -32.330 373 H ILE 51 H ILE 51 -20.903 35.243 -28.204 374 HA ILE 51 HA ILE 51 -21.296 34.315 -25.648 375 HB ILE 51 HB ILE 51 -20.304 37.116 -26.166 376 HG12 ILE 51 2HG1 ILE 51 -19.218 35.768 -27.872 377 HG13 ILE 51 3HG1 ILE 51 -18.083 36.304 -26.642 378 HG21 ILE 51 1HG2 ILE 51 -18.792 36.562 -24.302 379 HG22 ILE 51 2HG2 ILE 51 -20.480 36.393 -23.789 380 HG23 ILE 51 3HG2 ILE 51 -19.501 34.960 -24.158 381 HD11 ILE 51 3HD1 ILE 51 -17.644 34.005 -27.358 382 HD12 ILE 51 1HD1 ILE 51 -18.087 34.034 -25.649 383 HD13 ILE 51 2HD1 ILE 51 -19.274 33.510 -26.871 384 HA PRO 52 HA PRO 52 -25.009 36.714 -24.490 385 HB2 PRO 52 2HB PRO 52 -25.619 35.238 -22.285 386 HB3 PRO 52 3HB PRO 52 -26.019 34.703 -23.947 387 HG2 PRO 52 2HG PRO 52 -23.707 33.860 -22.194 388 HG3 PRO 52 3HG PRO 52 -24.752 32.843 -23.248 389 HD2 PRO 52 2HD PRO 52 -22.227 33.824 -23.939 390 HD3 PRO 52 3HD PRO 52 -23.454 33.381 -25.130 391 H GLY 53 H GLY 53 -25.235 38.267 -22.898 392 HA2 GLY 53 HA2 GLY 53 -23.089 39.608 -21.807 393 HA3 GLY 53 HA3 GLY 53 -24.742 39.726 -21.195 394 H THR 54 H THR 54 -24.804 36.903 -20.233 395 HA THR 54 HA THR 54 -22.579 36.766 -18.335 396 HB THR 54 HB THR 54 -24.170 36.208 -16.445 397 HG1 THR 54 HG1 THR 54 -26.397 36.561 -16.774 398 HG21 THR 54 1HG2 THR 54 -25.129 38.345 -15.938 399 HG22 THR 54 2HG2 THR 54 -23.602 38.633 -16.769 400 HG23 THR 54 3HG2 THR 54 -25.118 38.836 -17.649 401 H TRP 55 H TRP 55 -22.405 34.653 -17.210 402 HA TRP 55 HA TRP 55 -23.784 32.337 -18.352 403 HB2 TRP 55 2HB TRP 55 -21.992 32.989 -20.030 404 HB3 TRP 55 3HB TRP 55 -20.799 32.643 -18.787 405 HD1 TRP 55 HD1 TRP 55 -20.280 30.146 -18.257 406 HE1 TRP 55 HE1 TRP 55 -20.636 27.973 -19.538 407 HE3 TRP 55 HE3 TRP 55 -23.902 31.732 -21.457 408 HZ2 TRP 55 HZ2 TRP 55 -22.414 26.982 -21.613 409 HZ3 TRP 55 HZ3 TRP 55 -24.948 30.149 -23.081 410 HH2 TRP 55 HH2 TRP 55 -24.203 27.780 -23.169 411 H LEU 56 H LEU 56 -23.442 30.409 -17.121 412 HA LEU 56 HA LEU 56 -22.749 30.859 -14.360 413 HB2 LEU 56 2HB LEU 56 -24.366 29.085 -15.764 414 HB3 LEU 56 3HB LEU 56 -23.025 28.062 -15.246 415 HG LEU 56 HG LEU 56 -24.618 29.846 -13.365 416 HD11 LEU 56 1HD1 LEU 56 -25.791 27.788 -12.674 417 HD12 LEU 56 2HD1 LEU 56 -26.090 28.151 -14.381 418 HD13 LEU 56 3HD1 LEU 56 -24.939 26.869 -13.937 419 HD21 LEU 56 3HD2 LEU 56 -23.697 28.342 -11.619 420 HD22 LEU 56 1HD2 LEU 56 -22.750 27.484 -12.857 421 HD23 LEU 56 2HD2 LEU 56 -22.408 29.181 -12.487 422 H CYS 57 H CYS 57 -20.890 30.597 -13.335 423 HA CYS 57 HA CYS 57 -18.502 29.645 -14.822 424 HB2 CYS 57 2HB CYS 57 -18.904 31.286 -12.293 425 HB3 CYS 57 3HB CYS 57 -17.322 30.725 -12.852 426 HG CYS 57 HG CYS 57 -19.531 32.353 -14.693 427 H ARG 58 H ARG 58 -16.842 28.421 -13.656 428 HA ARG 58 HA ARG 58 -17.928 25.947 -12.742 429 HB2 ARG 58 2HB ARG 58 -15.031 26.873 -12.538 430 HB3 ARG 58 3HB ARG 58 -15.616 25.214 -12.473 431 HG2 ARG 58 2HG ARG 58 -16.469 25.472 -14.841 432 HG3 ARG 58 3HG ARG 58 -15.740 27.086 -14.877 433 HD2 ARG 58 2HD ARG 58 -14.222 25.593 -15.951 434 HD3 ARG 58 3HD ARG 58 -13.513 26.080 -14.401 435 HE ARG 58 HE ARG 58 -15.005 23.614 -14.139 436 HH11 ARG 58 2HH2 ARG 58 -11.930 24.749 -15.379 437 HH12 ARG 58 1HH2 ARG 58 -11.165 23.200 -15.152 438 HH21 ARG 58 1HH1 ARG 58 -13.965 21.670 -13.868 439 HH22 ARG 58 2HH1 ARG 58 -12.296 21.506 -14.323 440 H ASN 59 H ASN 59 -17.176 28.728 -10.882 441 HA ASN 59 HA ASN 59 -16.865 27.507 -8.315 442 HB2 ASN 59 2HB ASN 59 -16.266 29.792 -8.772 443 HB3 ASN 59 3HB ASN 59 -17.927 30.204 -9.218 444 HD21 ASN 59 1HD2 ASN 59 -17.947 31.925 -7.708 445 HD22 ASN 59 2HD2 ASN 59 -17.921 31.617 -5.983 446 H GLY 60 H GLY 60 -19.614 27.758 -10.397 447 HA2 GLY 60 HA2 GLY 60 -21.741 26.789 -10.108 448 HA3 GLY 60 HA3 GLY 60 -21.523 26.747 -8.356 449 H MET 61 H MET 61 -20.651 29.758 -9.819 450 HA MET 61 HA MET 61 -23.227 31.018 -9.019 451 HB2 MET 61 2HB MET 61 -21.213 31.482 -7.572 452 HB3 MET 61 3HB MET 61 -20.429 32.201 -8.957 453 HG2 MET 61 2HG MET 61 -21.428 33.887 -7.461 454 HG3 MET 61 3HG MET 61 -22.098 33.957 -9.086 455 HE1 MET 61 3HE MET 61 -24.329 32.536 -5.280 456 HE2 MET 61 1HE MET 61 -22.973 31.603 -5.945 457 HE3 MET 61 2HE MET 61 -22.699 33.245 -5.316 458 H GLU 62 H GLU 62 -24.047 32.676 -10.302 459 HA GLU 62 HA GLU 62 -23.540 32.571 -13.153 460 HB2 GLU 62 2HB GLU 62 -25.201 34.461 -11.449 461 HB3 GLU 62 3HB GLU 62 -25.122 34.502 -13.217 462 HG2 GLU 62 2HG GLU 62 -25.938 32.159 -13.317 463 HG3 GLU 62 3HG GLU 62 -26.059 32.120 -11.557 464 H GLY 63 H GLY 63 -21.762 33.334 -14.045 465 HA2 GLY 63 HA2 GLY 63 -20.251 35.599 -12.937 466 HA3 GLY 63 HA3 GLY 63 -19.760 34.555 -14.239 467 H THR 64 H THR 64 -19.933 37.556 -14.030 468 HA THR 64 HA THR 64 -21.621 38.031 -16.445 469 HB THR 64 HB THR 64 -20.514 40.061 -14.468 470 HG1 THR 64 HG1 THR 64 -22.202 38.855 -13.605 471 HG21 THR 64 1HG2 THR 64 -22.327 40.397 -16.905 472 HG22 THR 64 2HG2 THR 64 -22.193 41.604 -15.605 473 HG23 THR 64 3HG2 THR 64 -20.777 41.194 -16.577 474 H LEU 65 H LEU 65 -20.836 38.843 -18.282 475 HA LEU 65 HA LEU 65 -18.264 38.079 -19.016 476 HB2 LEU 65 2HB LEU 65 -20.312 38.258 -20.427 477 HB3 LEU 65 3HB LEU 65 -20.179 40.007 -20.377 478 HG LEU 65 HG LEU 65 -17.855 39.668 -21.528 479 HD11 LEU 65 1HD1 LEU 65 -17.554 37.306 -21.000 480 HD12 LEU 65 2HD1 LEU 65 -18.969 36.908 -21.976 481 HD13 LEU 65 3HD1 LEU 65 -17.525 37.645 -22.733 482 HD21 LEU 65 3HD2 LEU 65 -18.897 39.344 -23.743 483 HD22 LEU 65 1HD2 LEU 65 -20.381 38.747 -22.964 484 HD23 LEU 65 2HD2 LEU 65 -19.870 40.433 -22.741 485 H ILE 66 H ILE 66 -16.331 38.941 -18.828 486 HA ILE 66 HA ILE 66 -15.980 41.904 -18.822 487 HB ILE 66 HB ILE 66 -14.030 41.733 -17.456 488 HG12 ILE 66 2HG1 ILE 66 -13.349 39.359 -17.947 489 HG13 ILE 66 3HG1 ILE 66 -13.242 39.869 -16.268 490 HG21 ILE 66 1HG2 ILE 66 -16.161 42.249 -16.404 491 HG22 ILE 66 2HG2 ILE 66 -16.458 40.531 -16.081 492 HG23 ILE 66 3HG2 ILE 66 -15.103 41.361 -15.291 493 HD11 ILE 66 3HD1 ILE 66 -14.977 38.619 -15.522 494 HD12 ILE 66 1HD1 ILE 66 -15.577 38.277 -17.131 495 HD13 ILE 66 2HD1 ILE 66 -14.033 37.571 -16.575 496 H GLU 67 H GLU 67 -14.210 42.757 -19.930 497 HA GLU 67 HA GLU 67 -13.463 41.151 -22.290 498 HB2 GLU 67 2HB GLU 67 -13.061 44.078 -21.587 499 HB3 GLU 67 3HB GLU 67 -12.517 43.314 -23.089 500 HG2 GLU 67 2HG GLU 67 -14.862 42.619 -23.576 501 HG3 GLU 67 3HG GLU 67 -15.407 43.465 -22.127 502 H GLY 68 H GLY 68 -12.028 39.640 -21.633 503 HA2 GLY 68 HA2 GLY 68 -9.572 40.191 -20.191 504 HA3 GLY 68 HA3 GLY 68 -10.011 38.704 -21.028 505 H ASP 69 H ASP 69 -9.094 42.059 -21.697 506 HA ASP 69 HA ASP 69 -7.882 43.109 -23.255 507 HB2 ASP 69 2HB ASP 69 -6.059 41.624 -22.440 508 HB3 ASP 69 3HB ASP 69 -6.383 40.530 -23.784 509 H LEU 70 H LEU 70 -10.309 42.583 -23.955 510 HA LEU 70 HA LEU 70 -10.213 42.158 -26.899 511 HB2 LEU 70 2HB LEU 70 -12.505 41.777 -24.948 512 HB3 LEU 70 3HB LEU 70 -12.730 42.038 -26.657 513 HG LEU 70 HG LEU 70 -12.990 39.738 -26.236 514 HD11 LEU 70 1HD1 LEU 70 -11.424 38.714 -27.750 515 HD12 LEU 70 2HD1 LEU 70 -11.809 40.332 -28.347 516 HD13 LEU 70 3HD1 LEU 70 -10.250 40.017 -27.530 517 HD21 LEU 70 3HD2 LEU 70 -11.364 38.256 -25.291 518 HD22 LEU 70 1HD2 LEU 70 -10.176 39.560 -25.127 519 HD23 LEU 70 2HD2 LEU 70 -11.659 39.570 -24.141 520 HA PRO 71 HA PRO 71 -12.036 42.709 -28.553 521 HB2 PRO 71 2HB PRO 71 -12.821 44.370 -30.495 522 HB3 PRO 71 3HB PRO 71 -13.795 44.147 -29.013 523 HG2 PRO 71 2HG PRO 71 -11.861 46.404 -29.635 524 HG3 PRO 71 3HG PRO 71 -13.527 46.512 -28.994 525 HD2 PRO 71 2HD PRO 71 -11.244 46.534 -27.413 526 HD3 PRO 71 3HD PRO 71 -12.837 45.964 -26.850 527 H GLU 72 H GLU 72 -9.838 41.981 -28.608 528 HA GLU 72 HA GLU 72 -7.572 42.081 -28.831 529 HB2 GLU 72 2HB GLU 72 -8.738 42.203 -31.605 530 HB3 GLU 72 3HB GLU 72 -7.024 41.831 -31.288 531 HG2 GLU 72 2HG GLU 72 -7.724 39.910 -29.875 532 HG3 GLU 72 3HG GLU 72 -9.414 40.243 -30.260 533 HA PRO 73 HA PRO 73 -7.191 46.743 -29.212 534 HB2 PRO 73 2HB PRO 73 -5.822 46.323 -26.561 535 HB3 PRO 73 3HB PRO 73 -6.878 47.671 -27.088 536 HG2 PRO 73 2HG PRO 73 -7.864 45.738 -25.474 537 HG3 PRO 73 3HG PRO 73 -8.840 46.312 -26.866 538 HD2 PRO 73 2HD PRO 73 -7.069 43.854 -26.709 539 HD3 PRO 73 3HD PRO 73 -8.758 43.985 -27.258 540 H LYS 74 H LYS 74 -5.349 47.967 -29.697 541 HA LYS 74 HA LYS 74 -2.669 46.678 -29.703 542 HB2 LYS 74 2HB LYS 74 -3.745 46.066 -31.837 543 HB3 LYS 74 3HB LYS 74 -4.134 47.753 -32.145 544 HG2 LYS 74 2HG LYS 74 -2.294 47.190 -33.524 545 HG3 LYS 74 3HG LYS 74 -1.673 48.272 -32.286 546 HD2 LYS 74 2HD LYS 74 -0.788 46.259 -31.043 547 HD3 LYS 74 3HD LYS 74 -1.406 45.223 -32.347 548 HE2 LYS 74 2HE LYS 74 0.026 46.419 -33.980 549 HE3 LYS 74 3HE LYS 74 0.610 47.491 -32.699 550 HZ1 LYS 74 HZ1 LYS 74 2.165 45.670 -33.120 551 HZ2 LYS 74 HZ2 LYS 74 1.586 45.557 -31.599 552 HZ3 LYS 74 HZ3 LYS 74 1.034 44.549 -32.764 553 H LYS 75 H LYS 75 -0.981 48.024 -29.595 554 HA LYS 75 HA LYS 75 -1.313 50.982 -29.819 555 HB2 LYS 75 2HB LYS 75 0.258 49.498 -27.663 556 HB3 LYS 75 3HB LYS 75 0.350 51.237 -27.973 557 HG2 LYS 75 2HG LYS 75 -2.082 51.456 -27.483 558 HG3 LYS 75 3HG LYS 75 -2.152 49.724 -27.102 559 HD2 LYS 75 2HD LYS 75 -0.489 50.049 -25.289 560 HD3 LYS 75 3HD LYS 75 -0.433 51.788 -25.658 561 HE2 LYS 75 2HE LYS 75 -2.863 51.967 -25.171 562 HE3 LYS 75 3HE LYS 75 -2.923 50.237 -24.812 563 HZ1 LYS 75 HZ1 LYS 75 -1.374 50.633 -22.969 564 HZ2 LYS 75 HZ2 LYS 75 -1.318 52.233 -23.301 565 HZ3 LYS 75 HZ3 LYS 75 -2.708 51.554 -22.783 566 H VAL 76 H VAL 76 0.613 52.091 -30.426 567 HA VAL 76 HA VAL 76 2.762 50.500 -31.729 568 HB VAL 76 HB VAL 76 2.611 51.882 -33.771 569 HG11 VAL 76 1HG1 VAL 76 0.051 50.324 -33.259 570 HG12 VAL 76 2HG1 VAL 76 0.795 50.688 -34.826 571 HG13 VAL 76 3HG1 VAL 76 1.623 49.612 -33.690 572 HG21 VAL 76 3HG2 VAL 76 -0.111 52.789 -32.738 573 HG22 VAL 76 1HG2 VAL 76 1.327 53.822 -32.909 574 HG23 VAL 76 2HG2 VAL 76 0.577 53.107 -34.341 575 H LYS 77 H LYS 77 4.634 51.728 -32.334 576 HA LYS 77 HA LYS 77 5.331 53.812 -30.394 577 HB2 LYS 77 2HB LYS 77 6.895 52.392 -32.588 578 HB3 LYS 77 3HB LYS 77 7.589 53.648 -31.565 579 HG2 LYS 77 2HG LYS 77 7.057 52.309 -29.535 580 HG3 LYS 77 3HG LYS 77 6.417 51.015 -30.566 581 HD2 LYS 77 2HD LYS 77 8.636 50.779 -31.655 582 HD3 LYS 77 3HD LYS 77 9.280 52.071 -30.615 583 HE2 LYS 77 2HE LYS 77 8.731 50.718 -28.602 584 HE3 LYS 77 3HE LYS 77 8.089 49.434 -29.635 585 HZ1 LYS 77 HZ1 LYS 77 10.380 48.976 -28.975 586 HZ2 LYS 77 HZ2 LYS 77 10.319 49.182 -30.592 587 HZ3 LYS 77 HZ3 LYS 77 10.912 50.368 -29.638 588 HA PRO 78 HA PRO 78 7.100 55.477 -30.366 589 HB2 PRO 78 2HB PRO 78 7.149 58.141 -29.867 590 HB3 PRO 78 3HB PRO 78 8.055 57.399 -31.219 591 HG2 PRO 78 2HG PRO 78 5.328 58.737 -31.326 592 HG3 PRO 78 3HG PRO 78 6.747 59.038 -32.380 593 HD2 PRO 78 2HD PRO 78 4.725 57.347 -33.109 594 HD3 PRO 78 3HD PRO 78 6.426 57.020 -33.550 595 HA PRO 79 HA PRO 79 3.891 55.453 -27.302 596 HB2 PRO 79 2HB PRO 79 5.279 55.465 -24.962 597 HB3 PRO 79 3HB PRO 79 5.389 54.118 -26.134 598 HG2 PRO 79 2HG PRO 79 7.282 56.479 -25.841 599 HG3 PRO 79 3HG PRO 79 7.696 54.734 -25.894 600 HD2 PRO 79 2HD PRO 79 7.812 56.303 -28.119 601 HD3 PRO 79 3HD PRO 79 7.260 54.602 -28.207 602 H ARG 80 H ARG 80 5.891 58.272 -27.557 603 HA ARG 80 HA ARG 80 3.851 59.958 -26.250 604 HB2 ARG 80 2HB ARG 80 6.066 59.292 -24.756 605 HB3 ARG 80 3HB ARG 80 6.707 60.659 -25.650 606 HG2 ARG 80 2HG ARG 80 5.857 61.762 -23.827 607 HG3 ARG 80 3HG ARG 80 4.428 61.842 -24.856 608 HD2 ARG 80 2HD ARG 80 4.997 59.814 -22.640 609 HD3 ARG 80 3HD ARG 80 3.881 61.172 -22.538 610 HE ARG 80 HE ARG 80 3.557 58.809 -24.363 611 HH11 ARG 80 2HH2 ARG 80 1.917 61.237 -22.427 612 HH12 ARG 80 1HH2 ARG 80 0.349 60.614 -22.875 613 HH21 ARG 80 2HH1 ARG 80 1.656 58.124 -24.882 614 HH22 ARG 80 1HH1 ARG 80 0.196 58.855 -24.242 Start of MODEL 15 1 H1 SER 1 1H SER 1 -0.596 -2.129 -34.604 2 H2 SER 1 2H SER 1 -0.383 -0.511 -34.445 3 H3 SER 1 3H SER 1 -0.937 -1.128 -35.860 4 HA SER 1 HA SER 1 -2.967 -1.849 -34.866 5 HB2 SER 1 2HB SER 1 -1.876 -0.625 -32.301 6 HB3 SER 1 3HB SER 1 -3.473 -1.370 -32.529 7 HG SER 1 HG SER 1 -1.958 -2.842 -31.633 8 H MET 2 H MET 2 -4.823 -0.470 -34.789 9 HA MET 2 HA MET 2 -4.424 1.950 -36.214 10 HB2 MET 2 2HB MET 2 -6.401 0.244 -36.164 11 HB3 MET 2 3HB MET 2 -7.020 1.224 -34.829 12 HG2 MET 2 2HG MET 2 -6.906 3.225 -36.378 13 HG3 MET 2 3HG MET 2 -6.385 2.141 -37.665 14 HE1 MET 2 3HE MET 2 -9.991 3.053 -38.823 15 HE2 MET 2 1HE MET 2 -8.799 4.114 -38.042 16 HE3 MET 2 2HE MET 2 -8.276 2.945 -39.276 17 H ALA 3 H ALA 3 -4.535 1.495 -32.780 18 HA ALA 3 HA ALA 3 -5.249 4.187 -32.018 19 HB1 ALA 3 3HB ALA 3 -5.592 2.216 -30.580 20 HB2 ALA 3 1HB ALA 3 -3.831 1.961 -30.496 21 HB3 ALA 3 2HB ALA 3 -4.559 3.416 -29.786 22 H ASP 4 H ASP 4 -2.436 3.129 -33.567 23 HA ASP 4 HA ASP 4 -0.371 4.527 -32.190 24 HB2 ASP 4 2HB ASP 4 -0.033 2.722 -33.818 25 HB3 ASP 4 3HB ASP 4 -0.701 3.718 -35.106 26 H ARG 5 H ARG 5 -2.887 5.785 -34.255 27 HA ARG 5 HA ARG 5 -1.518 8.436 -34.527 28 HB2 ARG 5 2HB ARG 5 -2.843 6.931 -36.829 29 HB3 ARG 5 3HB ARG 5 -2.034 8.507 -36.911 30 HG2 ARG 5 2HG ARG 5 0.089 7.374 -36.121 31 HG3 ARG 5 3HG ARG 5 -0.765 5.827 -36.268 32 HD2 ARG 5 2HD ARG 5 -1.072 6.235 -38.690 33 HD3 ARG 5 3HD ARG 5 -0.071 7.703 -38.527 34 HE ARG 5 HE ARG 5 1.228 5.441 -37.293 35 HH11 ARG 5 2HH2 ARG 5 0.653 6.667 -40.536 36 HH12 ARG 5 1HH2 ARG 5 2.054 5.852 -41.180 37 HH21 ARG 5 1HH1 ARG 5 2.950 4.463 -38.148 38 HH22 ARG 5 2HH1 ARG 5 3.340 4.617 -39.843 39 H VAL 6 H VAL 6 -2.891 10.135 -35.378 40 HA VAL 6 HA VAL 6 -4.553 11.608 -34.996 41 HB VAL 6 HB VAL 6 -6.570 9.464 -35.645 42 HG11 VAL 6 1HG1 VAL 6 -7.366 11.841 -35.345 43 HG12 VAL 6 2HG1 VAL 6 -6.233 12.351 -36.608 44 HG13 VAL 6 3HG1 VAL 6 -7.581 11.264 -36.994 45 HG21 VAL 6 3HG2 VAL 6 -4.594 10.715 -37.601 46 HG22 VAL 6 1HG2 VAL 6 -4.778 8.985 -37.229 47 HG23 VAL 6 2HG2 VAL 6 -6.067 9.841 -38.068 48 H LEU 7 H LEU 7 -3.680 10.313 -32.619 49 HA LEU 7 HA LEU 7 -4.138 9.886 -30.452 50 HB2 LEU 7 2HB LEU 7 -6.160 12.131 -30.836 51 HB3 LEU 7 3HB LEU 7 -5.595 11.498 -29.302 52 HG LEU 7 HG LEU 7 -3.180 12.090 -30.211 53 HD11 LEU 7 1HD1 LEU 7 -4.963 14.057 -31.734 54 HD12 LEU 7 2HD1 LEU 7 -3.209 14.222 -31.503 55 HD13 LEU 7 3HD1 LEU 7 -3.842 12.894 -32.467 56 HD21 LEU 7 3HD2 LEU 7 -5.176 14.175 -29.239 57 HD22 LEU 7 1HD2 LEU 7 -4.244 13.059 -28.215 58 HD23 LEU 7 2HD2 LEU 7 -3.402 14.306 -29.143 59 H ARG 8 H ARG 8 -5.589 8.170 -32.317 60 HA ARG 8 HA ARG 8 -8.268 7.713 -31.401 61 HB2 ARG 8 2HB ARG 8 -7.354 7.235 -33.658 62 HB3 ARG 8 3HB ARG 8 -6.398 5.910 -32.991 63 HG2 ARG 8 2HG ARG 8 -8.503 4.755 -32.307 64 HG3 ARG 8 3HG ARG 8 -9.449 6.092 -32.985 65 HD2 ARG 8 2HD ARG 8 -7.563 4.256 -34.523 66 HD3 ARG 8 3HD ARG 8 -9.311 4.123 -34.488 67 HE ARG 8 HE ARG 8 -9.551 6.117 -35.755 68 HH11 ARG 8 1HH1 ARG 8 -6.114 5.285 -35.517 69 HH12 ARG 8 2HH1 ARG 8 -5.732 6.278 -36.894 70 HH21 ARG 8 2HH2 ARG 8 -8.937 7.342 -37.472 71 HH22 ARG 8 1HH2 ARG 8 -7.275 7.387 -37.972 72 H GLY 9 H GLY 9 -9.166 6.234 -30.043 73 HA2 GLY 9 HA2 GLY 9 -8.010 3.927 -28.924 74 HA3 GLY 9 HA3 GLY 9 -7.676 5.248 -27.802 75 H SER 10 H SER 10 -9.059 3.383 -26.692 76 HA SER 10 HA SER 10 -11.983 3.774 -26.935 77 HB2 SER 10 2HB SER 10 -10.334 1.998 -25.098 78 HB3 SER 10 3HB SER 10 -12.103 2.061 -25.144 79 HG SER 10 HG SER 10 -10.381 1.349 -27.310 80 H ARG 11 H ARG 11 -13.325 4.389 -25.190 81 HA ARG 11 HA ARG 11 -12.115 5.852 -22.904 82 HB2 ARG 11 2HB ARG 11 -12.547 7.523 -24.684 83 HB3 ARG 11 3HB ARG 11 -14.213 6.966 -24.813 84 HG2 ARG 11 2HG ARG 11 -14.248 8.996 -23.573 85 HG3 ARG 11 3HG ARG 11 -14.609 7.703 -22.442 86 HD2 ARG 11 2HD ARG 11 -12.077 7.767 -21.842 87 HD3 ARG 11 3HD ARG 11 -12.020 9.277 -22.767 88 HE ARG 11 HE ARG 11 -14.193 9.457 -20.951 89 HH11 ARG 11 1HH2 ARG 11 -10.697 9.427 -20.693 90 HH12 ARG 11 2HH2 ARG 11 -10.739 10.114 -19.091 91 HH21 ARG 11 1HH1 ARG 11 -14.195 10.214 -18.990 92 HH22 ARG 11 2HH1 ARG 11 -12.712 10.594 -18.135 93 H LEU 12 H LEU 12 -13.213 5.691 -21.019 94 HA LEU 12 HA LEU 12 -15.242 3.558 -20.913 95 HB2 LEU 12 2HB LEU 12 -13.658 4.942 -18.719 96 HB3 LEU 12 3HB LEU 12 -14.684 3.528 -18.510 97 HG LEU 12 HG LEU 12 -12.130 3.630 -20.176 98 HD11 LEU 12 1HD1 LEU 12 -11.221 2.175 -18.424 99 HD12 LEU 12 2HD1 LEU 12 -11.758 3.717 -17.739 100 HD13 LEU 12 3HD1 LEU 12 -12.755 2.259 -17.528 101 HD21 LEU 12 3HD2 LEU 12 -12.372 1.155 -20.288 102 HD22 LEU 12 1HD2 LEU 12 -13.984 1.289 -19.546 103 HD23 LEU 12 2HD2 LEU 12 -13.666 1.986 -21.153 104 H GLY 13 H GLY 13 -15.243 7.038 -20.378 105 HA2 GLY 13 HA2 GLY 13 -18.087 7.182 -20.292 106 HA3 GLY 13 HA3 GLY 13 -17.476 7.276 -18.641 107 H ALA 14 H ALA 14 -18.930 9.280 -19.758 108 HA ALA 14 HA ALA 14 -19.153 11.439 -20.196 109 HB1 ALA 14 3HB ALA 14 -17.783 11.730 -18.169 110 HB2 ALA 14 1HB ALA 14 -16.325 11.847 -19.179 111 HB3 ALA 14 2HB ALA 14 -17.603 13.067 -19.319 112 H VAL 15 H VAL 15 -18.743 13.202 -21.597 113 HA VAL 15 HA VAL 15 -17.435 12.376 -24.137 114 HB VAL 15 HB VAL 15 -19.864 12.799 -24.053 115 HG11 VAL 15 1HG1 VAL 15 -19.923 14.730 -22.502 116 HG12 VAL 15 2HG1 VAL 15 -19.118 15.737 -23.729 117 HG13 VAL 15 3HG1 VAL 15 -20.737 15.081 -24.029 118 HG21 VAL 15 3HG2 VAL 15 -18.595 12.941 -26.176 119 HG22 VAL 15 1HG2 VAL 15 -20.043 13.960 -26.141 120 HG23 VAL 15 2HG2 VAL 15 -18.445 14.699 -25.946 121 H SER 16 H SER 16 -16.872 14.528 -21.590 122 HA SER 16 HA SER 16 -14.650 15.784 -23.085 123 HB2 SER 16 2HB SER 16 -16.442 17.396 -23.288 124 HB3 SER 16 3HB SER 16 -16.796 17.274 -21.558 125 HG SER 16 HG SER 16 -15.478 19.116 -22.086 126 H TYR 17 H TYR 17 -12.875 15.876 -21.935 127 HA TYR 17 HA TYR 17 -12.672 15.571 -19.033 128 HB2 TYR 17 2HB TYR 17 -11.442 13.294 -19.408 129 HB3 TYR 17 3HB TYR 17 -13.191 13.318 -19.354 130 HD1 TYR 17 HD1 TYR 17 -10.265 12.980 -21.665 131 HD2 TYR 17 HD2 TYR 17 -14.557 12.743 -21.247 132 HE1 TYR 17 HE1 TYR 17 -10.442 11.977 -23.934 133 HE2 TYR 17 HE2 TYR 17 -14.729 11.767 -23.522 134 HH TYR 17 HH TYR 17 -13.589 11.094 -25.400 135 H GLU 18 H GLU 18 -11.073 15.215 -22.069 136 HA GLU 18 HA GLU 18 -8.974 17.171 -21.431 137 HB2 GLU 18 2HB GLU 18 -8.316 14.701 -20.642 138 HB3 GLU 18 3HB GLU 18 -7.972 14.463 -22.348 139 HG2 GLU 18 2HG GLU 18 -6.444 16.499 -22.222 140 HG3 GLU 18 3HG GLU 18 -6.800 16.601 -20.500 141 H THR 19 H THR 19 -11.187 17.004 -23.298 142 HA THR 19 HA THR 19 -10.144 16.125 -25.892 143 HB THR 19 HB THR 19 -12.391 15.517 -24.992 144 HG1 THR 19 HG1 THR 19 -13.351 15.646 -26.999 145 HG21 THR 19 1HG2 THR 19 -14.271 17.020 -25.283 146 HG22 THR 19 2HG2 THR 19 -13.110 17.771 -24.179 147 HG23 THR 19 3HG2 THR 19 -13.213 18.320 -25.865 148 H ASP 20 H ASP 20 -9.910 18.994 -24.280 149 HA ASP 20 HA ASP 20 -10.560 20.910 -26.344 150 HB2 ASP 20 2HB ASP 20 -9.879 22.545 -24.678 151 HB3 ASP 20 3HB ASP 20 -10.966 21.350 -23.995 152 H ARG 21 H ARG 21 -8.563 19.016 -27.189 153 HA ARG 21 HA ARG 21 -5.999 20.468 -27.469 154 HB2 ARG 21 2HB ARG 21 -7.049 17.812 -28.530 155 HB3 ARG 21 3HB ARG 21 -5.486 18.488 -29.004 156 HG2 ARG 21 2HG ARG 21 -4.715 18.496 -26.681 157 HG3 ARG 21 3HG ARG 21 -6.275 17.857 -26.121 158 HD2 ARG 21 2HD ARG 21 -5.941 15.775 -27.308 159 HD3 ARG 21 3HD ARG 21 -4.569 16.437 -28.199 160 HE ARG 21 HE ARG 21 -3.156 16.048 -26.426 161 HH11 ARG 21 1HH1 ARG 21 -6.429 15.639 -25.061 162 HH12 ARG 21 2HH1 ARG 21 -5.723 14.800 -23.691 163 HH21 ARG 21 1HH2 ARG 21 -2.518 15.029 -24.511 164 HH22 ARG 21 2HH2 ARG 21 -3.782 14.560 -23.373 165 H ASN 22 H ASN 22 -5.121 21.136 -29.430 166 HA ASN 22 HA ASN 22 -7.108 22.067 -31.441 167 HB2 ASN 22 2HB ASN 22 -5.605 23.626 -29.947 168 HB3 ASN 22 3HB ASN 22 -4.346 23.245 -31.119 169 HD21 ASN 22 2HD2 ASN 22 -5.204 23.546 -33.528 170 HD22 ASN 22 1HD2 ASN 22 -6.108 25.046 -33.768 171 H HIS 23 H HIS 23 -5.980 19.347 -31.477 172 HA HIS 23 HA HIS 23 -4.067 19.123 -33.651 173 HB2 HIS 23 2HB HIS 23 -4.401 17.402 -31.892 174 HB3 HIS 23 3HB HIS 23 -6.032 17.100 -32.495 175 HD2 HIS 23 HD2 HIS 23 -2.315 16.701 -33.551 176 HE1 HIS 23 HE1 HIS 23 -4.598 14.065 -36.007 177 HE2 HIS 23 HE2 HIS 23 -2.243 14.805 -35.379 178 H ASP 24 H ASP 24 -7.580 19.230 -33.472 179 HA ASP 24 HA ASP 24 -7.793 19.236 -36.445 180 HB2 ASP 24 2HB ASP 24 -9.144 17.594 -34.885 181 HB3 ASP 24 3HB ASP 24 -10.171 18.996 -34.607 182 H LEU 25 H LEU 25 -9.646 20.673 -37.183 183 HA LEU 25 HA LEU 25 -9.094 23.449 -36.417 184 HB2 LEU 25 2HB LEU 25 -10.912 22.129 -38.467 185 HB3 LEU 25 3HB LEU 25 -11.029 23.840 -38.080 186 HG LEU 25 HG LEU 25 -8.625 24.156 -38.692 187 HD11 LEU 25 1HD1 LEU 25 -7.719 21.890 -38.529 188 HD12 LEU 25 2HD1 LEU 25 -8.877 21.301 -39.745 189 HD13 LEU 25 3HD1 LEU 25 -7.590 22.442 -40.197 190 HD21 LEU 25 3HD2 LEU 25 -9.049 24.086 -41.116 191 HD22 LEU 25 1HD2 LEU 25 -10.435 23.000 -40.854 192 HD23 LEU 25 2HD2 LEU 25 -10.473 24.669 -40.243 193 H ALA 26 H ALA 26 -10.055 24.530 -34.875 194 HA ALA 26 HA ALA 26 -12.797 23.857 -33.920 195 HB1 ALA 26 3HB ALA 26 -11.936 23.736 -31.609 196 HB2 ALA 26 1HB ALA 26 -11.219 22.487 -32.650 197 HB3 ALA 26 2HB ALA 26 -10.271 23.923 -32.217 198 HA PRO 27 HA PRO 27 -11.882 28.454 -34.344 199 HB2 PRO 27 2HB PRO 27 -14.095 29.172 -35.789 200 HB3 PRO 27 3HB PRO 27 -12.599 28.530 -36.526 201 HG2 PRO 27 2HG PRO 27 -15.118 26.988 -35.814 202 HG3 PRO 27 3HG PRO 27 -14.209 26.974 -37.361 203 HD2 PRO 27 2HD PRO 27 -13.817 25.063 -35.483 204 HD3 PRO 27 3HD PRO 27 -12.432 25.731 -36.409 205 H ARG 28 H ARG 28 -12.226 29.330 -32.519 206 HA ARG 28 HA ARG 28 -14.878 29.357 -31.170 207 HB2 ARG 28 2HB ARG 28 -13.942 28.491 -29.113 208 HB3 ARG 28 3HB ARG 28 -13.642 27.379 -30.442 209 HG2 ARG 28 2HG ARG 28 -11.289 28.422 -30.617 210 HG3 ARG 28 3HG ARG 28 -11.654 29.236 -29.085 211 HD2 ARG 28 2HD ARG 28 -12.038 27.060 -28.000 212 HD3 ARG 28 3HD ARG 28 -11.791 26.217 -29.530 213 HE ARG 28 HE ARG 28 -9.745 27.278 -27.740 214 HH11 ARG 28 1HH2 ARG 28 -10.235 26.347 -31.137 215 HH12 ARG 28 2HH2 ARG 28 -8.532 25.930 -31.277 216 HH21 ARG 28 1HH1 ARG 28 -7.598 26.760 -28.153 217 HH22 ARG 28 2HH1 ARG 28 -7.170 26.173 -29.751 218 H GLN 29 H GLN 29 -14.901 30.566 -29.171 219 HA GLN 29 HA GLN 29 -13.433 33.163 -29.215 220 HB2 GLN 29 2HB GLN 29 -16.414 32.802 -28.704 221 HB3 GLN 29 3HB GLN 29 -15.524 34.319 -28.700 222 HG2 GLN 29 2HG GLN 29 -15.898 34.609 -30.897 223 HG3 GLN 29 3HG GLN 29 -15.159 33.055 -31.285 224 HE21 GLN 29 1HE2 GLN 29 -16.764 31.178 -30.217 225 HE22 GLN 29 2HE2 GLN 29 -18.359 31.267 -30.960 226 H ILE 30 H ILE 30 -12.412 33.211 -27.363 227 HA ILE 30 HA ILE 30 -13.444 31.915 -24.907 228 HB ILE 30 HB ILE 30 -10.816 33.393 -25.219 229 HG12 ILE 30 2HG1 ILE 30 -10.682 31.653 -26.854 230 HG13 ILE 30 3HG1 ILE 30 -9.724 31.197 -25.458 231 HG21 ILE 30 1HG2 ILE 30 -11.852 31.375 -23.173 232 HG22 ILE 30 2HG2 ILE 30 -10.193 32.006 -23.240 233 HG23 ILE 30 3HG2 ILE 30 -11.537 33.098 -22.905 234 HD11 ILE 30 3HD1 ILE 30 -12.457 30.084 -26.201 235 HD12 ILE 30 1HD1 ILE 30 -10.895 29.265 -26.329 236 HD13 ILE 30 2HD1 ILE 30 -11.540 29.660 -24.727 237 H ALA 31 H ALA 31 -14.992 33.054 -23.942 238 HA ALA 31 HA ALA 31 -14.553 35.951 -23.357 239 HB1 ALA 31 3HB ALA 31 -17.000 34.157 -23.143 240 HB2 ALA 31 1HB ALA 31 -16.904 35.797 -22.481 241 HB3 ALA 31 2HB ALA 31 -16.746 35.548 -24.226 242 H ARG 32 H ARG 32 -14.862 36.631 -21.137 243 HA ARG 32 HA ARG 32 -14.233 34.578 -19.051 244 HB2 ARG 32 2HB ARG 32 -12.940 37.238 -19.595 245 HB3 ARG 32 3HB ARG 32 -13.262 36.826 -17.909 246 HG2 ARG 32 2HG ARG 32 -12.004 34.839 -17.990 247 HG3 ARG 32 3HG ARG 32 -11.809 34.912 -19.748 248 HD2 ARG 32 2HD ARG 32 -10.509 37.056 -19.437 249 HD3 ARG 32 3HD ARG 32 -10.663 36.855 -17.683 250 HE ARG 32 HE ARG 32 -9.559 34.455 -18.667 251 HH11 ARG 32 1HH1 ARG 32 -8.483 37.787 -18.540 252 HH12 ARG 32 2HH1 ARG 32 -6.803 37.321 -18.517 253 HH21 ARG 32 2HH2 ARG 32 -7.478 33.924 -18.612 254 HH22 ARG 32 1HH2 ARG 32 -6.238 35.165 -18.563 255 H TYR 33 H TYR 33 -15.295 34.808 -17.102 256 HA TYR 33 HA TYR 33 -17.344 36.956 -16.880 257 HB2 TYR 33 2HB TYR 33 -17.942 34.016 -16.518 258 HB3 TYR 33 3HB TYR 33 -19.001 35.333 -16.103 259 HD1 TYR 33 HD1 TYR 33 -17.329 33.640 -18.983 260 HD2 TYR 33 HD2 TYR 33 -20.407 36.341 -17.683 261 HE1 TYR 33 HE1 TYR 33 -18.411 33.509 -21.232 262 HE2 TYR 33 HE2 TYR 33 -21.461 36.233 -19.950 263 HH TYR 33 HH TYR 33 -21.450 35.268 -21.951 264 H ARG 34 H ARG 34 -17.557 37.805 -14.924 265 HA ARG 34 HA ARG 34 -15.981 36.687 -12.663 266 HB2 ARG 34 2HB ARG 34 -15.521 39.003 -13.441 267 HB3 ARG 34 3HB ARG 34 -17.136 39.491 -12.919 268 HG2 ARG 34 2HG ARG 34 -16.585 39.021 -10.602 269 HG3 ARG 34 3HG ARG 34 -15.157 38.101 -11.075 270 HD2 ARG 34 2HD ARG 34 -14.396 40.424 -12.148 271 HD3 ARG 34 3HD ARG 34 -15.550 41.083 -10.974 272 HE ARG 34 HE ARG 34 -13.607 39.114 -9.924 273 HH11 ARG 34 1HH2 ARG 34 -14.042 42.560 -10.434 274 HH12 ARG 34 2HH2 ARG 34 -12.823 42.959 -9.253 275 HH21 ARG 34 1HH1 ARG 34 -12.111 39.669 -8.490 276 HH22 ARG 34 2HH1 ARG 34 -11.747 41.346 -8.169 277 H THR 35 H THR 35 -16.893 35.805 -10.961 278 HA THR 35 HA THR 35 -19.797 35.475 -10.781 279 HB THR 35 HB THR 35 -19.351 34.003 -8.892 280 HG1 THR 35 HG1 THR 35 -16.645 34.501 -9.339 281 HG21 THR 35 1HG2 THR 35 -17.992 32.312 -9.970 282 HG22 THR 35 2HG2 THR 35 -19.211 33.008 -11.065 283 HG23 THR 35 3HG2 THR 35 -17.502 33.465 -11.227 284 H ASP 36 H ASP 36 -20.634 35.471 -8.346 285 HA ASP 36 HA ASP 36 -20.644 38.240 -7.620 286 HB2 ASP 36 2HB ASP 36 -22.630 36.690 -7.569 287 HB3 ASP 36 3HB ASP 36 -21.907 35.858 -6.191 288 H ASN 37 H ASN 37 -18.579 35.654 -6.547 289 HA ASN 37 HA ASN 37 -17.863 37.179 -4.090 290 HB2 ASN 37 2HB ASN 37 -16.385 34.753 -4.926 291 HB3 ASN 37 3HB ASN 37 -16.630 35.423 -3.352 292 HD21 ASN 37 1HD2 ASN 37 -17.042 32.745 -4.583 293 HD22 ASN 37 2HD2 ASN 37 -18.672 32.293 -4.039 294 H GLY 38 H GLY 38 -17.258 37.684 -7.246 295 HA2 GLY 38 HA2 GLY 38 -15.631 38.956 -8.319 296 HA3 GLY 38 HA3 GLY 38 -14.539 38.804 -6.939 297 H GLU 39 H GLU 39 -15.705 35.725 -7.762 298 HA GLU 39 HA GLU 39 -13.014 34.947 -8.578 299 HB2 GLU 39 2HB GLU 39 -15.378 33.088 -8.760 300 HB3 GLU 39 3HB GLU 39 -13.706 32.739 -8.417 301 HG2 GLU 39 2HG GLU 39 -14.311 34.296 -6.248 302 HG3 GLU 39 3HG GLU 39 -15.937 33.754 -6.704 303 H GLU 40 H GLU 40 -12.298 35.167 -10.604 304 HA GLU 40 HA GLU 40 -14.191 35.336 -12.887 305 HB2 GLU 40 2HB GLU 40 -11.244 36.018 -12.585 306 HB3 GLU 40 3HB GLU 40 -12.147 36.153 -14.102 307 HG2 GLU 40 2HG GLU 40 -13.652 37.781 -13.158 308 HG3 GLU 40 3HG GLU 40 -12.966 37.583 -11.549 309 H PHE 41 H PHE 41 -14.471 33.849 -14.360 310 HA PHE 41 HA PHE 41 -12.453 31.676 -14.795 311 HB2 PHE 41 2HB PHE 41 -15.473 31.432 -14.696 312 HB3 PHE 41 3HB PHE 41 -14.378 30.159 -15.185 313 HD1 PHE 41 HD2 PHE 41 -15.561 32.141 -12.217 314 HD2 PHE 41 HD1 PHE 41 -13.053 28.904 -13.619 315 HE1 PHE 41 HE2 PHE 41 -15.238 31.372 -9.927 316 HE2 PHE 41 HE1 PHE 41 -12.588 28.263 -11.266 317 HZ PHE 41 HZ PHE 41 -13.682 29.496 -9.407 318 H GLU 42 H GLU 42 -12.725 30.572 -16.920 319 HA GLU 42 HA GLU 42 -13.426 32.528 -19.054 320 HB2 GLU 42 2HB GLU 42 -11.393 30.289 -19.210 321 HB3 GLU 42 3HB GLU 42 -11.799 31.453 -20.465 322 HG2 GLU 42 2HG GLU 42 -10.416 33.003 -19.695 323 HG3 GLU 42 3HG GLU 42 -11.015 32.879 -18.052 324 H VAL 43 H VAL 43 -14.756 31.911 -20.635 325 HA VAL 43 HA VAL 43 -15.783 29.100 -20.656 326 HB VAL 43 HB VAL 43 -17.436 31.557 -21.209 327 HG11 VAL 43 1HG1 VAL 43 -19.290 30.002 -21.287 328 HG12 VAL 43 2HG1 VAL 43 -18.102 29.512 -22.482 329 HG13 VAL 43 3HG1 VAL 43 -18.214 28.624 -20.949 330 HG21 VAL 43 3HG2 VAL 43 -18.554 31.157 -19.148 331 HG22 VAL 43 1HG2 VAL 43 -17.620 29.673 -18.827 332 HG23 VAL 43 2HG2 VAL 43 -16.852 31.272 -18.753 333 HA PRO 44 HA PRO 44 -14.360 29.677 -24.969 334 HB2 PRO 44 2HB PRO 44 -14.164 27.031 -25.621 335 HB3 PRO 44 3HB PRO 44 -12.920 27.886 -24.671 336 HG2 PRO 44 2HG PRO 44 -15.119 26.100 -23.644 337 HG3 PRO 44 3HG PRO 44 -13.396 26.144 -23.161 338 HD2 PRO 44 2HD PRO 44 -15.409 27.383 -21.762 339 HD3 PRO 44 3HD PRO 44 -13.744 28.042 -21.788 340 H PHE 45 H PHE 45 -15.803 30.147 -26.486 341 HA PHE 45 HA PHE 45 -18.340 28.542 -26.811 342 HB2 PHE 45 2HB PHE 45 -17.697 31.452 -27.297 343 HB3 PHE 45 3HB PHE 45 -19.045 30.694 -28.079 344 HD1 PHE 45 HD2 PHE 45 -17.648 31.730 -24.789 345 HD2 PHE 45 HD1 PHE 45 -21.099 30.189 -26.865 346 HE1 PHE 45 HE2 PHE 45 -19.064 32.230 -22.826 347 HE2 PHE 45 HE1 PHE 45 -22.510 30.703 -24.884 348 HZ PHE 45 HZ PHE 45 -21.471 31.687 -22.834 349 H ALA 46 H ALA 46 -18.885 27.824 -28.866 350 HA ALA 46 HA ALA 46 -16.658 27.636 -30.809 351 HB1 ALA 46 3HB ALA 46 -17.913 25.601 -30.183 352 HB2 ALA 46 1HB ALA 46 -19.417 26.336 -30.786 353 HB3 ALA 46 2HB ALA 46 -18.090 25.968 -31.909 354 H ASP 47 H ASP 47 -16.982 28.140 -33.088 355 HA ASP 47 HA ASP 47 -18.093 30.669 -33.654 356 HB2 ASP 47 2HB ASP 47 -16.287 29.555 -34.902 357 HB3 ASP 47 3HB ASP 47 -17.431 28.367 -35.531 358 H ASP 48 H ASP 48 -19.750 27.623 -33.542 359 HA ASP 48 HA ASP 48 -22.102 28.380 -35.098 360 HB2 ASP 48 2HB ASP 48 -21.275 26.045 -34.713 361 HB3 ASP 48 3HB ASP 48 -21.709 26.206 -33.014 362 H ALA 49 H ALA 49 -20.959 29.305 -32.042 363 HA ALA 49 HA ALA 49 -23.649 30.077 -30.992 364 HB1 ALA 49 3HB ALA 49 -21.151 29.278 -29.440 365 HB2 ALA 49 1HB ALA 49 -22.741 29.679 -28.759 366 HB3 ALA 49 2HB ALA 49 -22.548 28.218 -29.742 367 H GLU 50 H GLU 50 -23.386 31.837 -29.265 368 HA GLU 50 HA GLU 50 -21.294 33.850 -29.823 369 HB2 GLU 50 2HB GLU 50 -22.874 35.643 -30.004 370 HB3 GLU 50 3HB GLU 50 -23.262 34.416 -31.212 371 HG2 GLU 50 2HG GLU 50 -25.085 33.556 -29.713 372 HG3 GLU 50 3HG GLU 50 -24.724 34.852 -28.570 373 H ILE 51 H ILE 51 -21.196 35.516 -28.114 374 HA ILE 51 HA ILE 51 -21.310 34.387 -25.475 375 HB ILE 51 HB ILE 51 -20.393 37.167 -26.196 376 HG12 ILE 51 2HG1 ILE 51 -19.275 35.707 -27.786 377 HG13 ILE 51 3HG1 ILE 51 -18.148 36.379 -26.607 378 HG21 ILE 51 1HG2 ILE 51 -20.594 36.602 -23.768 379 HG22 ILE 51 2HG2 ILE 51 -19.508 35.226 -24.023 380 HG23 ILE 51 3HG2 ILE 51 -18.923 36.869 -24.286 381 HD11 ILE 51 3HD1 ILE 51 -19.257 33.547 -26.672 382 HD12 ILE 51 1HD1 ILE 51 -17.619 34.056 -27.117 383 HD13 ILE 51 2HD1 ILE 51 -18.137 34.166 -25.433 384 HA PRO 52 HA PRO 52 -25.054 36.848 -24.480 385 HB2 PRO 52 2HB PRO 52 -25.727 35.411 -22.256 386 HB3 PRO 52 3HB PRO 52 -26.136 34.880 -23.918 387 HG2 PRO 52 2HG PRO 52 -23.855 33.988 -22.147 388 HG3 PRO 52 3HG PRO 52 -24.932 32.988 -23.186 389 HD2 PRO 52 2HD PRO 52 -22.391 33.835 -23.909 390 HD3 PRO 52 3HD PRO 52 -23.671 33.508 -25.092 391 H GLY 53 H GLY 53 -25.300 38.401 -22.893 392 HA2 GLY 53 HA2 GLY 53 -23.181 39.734 -21.748 393 HA3 GLY 53 HA3 GLY 53 -24.845 39.852 -21.169 394 H THR 54 H THR 54 -24.927 37.032 -20.196 395 HA THR 54 HA THR 54 -22.709 36.876 -18.295 396 HB THR 54 HB THR 54 -24.298 36.299 -16.411 397 HG1 THR 54 HG1 THR 54 -26.525 36.664 -16.730 398 HG21 THR 54 1HG2 THR 54 -25.221 38.952 -17.584 399 HG22 THR 54 2HG2 THR 54 -25.272 38.433 -15.883 400 HG23 THR 54 3HG2 THR 54 -23.724 38.719 -16.674 401 H TRP 55 H TRP 55 -22.543 34.754 -17.187 402 HA TRP 55 HA TRP 55 -23.898 32.439 -18.364 403 HB2 TRP 55 2HB TRP 55 -22.108 33.141 -20.038 404 HB3 TRP 55 3HB TRP 55 -20.919 32.783 -18.800 405 HD1 TRP 55 HD1 TRP 55 -20.339 30.301 -18.348 406 HE1 TRP 55 HE1 TRP 55 -20.692 28.141 -19.647 407 HE3 TRP 55 HE3 TRP 55 -24.100 31.856 -21.407 408 HZ2 TRP 55 HZ2 TRP 55 -22.494 27.151 -21.702 409 HZ3 TRP 55 HZ3 TRP 55 -25.145 30.281 -23.034 410 HH2 TRP 55 HH2 TRP 55 -24.343 27.934 -23.192 411 H LEU 56 H LEU 56 -23.520 30.493 -17.145 412 HA LEU 56 HA LEU 56 -22.774 30.918 -14.393 413 HB2 LEU 56 2HB LEU 56 -24.406 29.149 -15.789 414 HB3 LEU 56 3HB LEU 56 -23.045 28.132 -15.317 415 HG LEU 56 HG LEU 56 -24.597 29.878 -13.367 416 HD11 LEU 56 1HD1 LEU 56 -24.946 26.916 -13.995 417 HD12 LEU 56 2HD1 LEU 56 -25.762 27.811 -12.691 418 HD13 LEU 56 3HD1 LEU 56 -26.102 28.212 -14.383 419 HD21 LEU 56 3HD2 LEU 56 -22.737 27.491 -12.953 420 HD22 LEU 56 1HD2 LEU 56 -22.365 29.178 -12.564 421 HD23 LEU 56 2HD2 LEU 56 -23.643 28.340 -11.677 422 H CYS 57 H CYS 57 -20.887 30.656 -13.419 423 HA CYS 57 HA CYS 57 -18.523 29.746 -14.959 424 HB2 CYS 57 2HB CYS 57 -18.871 31.206 -12.311 425 HB3 CYS 57 3HB CYS 57 -17.307 30.650 -12.930 426 HG CYS 57 HG CYS 57 -17.456 33.187 -13.430 427 H ARG 58 H ARG 58 -16.919 28.329 -13.968 428 HA ARG 58 HA ARG 58 -18.094 25.897 -13.097 429 HB2 ARG 58 2HB ARG 58 -16.166 25.005 -13.740 430 HB3 ARG 58 3HB ARG 58 -15.701 26.618 -14.264 431 HG2 ARG 58 2HG ARG 58 -14.660 26.964 -11.981 432 HG3 ARG 58 3HG ARG 58 -14.937 25.253 -11.650 433 HD2 ARG 58 2HD ARG 58 -13.316 26.336 -13.988 434 HD3 ARG 58 3HD ARG 58 -12.636 25.757 -12.458 435 HE ARG 58 HE ARG 58 -14.245 23.666 -13.425 436 HH11 ARG 58 1HH1 ARG 58 -11.315 25.266 -14.490 437 HH12 ARG 58 2HH1 ARG 58 -10.743 23.854 -15.336 438 HH21 ARG 58 1HH2 ARG 58 -13.462 21.906 -14.530 439 HH22 ARG 58 2HH2 ARG 58 -11.932 22.004 -15.349 440 H ASN 59 H ASN 59 -17.144 28.544 -11.167 441 HA ASN 59 HA ASN 59 -16.816 27.282 -8.641 442 HB2 ASN 59 2HB ASN 59 -16.180 29.546 -9.096 443 HB3 ASN 59 3HB ASN 59 -17.842 30.016 -9.477 444 HD21 ASN 59 1HD2 ASN 59 -17.836 31.716 -7.918 445 HD22 ASN 59 2HD2 ASN 59 -17.711 31.368 -6.207 446 H GLY 60 H GLY 60 -19.635 27.631 -10.617 447 HA2 GLY 60 HA2 GLY 60 -21.760 26.684 -10.267 448 HA3 GLY 60 HA3 GLY 60 -21.478 26.602 -8.526 449 H MET 61 H MET 61 -20.601 29.646 -9.918 450 HA MET 61 HA MET 61 -23.158 30.896 -9.037 451 HB2 MET 61 2HB MET 61 -21.111 31.289 -7.619 452 HB3 MET 61 3HB MET 61 -20.352 32.055 -8.993 453 HG2 MET 61 2HG MET 61 -21.310 33.698 -7.427 454 HG3 MET 61 3HG MET 61 -22.019 33.818 -9.033 455 HE1 MET 61 3HE MET 61 -22.828 31.376 -5.943 456 HE2 MET 61 1HE MET 61 -22.533 32.999 -5.272 457 HE3 MET 61 2HE MET 61 -24.163 32.294 -5.218 458 H GLU 62 H GLU 62 -24.021 32.559 -10.266 459 HA GLU 62 HA GLU 62 -23.556 32.534 -13.124 460 HB2 GLU 62 2HB GLU 62 -25.230 34.342 -11.347 461 HB3 GLU 62 3HB GLU 62 -25.177 34.436 -13.114 462 HG2 GLU 62 2HG GLU 62 -25.947 32.083 -13.272 463 HG3 GLU 62 3HG GLU 62 -26.038 31.986 -11.513 464 H GLY 63 H GLY 63 -21.803 33.351 -14.025 465 HA2 GLY 63 HA2 GLY 63 -20.348 35.635 -12.888 466 HA3 GLY 63 HA3 GLY 63 -19.826 34.611 -14.200 467 H THR 64 H THR 64 -20.016 37.593 -13.974 468 HA THR 64 HA THR 64 -21.736 38.097 -16.366 469 HB THR 64 HB THR 64 -20.622 40.101 -14.369 470 HG1 THR 64 HG1 THR 64 -22.299 38.877 -13.514 471 HG21 THR 64 1HG2 THR 64 -22.445 40.468 -16.794 472 HG22 THR 64 2HG2 THR 64 -22.319 41.651 -15.473 473 HG23 THR 64 3HG2 THR 64 -20.901 41.270 -16.454 474 H LEU 65 H LEU 65 -20.968 38.953 -18.196 475 HA LEU 65 HA LEU 65 -18.433 38.182 -18.981 476 HB2 LEU 65 2HB LEU 65 -20.472 38.436 -20.356 477 HB3 LEU 65 3HB LEU 65 -20.335 40.187 -20.256 478 HG LEU 65 HG LEU 65 -18.063 39.904 -21.474 479 HD11 LEU 65 1HD1 LEU 65 -17.690 37.890 -22.705 480 HD12 LEU 65 2HD1 LEU 65 -17.652 37.569 -20.978 481 HD13 LEU 65 3HD1 LEU 65 -19.083 37.104 -21.900 482 HD21 LEU 65 3HD2 LEU 65 -20.126 40.608 -22.639 483 HD22 LEU 65 1HD2 LEU 65 -19.137 39.561 -23.671 484 HD23 LEU 65 2HD2 LEU 65 -20.584 38.906 -22.867 485 H ILE 66 H ILE 66 -16.509 38.925 -18.794 486 HA ILE 66 HA ILE 66 -15.897 41.794 -19.107 487 HB ILE 66 HB ILE 66 -14.008 41.677 -17.658 488 HG12 ILE 66 2HG1 ILE 66 -13.482 39.235 -17.831 489 HG13 ILE 66 3HG1 ILE 66 -13.393 39.927 -16.219 490 HG21 ILE 66 1HG2 ILE 66 -15.124 41.621 -15.459 491 HG22 ILE 66 2HG2 ILE 66 -16.084 42.480 -16.682 492 HG23 ILE 66 3HG2 ILE 66 -16.538 40.841 -16.178 493 HD11 ILE 66 3HD1 ILE 66 -15.451 38.966 -15.531 494 HD12 ILE 66 1HD1 ILE 66 -15.705 38.289 -17.119 495 HD13 ILE 66 2HD1 ILE 66 -14.350 37.717 -16.123 496 H GLU 67 H GLU 67 -13.764 42.140 -20.168 497 HA GLU 67 HA GLU 67 -13.762 40.634 -22.552 498 HB2 GLU 67 2HB GLU 67 -11.619 42.522 -21.514 499 HB3 GLU 67 3HB GLU 67 -11.758 41.916 -23.173 500 HG2 GLU 67 2HG GLU 67 -14.067 42.924 -23.288 501 HG3 GLU 67 3HG GLU 67 -13.782 43.668 -21.713 502 H GLY 68 H GLY 68 -13.268 38.559 -22.717 503 HA2 GLY 68 HA2 GLY 68 -10.817 37.373 -21.556 504 HA3 GLY 68 HA3 GLY 68 -12.082 36.544 -22.459 505 H ASP 69 H ASP 69 -11.509 39.081 -24.397 506 HA ASP 69 HA ASP 69 -9.938 37.453 -26.239 507 HB2 ASP 69 2HB ASP 69 -12.144 38.536 -26.735 508 HB3 ASP 69 3HB ASP 69 -11.353 40.104 -26.663 509 H LEU 70 H LEU 70 -8.583 38.919 -23.964 510 HA LEU 70 HA LEU 70 -6.863 40.952 -25.093 511 HB2 LEU 70 2HB LEU 70 -7.165 39.513 -22.469 512 HB3 LEU 70 3HB LEU 70 -5.599 40.208 -22.815 513 HG LEU 70 HG LEU 70 -6.628 42.433 -23.210 514 HD11 LEU 70 1HD1 LEU 70 -9.176 41.108 -22.196 515 HD12 LEU 70 2HD1 LEU 70 -8.936 42.856 -22.416 516 HD13 LEU 70 3HD1 LEU 70 -8.929 41.782 -23.819 517 HD21 LEU 70 3HD2 LEU 70 -7.096 42.904 -20.841 518 HD22 LEU 70 1HD2 LEU 70 -7.294 41.166 -20.519 519 HD23 LEU 70 2HD2 LEU 70 -5.710 41.813 -21.004 520 HA PRO 71 HA PRO 71 -4.362 41.410 -24.117 521 HB2 PRO 71 2HB PRO 71 -2.300 41.606 -26.270 522 HB3 PRO 71 3HB PRO 71 -2.129 41.836 -24.505 523 HG2 PRO 71 2HG PRO 71 -1.208 39.582 -25.684 524 HG3 PRO 71 3HG PRO 71 -2.108 39.470 -24.130 525 HD2 PRO 71 2HD PRO 71 -3.200 39.119 -26.950 526 HD3 PRO 71 3HD PRO 71 -3.346 38.016 -25.551 527 H GLU 72 H GLU 72 -5.345 40.942 -27.400 528 HA GLU 72 HA GLU 72 -5.710 43.866 -27.877 529 HB2 GLU 72 2HB GLU 72 -5.184 43.382 -30.233 530 HB3 GLU 72 3HB GLU 72 -3.857 43.152 -29.100 531 HG2 GLU 72 2HG GLU 72 -4.104 40.712 -29.199 532 HG3 GLU 72 3HG GLU 72 -5.483 40.861 -30.284 533 HA PRO 73 HA PRO 73 -9.737 41.554 -28.024 534 HB2 PRO 73 2HB PRO 73 -11.308 43.257 -26.570 535 HB3 PRO 73 3HB PRO 73 -10.229 42.035 -25.830 536 HG2 PRO 73 2HG PRO 73 -9.627 44.975 -26.329 537 HG3 PRO 73 3HG PRO 73 -9.434 44.046 -24.808 538 HD2 PRO 73 2HD PRO 73 -7.327 44.427 -26.462 539 HD3 PRO 73 3HD PRO 73 -7.574 42.850 -25.668 540 H LYS 74 H LYS 74 -11.327 41.735 -29.460 541 HA LYS 74 HA LYS 74 -11.358 43.955 -31.352 542 HB2 LYS 74 2HB LYS 74 -11.647 41.501 -31.892 543 HB3 LYS 74 3HB LYS 74 -13.264 41.587 -31.182 544 HG2 LYS 74 2HG LYS 74 -13.892 43.315 -32.874 545 HG3 LYS 74 3HG LYS 74 -12.251 43.248 -33.541 546 HD2 LYS 74 2HD LYS 74 -12.570 40.864 -34.124 547 HD3 LYS 74 3HD LYS 74 -14.207 40.905 -33.435 548 HE2 LYS 74 2HE LYS 74 -14.857 42.652 -35.075 549 HE3 LYS 74 3HE LYS 74 -13.222 42.637 -35.750 550 HZ1 LYS 74 HZ1 LYS 74 -13.577 40.313 -36.392 551 HZ2 LYS 74 HZ2 LYS 74 -15.088 40.320 -35.768 552 HZ3 LYS 74 HZ3 LYS 74 -14.729 41.254 -37.058 553 H LYS 75 H LYS 75 -12.925 45.500 -31.722 554 HA LYS 75 HA LYS 75 -14.671 46.147 -29.446 555 HB2 LYS 75 2HB LYS 75 -13.141 47.817 -30.636 556 HB3 LYS 75 3HB LYS 75 -14.348 47.838 -31.930 557 HG2 LYS 75 2HG LYS 75 -16.088 48.346 -30.067 558 HG3 LYS 75 3HG LYS 75 -14.725 48.507 -28.966 559 HD2 LYS 75 2HD LYS 75 -15.441 50.680 -29.651 560 HD3 LYS 75 3HD LYS 75 -13.853 50.392 -30.385 561 HE2 LYS 75 2HE LYS 75 -14.815 50.006 -32.552 562 HE3 LYS 75 3HE LYS 75 -16.428 49.762 -31.867 563 HZ1 LYS 75 HZ1 LYS 75 -16.291 51.928 -32.873 564 HZ2 LYS 75 HZ2 LYS 75 -16.503 52.083 -31.269 565 HZ3 LYS 75 HZ3 LYS 75 -15.012 52.369 -31.926 566 H VAL 76 H VAL 76 -15.802 44.054 -30.028 567 HA VAL 76 HA VAL 76 -18.152 44.506 -31.796 568 HB VAL 76 HB VAL 76 -18.816 42.215 -31.232 569 HG11 VAL 76 1HG1 VAL 76 -17.087 41.092 -32.505 570 HG12 VAL 76 2HG1 VAL 76 -17.381 42.701 -33.186 571 HG13 VAL 76 3HG1 VAL 76 -15.939 42.406 -32.188 572 HG21 VAL 76 3HG2 VAL 76 -17.287 40.695 -30.073 573 HG22 VAL 76 1HG2 VAL 76 -16.165 42.019 -29.715 574 HG23 VAL 76 2HG2 VAL 76 -17.785 41.984 -28.976 575 H LYS 77 H LYS 77 -17.750 46.264 -29.573 576 HA LYS 77 HA LYS 77 -20.236 45.850 -27.993 577 HB2 LYS 77 2HB LYS 77 -17.546 46.695 -26.834 578 HB3 LYS 77 3HB LYS 77 -19.091 46.723 -26.002 579 HG2 LYS 77 2HG LYS 77 -18.342 44.752 -25.188 580 HG3 LYS 77 3HG LYS 77 -19.191 44.155 -26.600 581 HD2 LYS 77 2HD LYS 77 -17.114 42.989 -26.443 582 HD3 LYS 77 3HD LYS 77 -16.940 44.088 -27.811 583 HE2 LYS 77 2HE LYS 77 -15.684 45.686 -26.381 584 HE3 LYS 77 3HE LYS 77 -15.922 44.623 -24.991 585 HZ1 LYS 77 HZ1 LYS 77 -14.331 43.961 -27.424 586 HZ2 LYS 77 HZ2 LYS 77 -13.765 44.238 -25.897 587 HZ3 LYS 77 HZ3 LYS 77 -14.652 42.906 -26.211 588 HA PRO 78 HA PRO 78 -20.805 49.981 -29.553 589 HB2 PRO 78 2HB PRO 78 -22.713 50.298 -27.237 590 HB3 PRO 78 3HB PRO 78 -22.957 50.718 -28.960 591 HG2 PRO 78 2HG PRO 78 -24.028 48.448 -27.968 592 HG3 PRO 78 3HG PRO 78 -23.202 48.412 -29.562 593 HD2 PRO 78 2HD PRO 78 -22.099 47.590 -26.856 594 HD3 PRO 78 3HD PRO 78 -22.029 46.733 -28.428 595 HA PRO 79 HA PRO 79 -21.364 52.363 -29.657 596 HB2 PRO 79 2HB PRO 79 -19.177 54.399 -29.796 597 HB3 PRO 79 3HB PRO 79 -20.948 54.626 -29.891 598 HG2 PRO 79 2HG PRO 79 -19.580 55.309 -27.645 599 HG3 PRO 79 3HG PRO 79 -21.170 54.481 -27.518 600 HD2 PRO 79 2HD PRO 79 -18.399 53.231 -27.390 601 HD3 PRO 79 3HD PRO 79 -19.766 53.041 -26.251 602 H ARG 80 H ARG 80 -21.031 51.854 -31.810 603 HA ARG 80 HA ARG 80 -18.502 50.453 -32.481 604 HB2 ARG 80 2HB ARG 80 -21.064 50.437 -34.066 605 HB3 ARG 80 3HB ARG 80 -19.683 49.373 -34.267 606 HG2 ARG 80 2HG ARG 80 -21.506 49.450 -31.803 607 HG3 ARG 80 3HG ARG 80 -21.690 48.357 -33.153 608 HD2 ARG 80 2HD ARG 80 -19.281 48.479 -31.310 609 HD3 ARG 80 3HD ARG 80 -20.570 47.282 -31.226 610 HE ARG 80 HE ARG 80 -18.239 47.165 -32.827 611 HH11 ARG 80 1HH2 ARG 80 -21.610 46.200 -33.062 612 HH12 ARG 80 2HH2 ARG 80 -21.247 44.986 -34.255 613 HH21 ARG 80 2HH1 ARG 80 -17.889 45.699 -34.388 614 HH22 ARG 80 1HH1 ARG 80 -19.193 44.711 -34.986 Start of MODEL 16 1 H1 SER 1 1H SER 1 5.950 16.043 2.832 2 H2 SER 1 2H SER 1 5.478 16.674 4.263 3 H3 SER 1 3H SER 1 6.370 17.578 3.233 4 HA SER 1 HA SER 1 4.071 18.279 3.195 5 HB2 SER 1 2HB SER 1 5.420 18.524 1.138 6 HB3 SER 1 3HB SER 1 4.916 16.906 0.611 7 HG SER 1 HG SER 1 3.669 18.706 -0.243 8 H MET 2 H MET 2 1.891 17.821 2.693 9 HA MET 2 HA MET 2 1.086 14.956 2.567 10 HB2 MET 2 2HB MET 2 0.761 16.228 4.827 11 HB3 MET 2 3HB MET 2 -0.607 16.993 4.009 12 HG2 MET 2 2HG MET 2 -1.560 14.726 3.567 13 HG3 MET 2 3HG MET 2 -0.134 13.997 4.312 14 HE1 MET 2 3HE MET 2 -2.654 12.860 5.219 15 HE2 MET 2 1HE MET 2 -1.183 12.545 6.162 16 HE3 MET 2 2HE MET 2 -2.683 13.016 6.990 17 H ALA 3 H ALA 3 1.383 17.395 0.586 18 HA ALA 3 HA ALA 3 -1.150 18.239 -0.230 19 HB1 ALA 3 3HB ALA 3 1.419 17.978 -1.850 20 HB2 ALA 3 1HB ALA 3 0.034 19.015 -2.253 21 HB3 ALA 3 2HB ALA 3 0.978 19.337 -0.787 22 H ASP 4 H ASP 4 0.349 15.159 -1.007 23 HA ASP 4 HA ASP 4 -1.340 14.652 -3.348 24 HB2 ASP 4 3HB ASP 4 -0.018 12.747 -3.676 25 HB3 ASP 4 2HB ASP 4 1.094 13.998 -3.138 26 H ARG 5 H ARG 5 -1.834 14.229 0.008 27 HA ARG 5 HA ARG 5 -3.841 12.051 -0.392 28 HB2 ARG 5 2HB ARG 5 -2.827 10.702 1.352 29 HB3 ARG 5 3HB ARG 5 -1.668 11.031 0.073 30 HG2 ARG 5 2HG ARG 5 -0.771 12.944 1.584 31 HG3 ARG 5 3HG ARG 5 -1.759 12.227 2.869 32 HD2 ARG 5 2HD ARG 5 -0.588 10.049 2.509 33 HD3 ARG 5 3HD ARG 5 0.410 10.792 1.256 34 HE ARG 5 HE ARG 5 0.676 11.073 4.158 35 HH11 ARG 5 1HH1 ARG 5 1.633 12.600 1.083 36 HH12 ARG 5 2HH1 ARG 5 2.924 13.454 1.900 37 HH21 ARG 5 2HH2 ARG 5 2.377 12.248 5.012 38 HH22 ARG 5 1HH2 ARG 5 3.286 13.308 3.960 39 H VAL 6 H VAL 6 -5.034 11.506 1.565 40 HA VAL 6 HA VAL 6 -6.720 11.962 2.865 41 HB VAL 6 HB VAL 6 -4.713 12.530 4.382 42 HG11 VAL 6 1HG1 VAL 6 -4.941 14.659 5.610 43 HG12 VAL 6 2HG1 VAL 6 -4.397 14.918 3.964 44 HG13 VAL 6 3HG1 VAL 6 -6.088 15.253 4.402 45 HG21 VAL 6 3HG2 VAL 6 -6.142 12.682 6.272 46 HG22 VAL 6 1HG2 VAL 6 -7.494 13.297 5.319 47 HG23 VAL 6 2HG2 VAL 6 -6.913 11.628 5.087 48 H LEU 7 H LEU 7 -8.292 13.663 3.748 49 HA LEU 7 HA LEU 7 -9.590 14.737 1.440 50 HB2 LEU 7 2HB LEU 7 -10.185 15.105 4.405 51 HB3 LEU 7 3HB LEU 7 -11.293 15.505 3.099 52 HG LEU 7 HG LEU 7 -10.311 12.700 3.777 53 HD11 LEU 7 1HD1 LEU 7 -13.031 14.027 4.118 54 HD12 LEU 7 2HD1 LEU 7 -12.629 12.338 4.498 55 HD13 LEU 7 3HD1 LEU 7 -11.883 13.651 5.422 56 HD21 LEU 7 3HD2 LEU 7 -12.069 11.954 2.179 57 HD22 LEU 7 1HD2 LEU 7 -12.335 13.644 1.696 58 HD23 LEU 7 2HD2 LEU 7 -10.778 12.844 1.370 59 H ARG 8 H ARG 8 -10.605 16.888 1.362 60 HA ARG 8 HA ARG 8 -8.894 19.174 2.233 61 HB2 ARG 8 2HB ARG 8 -9.970 18.719 -0.587 62 HB3 ARG 8 3HB ARG 8 -9.149 20.176 -0.041 63 HG2 ARG 8 2HG ARG 8 -7.880 17.405 -0.196 64 HG3 ARG 8 3HG ARG 8 -7.724 18.674 -1.404 65 HD2 ARG 8 2HD ARG 8 -6.590 20.144 0.180 66 HD3 ARG 8 3HD ARG 8 -6.803 18.981 1.486 67 HE ARG 8 HE ARG 8 -4.977 18.736 -0.853 68 HH11 ARG 8 1HH2 ARG 8 -6.118 17.180 2.115 69 HH12 ARG 8 2HH2 ARG 8 -4.799 16.034 2.030 70 HH21 ARG 8 2HH1 ARG 8 -3.395 17.124 -0.794 71 HH22 ARG 8 1HH1 ARG 8 -3.286 16.128 0.647 72 H GLY 9 H GLY 9 -9.961 21.212 2.223 73 HA2 GLY 9 HA2 GLY 9 -12.722 21.160 3.138 74 HA3 GLY 9 HA3 GLY 9 -11.706 22.581 2.922 75 H SER 10 H SER 10 -14.282 22.867 2.282 76 HA SER 10 HA SER 10 -15.194 22.079 -0.243 77 HB2 SER 10 2HB SER 10 -15.951 24.612 1.260 78 HB3 SER 10 3HB SER 10 -16.925 23.764 0.042 79 HG SER 10 HG SER 10 -17.550 23.215 2.187 80 H ARG 11 H ARG 11 -12.859 24.546 0.358 81 HA ARG 11 HA ARG 11 -13.260 25.946 -2.215 82 HB2 ARG 11 2HB ARG 11 -11.235 26.340 0.011 83 HB3 ARG 11 3HB ARG 11 -11.313 27.337 -1.432 84 HG2 ARG 11 2HG ARG 11 -13.601 27.052 0.577 85 HG3 ARG 11 3HG ARG 11 -12.403 28.338 0.593 86 HD2 ARG 11 2HD ARG 11 -14.381 27.797 -1.654 87 HD3 ARG 11 3HD ARG 11 -14.498 29.078 -0.442 88 HE ARG 11 HE ARG 11 -12.009 29.458 -1.647 89 HH11 ARG 11 2HH2 ARG 11 -15.339 29.584 -2.782 90 HH12 ARG 11 1HH2 ARG 11 -14.919 30.706 -4.069 91 HH21 ARG 11 1HH1 ARG 11 -11.580 30.749 -3.422 92 HH22 ARG 11 2HH1 ARG 11 -12.891 31.160 -4.515 93 H LEU 12 H LEU 12 -12.392 23.039 -2.044 94 HA LEU 12 HA LEU 12 -9.769 22.870 -3.138 95 HB2 LEU 12 2HB LEU 12 -10.346 20.528 -3.618 96 HB3 LEU 12 3HB LEU 12 -10.663 21.051 -1.979 97 HG LEU 12 HG LEU 12 -13.119 21.200 -2.511 98 HD11 LEU 12 1HD1 LEU 12 -12.262 19.933 -5.143 99 HD12 LEU 12 2HD1 LEU 12 -13.921 19.904 -4.504 100 HD13 LEU 12 3HD1 LEU 12 -13.178 21.443 -4.910 101 HD21 LEU 12 3HD2 LEU 12 -12.153 19.234 -1.420 102 HD22 LEU 12 1HD2 LEU 12 -13.459 18.758 -2.507 103 HD23 LEU 12 2HD2 LEU 12 -11.768 18.515 -3.003 104 H GLY 13 H GLY 13 -12.436 24.135 -4.730 105 HA2 GLY 13 HA2 GLY 13 -12.439 25.173 -6.786 106 HA3 GLY 13 HA3 GLY 13 -10.846 24.511 -7.112 107 H ALA 14 H ALA 14 -12.086 24.627 -9.270 108 HA ALA 14 HA ALA 14 -13.943 22.454 -9.853 109 HB1 ALA 14 3HB ALA 14 -14.132 24.693 -10.884 110 HB2 ALA 14 1HB ALA 14 -12.569 24.447 -11.700 111 HB3 ALA 14 2HB ALA 14 -13.961 23.409 -12.091 112 H VAL 15 H VAL 15 -13.609 20.856 -11.523 113 HA VAL 15 HA VAL 15 -11.156 19.368 -11.129 114 HB VAL 15 HB VAL 15 -13.446 18.833 -13.065 115 HG11 VAL 15 1HG1 VAL 15 -12.685 16.470 -12.946 116 HG12 VAL 15 2HG1 VAL 15 -11.455 17.504 -13.665 117 HG13 VAL 15 3HG1 VAL 15 -11.282 16.969 -11.977 118 HG21 VAL 15 3HG2 VAL 15 -14.270 18.893 -10.738 119 HG22 VAL 15 1HG2 VAL 15 -14.235 17.233 -11.330 120 HG23 VAL 15 2HG2 VAL 15 -12.961 17.804 -10.231 121 H SER 16 H SER 16 -9.484 18.956 -12.392 122 HA SER 16 HA SER 16 -9.138 20.517 -14.921 123 HB2 SER 16 2HB SER 16 -7.124 20.052 -12.689 124 HB3 SER 16 3HB SER 16 -6.784 20.806 -14.251 125 HG SER 16 HG SER 16 -8.587 21.752 -12.258 126 H TYR 17 H TYR 17 -7.862 19.616 -16.500 127 HA TYR 17 HA TYR 17 -7.560 16.655 -16.386 128 HB2 TYR 17 2HB TYR 17 -8.451 18.185 -18.831 129 HB3 TYR 17 3HB TYR 17 -8.679 16.494 -18.469 130 HD1 TYR 17 HD1 TYR 17 -10.555 15.822 -16.878 131 HD2 TYR 17 HD2 TYR 17 -9.919 19.929 -18.044 132 HE1 TYR 17 HE1 TYR 17 -12.805 16.430 -15.995 133 HE2 TYR 17 HE2 TYR 17 -12.151 20.537 -17.159 134 HH TYR 17 HH TYR 17 -14.336 18.099 -15.670 135 H GLU 18 H GLU 18 -4.440 17.865 -17.857 136 HA GLU 18 HA GLU 18 -5.538 19.860 -16.261 137 HB2 GLU 18 2HB GLU 18 -3.642 20.206 -18.597 138 HB3 GLU 18 3HB GLU 18 -3.999 21.449 -17.390 139 HG2 GLU 18 2HG GLU 18 -3.161 19.943 -15.594 140 HG3 GLU 18 3HG GLU 18 -2.751 18.727 -16.806 141 H THR 19 H THR 19 -5.784 19.576 -19.655 142 HA THR 19 HA THR 19 -8.497 20.676 -19.710 143 HB THR 19 HB THR 19 -8.093 22.002 -21.817 144 HG1 THR 19 HG1 THR 19 -5.426 21.951 -20.851 145 HG21 THR 19 1HG2 THR 19 -6.793 23.160 -19.325 146 HG22 THR 19 2HG2 THR 19 -7.534 24.045 -20.676 147 HG23 THR 19 3HG2 THR 19 -8.544 23.051 -19.609 148 H ASP 20 H ASP 20 -9.714 20.077 -21.595 149 HA ASP 20 HA ASP 20 -8.608 18.003 -23.371 150 HB2 ASP 20 2HB ASP 20 -9.295 16.881 -21.212 151 HB3 ASP 20 3HB ASP 20 -10.938 17.463 -21.481 152 H ARG 21 H ARG 21 -10.303 17.278 -24.972 153 HA ARG 21 HA ARG 21 -11.532 19.558 -26.242 154 HB2 ARG 21 2HB ARG 21 -12.415 17.967 -27.882 155 HB3 ARG 21 3HB ARG 21 -10.691 17.750 -27.590 156 HG2 ARG 21 2HG ARG 21 -11.145 15.790 -26.162 157 HG3 ARG 21 3HG ARG 21 -12.886 15.993 -26.383 158 HD2 ARG 21 2HD ARG 21 -10.926 15.513 -28.669 159 HD3 ARG 21 3HD ARG 21 -11.748 14.225 -27.802 160 HE ARG 21 HE ARG 21 -13.884 14.985 -28.589 161 HH11 ARG 21 1HH1 ARG 21 -11.245 16.525 -30.326 162 HH12 ARG 21 2HH1 ARG 21 -12.279 16.940 -31.681 163 HH21 ARG 21 1HH2 ARG 21 -15.092 15.486 -30.361 164 HH22 ARG 21 2HH2 ARG 21 -14.372 16.331 -31.710 165 H ASN 22 H ASN 22 -13.623 20.087 -26.642 166 HA ASN 22 HA ASN 22 -15.828 18.927 -25.069 167 HB2 ASN 22 2HB ASN 22 -16.372 21.183 -24.079 168 HB3 ASN 22 3HB ASN 22 -14.991 20.347 -23.400 169 HD21 ASN 22 2HD2 ASN 22 -14.774 22.629 -22.516 170 HD22 ASN 22 1HD2 ASN 22 -13.758 23.702 -23.465 171 H HIS 23 H HIS 23 -15.271 22.009 -26.717 172 HA HIS 23 HA HIS 23 -16.877 21.214 -29.099 173 HB2 HIS 23 2HB HIS 23 -17.105 23.522 -28.441 174 HB3 HIS 23 3HB HIS 23 -15.368 23.714 -28.270 175 HD2 HIS 23 HD2 HIS 23 -14.825 25.486 -29.963 176 HE1 HIS 23 HE1 HIS 23 -16.707 23.898 -33.440 177 HE2 HIS 23 HE2 HIS 23 -15.230 25.792 -32.555 178 H ASP 24 H ASP 24 -15.583 21.319 -31.171 179 HA ASP 24 HA ASP 24 -13.387 19.410 -30.860 180 HB2 ASP 24 2HB ASP 24 -15.481 19.602 -32.601 181 HB3 ASP 24 3HB ASP 24 -14.213 20.332 -33.582 182 H LEU 25 H LEU 25 -11.668 19.631 -32.792 183 HA LEU 25 HA LEU 25 -9.994 21.983 -32.256 184 HB2 LEU 25 2HB LEU 25 -9.670 19.523 -34.007 185 HB3 LEU 25 3HB LEU 25 -8.539 20.874 -33.993 186 HG LEU 25 HG LEU 25 -8.128 20.529 -31.557 187 HD11 LEU 25 1HD1 LEU 25 -8.648 18.261 -30.612 188 HD12 LEU 25 2HD1 LEU 25 -10.077 19.270 -30.809 189 HD13 LEU 25 3HD1 LEU 25 -9.739 17.975 -31.988 190 HD21 LEU 25 3HD2 LEU 25 -7.585 18.135 -33.364 191 HD22 LEU 25 1HD2 LEU 25 -6.630 19.634 -33.302 192 HD23 LEU 25 2HD2 LEU 25 -6.681 18.566 -31.893 193 H ALA 26 H ALA 26 -11.723 23.339 -32.887 194 HA ALA 26 HA ALA 26 -11.822 24.215 -35.723 195 HB1 ALA 26 3HB ALA 26 -14.368 24.162 -35.477 196 HB2 ALA 26 1HB ALA 26 -13.609 22.562 -35.461 197 HB3 ALA 26 2HB ALA 26 -14.139 23.307 -33.943 198 HA PRO 27 HA PRO 27 -11.735 28.285 -34.130 199 HB2 PRO 27 2HB PRO 27 -13.838 29.660 -35.365 200 HB3 PRO 27 3HB PRO 27 -12.244 29.291 -36.084 201 HG2 PRO 27 2HG PRO 27 -14.813 27.691 -36.338 202 HG3 PRO 27 3HG PRO 27 -13.684 28.199 -37.641 203 HD2 PRO 27 2HD PRO 27 -13.495 25.732 -36.670 204 HD3 PRO 27 3HD PRO 27 -11.991 26.690 -36.850 205 H ARG 28 H ARG 28 -12.197 29.216 -32.381 206 HA ARG 28 HA ARG 28 -14.874 29.227 -31.128 207 HB2 ARG 28 2HB ARG 28 -14.111 28.287 -29.063 208 HB3 ARG 28 3HB ARG 28 -13.765 27.210 -30.419 209 HG2 ARG 28 2HG ARG 28 -11.393 27.788 -30.378 210 HG3 ARG 28 3HG ARG 28 -11.709 28.997 -29.122 211 HD2 ARG 28 2HD ARG 28 -10.833 27.054 -28.038 212 HD3 ARG 28 3HD ARG 28 -12.544 27.187 -27.618 213 HE ARG 28 HE ARG 28 -11.912 25.445 -29.925 214 HH11 ARG 28 1HH1 ARG 28 -12.392 25.415 -26.438 215 HH12 ARG 28 2HH1 ARG 28 -12.896 23.740 -26.443 216 HH21 ARG 28 1HH2 ARG 28 -12.432 23.271 -29.809 217 HH22 ARG 28 2HH2 ARG 28 -12.782 22.556 -28.273 218 H GLN 29 H GLN 29 -14.892 30.425 -29.065 219 HA GLN 29 HA GLN 29 -13.331 32.979 -29.107 220 HB2 GLN 29 2HB GLN 29 -16.337 32.724 -28.691 221 HB3 GLN 29 3HB GLN 29 -15.407 34.205 -28.689 222 HG2 GLN 29 2HG GLN 29 -15.636 34.443 -30.928 223 HG3 GLN 29 3HG GLN 29 -15.043 32.810 -31.234 224 HE21 GLN 29 1HE2 GLN 29 -16.779 31.134 -30.139 225 HE22 GLN 29 2HE2 GLN 29 -18.365 31.317 -30.894 226 H ILE 30 H ILE 30 -12.189 32.535 -27.220 227 HA ILE 30 HA ILE 30 -13.517 31.714 -24.771 228 HB ILE 30 HB ILE 30 -10.743 32.792 -25.329 229 HG12 ILE 30 2HG1 ILE 30 -9.975 30.578 -24.886 230 HG13 ILE 30 3HG1 ILE 30 -11.568 30.034 -24.363 231 HG21 ILE 30 1HG2 ILE 30 -11.348 33.400 -23.033 232 HG22 ILE 30 2HG2 ILE 30 -12.021 31.775 -22.752 233 HG23 ILE 30 3HG2 ILE 30 -10.269 32.008 -22.974 234 HD11 ILE 30 3HD1 ILE 30 -12.353 29.898 -26.628 235 HD12 ILE 30 1HD1 ILE 30 -10.870 30.680 -27.242 236 HD13 ILE 30 2HD1 ILE 30 -10.800 29.071 -26.502 237 H ALA 31 H ALA 31 -14.978 32.935 -23.944 238 HA ALA 31 HA ALA 31 -14.452 35.842 -23.456 239 HB1 ALA 31 3HB ALA 31 -16.972 34.165 -23.111 240 HB2 ALA 31 1HB ALA 31 -16.819 35.888 -22.701 241 HB3 ALA 31 2HB ALA 31 -16.651 35.359 -24.386 242 H ARG 32 H ARG 32 -14.756 36.578 -21.243 243 HA ARG 32 HA ARG 32 -14.279 34.514 -19.122 244 HB2 ARG 32 2HB ARG 32 -12.988 37.204 -19.555 245 HB3 ARG 32 3HB ARG 32 -13.280 36.658 -17.901 246 HG2 ARG 32 2HG ARG 32 -11.916 34.790 -18.056 247 HG3 ARG 32 3HG ARG 32 -11.904 34.799 -19.825 248 HD2 ARG 32 2HD ARG 32 -9.782 35.576 -19.159 249 HD3 ARG 32 3HD ARG 32 -10.679 36.994 -19.738 250 HE ARG 32 HE ARG 32 -11.124 37.145 -17.049 251 HH11 ARG 32 1HH2 ARG 32 -8.096 36.731 -18.791 252 HH12 ARG 32 2HH2 ARG 32 -7.218 37.684 -17.631 253 HH21 ARG 32 1HH1 ARG 32 -9.959 38.280 -15.631 254 HH22 ARG 32 2HH1 ARG 32 -8.226 38.494 -15.844 255 H TYR 33 H TYR 33 -15.227 34.889 -17.121 256 HA TYR 33 HA TYR 33 -17.280 37.004 -16.960 257 HB2 TYR 33 2HB TYR 33 -17.913 34.069 -16.528 258 HB3 TYR 33 3HB TYR 33 -18.959 35.400 -16.119 259 HD1 TYR 33 HD2 TYR 33 -17.316 33.676 -19.002 260 HD2 TYR 33 HD1 TYR 33 -20.432 36.320 -17.682 261 HE1 TYR 33 HE2 TYR 33 -18.430 33.500 -21.231 262 HE2 TYR 33 HE1 TYR 33 -21.515 36.173 -19.921 263 HH TYR 33 HH TYR 33 -21.523 35.188 -21.912 264 H ARG 34 H ARG 34 -17.602 37.769 -14.942 265 HA ARG 34 HA ARG 34 -15.967 36.685 -12.696 266 HB2 ARG 34 2HB ARG 34 -15.482 38.982 -13.521 267 HB3 ARG 34 3HB ARG 34 -17.130 39.471 -13.145 268 HG2 ARG 34 2HG ARG 34 -16.791 39.344 -10.817 269 HG3 ARG 34 3HG ARG 34 -15.449 38.204 -10.976 270 HD2 ARG 34 2HD ARG 34 -14.609 40.364 -10.268 271 HD3 ARG 34 3HD ARG 34 -13.995 39.913 -11.847 272 HE ARG 34 HE ARG 34 -16.290 41.812 -11.524 273 HH11 ARG 34 1HH2 ARG 34 -13.113 41.194 -13.012 274 HH12 ARG 34 2HH2 ARG 34 -13.101 42.783 -13.721 275 HH21 ARG 34 1HH1 ARG 34 -16.169 43.757 -12.551 276 HH22 ARG 34 2HH1 ARG 34 -14.780 44.158 -13.513 277 H THR 35 H THR 35 -16.885 35.797 -11.024 278 HA THR 35 HA THR 35 -19.778 35.500 -10.803 279 HB THR 35 HB THR 35 -19.311 34.067 -8.887 280 HG1 THR 35 HG1 THR 35 -16.608 34.550 -9.376 281 HG21 THR 35 1HG2 THR 35 -17.490 33.477 -11.238 282 HG22 THR 35 2HG2 THR 35 -17.959 32.351 -9.948 283 HG23 THR 35 3HG2 THR 35 -19.194 33.020 -11.041 284 H ASP 36 H ASP 36 -20.591 35.553 -8.361 285 HA ASP 36 HA ASP 36 -20.581 38.330 -7.692 286 HB2 ASP 36 2HB ASP 36 -22.562 36.777 -7.555 287 HB3 ASP 36 3HB ASP 36 -21.802 35.978 -6.179 288 H ASN 37 H ASN 37 -18.486 35.773 -6.598 289 HA ASN 37 HA ASN 37 -17.716 37.382 -4.212 290 HB2 ASN 37 2HB ASN 37 -16.257 34.925 -4.993 291 HB3 ASN 37 3HB ASN 37 -16.459 35.659 -3.440 292 HD21 ASN 37 1HD2 ASN 37 -16.932 32.933 -4.591 293 HD22 ASN 37 2HD2 ASN 37 -18.542 32.517 -3.968 294 H GLY 38 H GLY 38 -17.175 37.797 -7.392 295 HA2 GLY 38 HA2 GLY 38 -15.568 39.049 -8.528 296 HA3 GLY 38 HA3 GLY 38 -14.459 38.946 -7.158 297 H GLU 39 H GLU 39 -15.625 35.842 -7.851 298 HA GLU 39 HA GLU 39 -12.951 35.030 -8.684 299 HB2 GLU 39 2HB GLU 39 -15.313 33.160 -8.809 300 HB3 GLU 39 3HB GLU 39 -13.643 32.825 -8.461 301 HG2 GLU 39 2HG GLU 39 -14.232 34.444 -6.332 302 HG3 GLU 39 3HG GLU 39 -15.862 33.891 -6.758 303 H GLU 40 H GLU 40 -12.253 35.224 -10.739 304 HA GLU 40 HA GLU 40 -14.216 35.275 -12.969 305 HB2 GLU 40 2HB GLU 40 -11.351 36.190 -12.675 306 HB3 GLU 40 3HB GLU 40 -12.065 35.902 -14.270 307 HG2 GLU 40 2HG GLU 40 -13.912 37.423 -13.761 308 HG3 GLU 40 3HG GLU 40 -13.223 37.760 -12.168 309 H PHE 41 H PHE 41 -14.472 33.825 -14.432 310 HA PHE 41 HA PHE 41 -12.507 31.608 -14.831 311 HB2 PHE 41 2HB PHE 41 -15.537 31.466 -14.761 312 HB3 PHE 41 3HB PHE 41 -14.498 30.163 -15.276 313 HD1 PHE 41 HD1 PHE 41 -15.500 32.193 -12.250 314 HD2 PHE 41 HD2 PHE 41 -13.351 28.736 -13.741 315 HE1 PHE 41 HE1 PHE 41 -15.156 31.391 -9.972 316 HE2 PHE 41 HE2 PHE 41 -12.998 27.962 -11.420 317 HZ PHE 41 HZ PHE 41 -13.864 29.307 -9.518 318 H GLU 42 H GLU 42 -12.749 30.529 -16.920 319 HA GLU 42 HA GLU 42 -13.382 32.449 -19.102 320 HB2 GLU 42 2HB GLU 42 -11.486 30.104 -19.359 321 HB3 GLU 42 3HB GLU 42 -11.711 31.485 -20.419 322 HG2 GLU 42 2HG GLU 42 -9.820 32.232 -19.451 323 HG3 GLU 42 3HG GLU 42 -10.904 32.814 -18.198 324 H VAL 43 H VAL 43 -14.820 31.882 -20.603 325 HA VAL 43 HA VAL 43 -15.831 29.060 -20.694 326 HB VAL 43 HB VAL 43 -17.487 31.520 -21.230 327 HG11 VAL 43 1HG1 VAL 43 -19.337 29.959 -21.298 328 HG12 VAL 43 2HG1 VAL 43 -18.148 29.468 -22.495 329 HG13 VAL 43 3HG1 VAL 43 -18.256 28.586 -20.957 330 HG21 VAL 43 3HG2 VAL 43 -17.664 29.657 -18.836 331 HG22 VAL 43 1HG2 VAL 43 -16.914 31.268 -18.780 332 HG23 VAL 43 2HG2 VAL 43 -18.612 31.127 -19.176 333 HA PRO 44 HA PRO 44 -14.451 29.760 -24.984 334 HB2 PRO 44 2HB PRO 44 -14.030 27.159 -25.683 335 HB3 PRO 44 3HB PRO 44 -12.876 28.105 -24.697 336 HG2 PRO 44 2HG PRO 44 -14.932 26.103 -23.752 337 HG3 PRO 44 3HG PRO 44 -13.232 26.293 -23.224 338 HD2 PRO 44 2HD PRO 44 -15.407 27.324 -21.868 339 HD3 PRO 44 3HD PRO 44 -13.787 28.083 -21.802 340 H PHE 45 H PHE 45 -16.033 30.293 -26.339 341 HA PHE 45 HA PHE 45 -18.457 28.589 -26.749 342 HB2 PHE 45 2HB PHE 45 -17.786 31.482 -27.297 343 HB3 PHE 45 3HB PHE 45 -19.135 30.720 -28.077 344 HD1 PHE 45 HD2 PHE 45 -17.710 31.692 -24.774 345 HD2 PHE 45 HD1 PHE 45 -21.211 30.308 -26.869 346 HE1 PHE 45 HE2 PHE 45 -19.105 32.188 -22.790 347 HE2 PHE 45 HE1 PHE 45 -22.601 30.819 -24.875 348 HZ PHE 45 HZ PHE 45 -21.525 31.711 -22.798 349 H ALA 46 H ALA 46 -19.021 27.859 -28.797 350 HA ALA 46 HA ALA 46 -16.806 27.482 -30.698 351 HB1 ALA 46 3HB ALA 46 -19.706 26.500 -30.699 352 HB2 ALA 46 1HB ALA 46 -18.430 25.964 -31.807 353 HB3 ALA 46 2HB ALA 46 -18.306 25.601 -30.074 354 H ASP 47 H ASP 47 -17.003 28.018 -32.979 355 HA ASP 47 HA ASP 47 -17.926 30.610 -33.616 356 HB2 ASP 47 2HB ASP 47 -16.158 29.356 -34.787 357 HB3 ASP 47 3HB ASP 47 -17.361 28.240 -35.437 358 H ASP 48 H ASP 48 -19.778 27.677 -33.501 359 HA ASP 48 HA ASP 48 -22.019 28.567 -35.157 360 HB2 ASP 48 2HB ASP 48 -21.331 26.187 -34.768 361 HB3 ASP 48 3HB ASP 48 -21.829 26.355 -33.088 362 H ALA 49 H ALA 49 -20.939 29.415 -32.062 363 HA ALA 49 HA ALA 49 -23.632 30.249 -31.066 364 HB1 ALA 49 3HB ALA 49 -22.779 29.795 -28.822 365 HB2 ALA 49 1HB ALA 49 -22.596 28.347 -29.825 366 HB3 ALA 49 2HB ALA 49 -21.184 29.373 -29.474 367 H GLU 50 H GLU 50 -23.391 31.970 -29.315 368 HA GLU 50 HA GLU 50 -21.260 33.971 -29.799 369 HB2 GLU 50 2HB GLU 50 -22.823 35.784 -29.922 370 HB3 GLU 50 3HB GLU 50 -23.215 34.603 -31.172 371 HG2 GLU 50 2HG GLU 50 -25.055 33.710 -29.716 372 HG3 GLU 50 3HG GLU 50 -24.682 34.954 -28.519 373 H ILE 51 H ILE 51 -21.242 35.643 -28.047 374 HA ILE 51 HA ILE 51 -21.308 34.383 -25.436 375 HB ILE 51 HB ILE 51 -20.345 37.176 -26.038 376 HG12 ILE 51 2HG1 ILE 51 -19.263 35.775 -27.706 377 HG13 ILE 51 3HG1 ILE 51 -18.116 36.370 -26.504 378 HG21 ILE 51 1HG2 ILE 51 -19.481 35.134 -23.953 379 HG22 ILE 51 2HG2 ILE 51 -18.869 36.779 -24.119 380 HG23 ILE 51 3HG2 ILE 51 -20.548 36.510 -23.642 381 HD11 ILE 51 3HD1 ILE 51 -18.165 34.088 -25.442 382 HD12 ILE 51 1HD1 ILE 51 -19.263 33.566 -26.740 383 HD13 ILE 51 2HD1 ILE 51 -17.609 34.080 -27.120 384 HA PRO 52 HA PRO 52 -25.058 36.833 -24.441 385 HB2 PRO 52 2HB PRO 52 -25.760 35.359 -22.247 386 HB3 PRO 52 3HB PRO 52 -26.147 34.858 -23.925 387 HG2 PRO 52 2HG PRO 52 -23.884 33.942 -22.141 388 HG3 PRO 52 3HG PRO 52 -24.952 32.954 -23.199 389 HD2 PRO 52 2HD PRO 52 -22.411 33.803 -23.900 390 HD3 PRO 52 3HD PRO 52 -23.686 33.520 -25.100 391 H GLY 53 H GLY 53 -25.331 38.363 -22.837 392 HA2 GLY 53 HA2 GLY 53 -23.228 39.692 -21.675 393 HA3 GLY 53 HA3 GLY 53 -24.893 39.798 -21.094 394 H THR 54 H THR 54 -24.959 36.965 -20.138 395 HA THR 54 HA THR 54 -22.737 36.822 -18.235 396 HB THR 54 HB THR 54 -24.308 36.238 -16.352 397 HG1 THR 54 HG1 THR 54 -26.542 36.589 -16.660 398 HG21 THR 54 1HG2 THR 54 -25.267 38.878 -17.520 399 HG22 THR 54 2HG2 THR 54 -25.291 38.364 -15.817 400 HG23 THR 54 3HG2 THR 54 -23.757 38.666 -16.629 401 H TRP 55 H TRP 55 -22.533 34.688 -17.162 402 HA TRP 55 HA TRP 55 -23.913 32.374 -18.314 403 HB2 TRP 55 2HB TRP 55 -22.167 33.056 -20.024 404 HB3 TRP 55 3HB TRP 55 -20.942 32.721 -18.811 405 HD1 TRP 55 HD1 TRP 55 -20.369 30.226 -18.342 406 HE1 TRP 55 HE1 TRP 55 -20.717 28.080 -19.658 407 HE3 TRP 55 HE3 TRP 55 -24.121 31.807 -21.402 408 HZ2 TRP 55 HZ2 TRP 55 -22.525 27.098 -21.718 409 HZ3 TRP 55 HZ3 TRP 55 -25.164 30.242 -23.042 410 HH2 TRP 55 HH2 TRP 55 -24.366 27.895 -23.210 411 H LEU 56 H LEU 56 -23.523 30.431 -17.112 412 HA LEU 56 HA LEU 56 -22.774 30.853 -14.365 413 HB2 LEU 56 2HB LEU 56 -24.396 29.075 -15.757 414 HB3 LEU 56 3HB LEU 56 -23.029 28.065 -15.281 415 HG LEU 56 HG LEU 56 -24.611 29.800 -13.344 416 HD11 LEU 56 1HD1 LEU 56 -24.892 26.826 -13.944 417 HD12 LEU 56 2HD1 LEU 56 -25.733 27.716 -12.654 418 HD13 LEU 56 3HD1 LEU 56 -26.073 28.091 -14.351 419 HD21 LEU 56 3HD2 LEU 56 -22.371 29.166 -12.520 420 HD22 LEU 56 1HD2 LEU 56 -23.629 28.296 -11.636 421 HD23 LEU 56 2HD2 LEU 56 -22.692 27.468 -12.902 422 H CYS 57 H CYS 57 -20.890 30.614 -13.392 423 HA CYS 57 HA CYS 57 -18.519 29.708 -14.934 424 HB2 CYS 57 2HB CYS 57 -18.898 31.253 -12.344 425 HB3 CYS 57 3HB CYS 57 -17.319 30.733 -12.946 426 HG CYS 57 HG CYS 57 -19.564 32.411 -14.698 427 H ARG 58 H ARG 58 -16.844 28.436 -13.838 428 HA ARG 58 HA ARG 58 -17.951 25.955 -12.932 429 HB2 ARG 58 2HB ARG 58 -15.016 26.745 -12.849 430 HB3 ARG 58 3HB ARG 58 -15.701 25.121 -12.879 431 HG2 ARG 58 2HG ARG 58 -16.674 25.666 -15.178 432 HG3 ARG 58 3HG ARG 58 -15.746 27.172 -15.129 433 HD2 ARG 58 2HD ARG 58 -14.415 25.659 -16.359 434 HD3 ARG 58 3HD ARG 58 -13.659 25.789 -14.765 435 HE ARG 58 HE ARG 58 -15.579 23.561 -15.295 436 HH11 ARG 58 1HH2 ARG 58 -12.175 24.381 -14.829 437 HH12 ARG 58 2HH2 ARG 58 -11.777 22.693 -14.535 438 HH21 ARG 58 2HH1 ARG 58 -14.876 21.451 -15.023 439 HH22 ARG 58 1HH1 ARG 58 -13.185 21.170 -14.683 440 H ASN 59 H ASN 59 -17.137 28.679 -11.062 441 HA ASN 59 HA ASN 59 -16.732 27.408 -8.516 442 HB2 ASN 59 2HB ASN 59 -16.147 29.704 -8.958 443 HB3 ASN 59 3HB ASN 59 -17.818 30.121 -9.356 444 HD21 ASN 59 1HD2 ASN 59 -17.772 31.834 -7.832 445 HD22 ASN 59 2HD2 ASN 59 -17.656 31.518 -6.115 446 H GLY 60 H GLY 60 -19.528 27.713 -10.529 447 HA2 GLY 60 HA2 GLY 60 -21.643 26.729 -10.214 448 HA3 GLY 60 HA3 GLY 60 -21.386 26.651 -8.468 449 H MET 61 H MET 61 -20.546 29.701 -9.880 450 HA MET 61 HA MET 61 -23.124 30.921 -9.022 451 HB2 MET 61 2HB MET 61 -21.098 31.379 -7.596 452 HB3 MET 61 3HB MET 61 -20.341 32.141 -8.971 453 HG2 MET 61 2HG MET 61 -21.346 33.785 -7.441 454 HG3 MET 61 3HG MET 61 -22.038 33.869 -9.056 455 HE1 MET 61 3HE MET 61 -22.582 33.093 -5.289 456 HE2 MET 61 1HE MET 61 -24.197 32.356 -5.245 457 HE3 MET 61 2HE MET 61 -22.836 31.456 -5.942 458 H GLU 62 H GLU 62 -24.004 32.561 -10.276 459 HA GLU 62 HA GLU 62 -23.537 32.497 -13.133 460 HB2 GLU 62 2HB GLU 62 -25.232 34.312 -11.383 461 HB3 GLU 62 3HB GLU 62 -25.179 34.380 -13.153 462 HG2 GLU 62 2HG GLU 62 -25.927 32.020 -13.278 463 HG3 GLU 62 3HG GLU 62 -26.012 31.942 -11.517 464 H GLY 63 H GLY 63 -21.797 33.330 -14.050 465 HA2 GLY 63 HA2 GLY 63 -20.366 35.615 -12.898 466 HA3 GLY 63 HA3 GLY 63 -19.813 34.619 -14.222 467 H THR 64 H THR 64 -20.034 37.588 -13.999 468 HA THR 64 HA THR 64 -21.763 38.085 -16.383 469 HB THR 64 HB THR 64 -20.595 40.097 -14.424 470 HG1 THR 64 HG1 THR 64 -22.264 38.889 -13.520 471 HG21 THR 64 1HG2 THR 64 -20.919 41.236 -16.526 472 HG22 THR 64 2HG2 THR 64 -22.487 40.451 -16.797 473 HG23 THR 64 3HG2 THR 64 -22.296 41.654 -15.501 474 H LEU 65 H LEU 65 -20.987 38.932 -18.232 475 HA LEU 65 HA LEU 65 -18.430 38.119 -19.023 476 HB2 LEU 65 2HB LEU 65 -20.549 38.321 -20.315 477 HB3 LEU 65 3HB LEU 65 -20.365 40.056 -20.330 478 HG LEU 65 HG LEU 65 -18.765 37.911 -21.777 479 HD11 LEU 65 1HD1 LEU 65 -20.324 40.355 -22.739 480 HD12 LEU 65 2HD1 LEU 65 -19.600 39.097 -23.763 481 HD13 LEU 65 3HD1 LEU 65 -20.948 38.694 -22.695 482 HD21 LEU 65 3HD2 LEU 65 -17.015 39.449 -21.258 483 HD22 LEU 65 1HD2 LEU 65 -17.509 39.790 -22.905 484 HD23 LEU 65 2HD2 LEU 65 -18.054 40.864 -21.601 485 H ILE 66 H ILE 66 -16.474 38.997 -18.742 486 HA ILE 66 HA ILE 66 -16.111 41.938 -18.914 487 HB ILE 66 HB ILE 66 -14.386 41.984 -17.300 488 HG12 ILE 66 2HG1 ILE 66 -13.319 39.837 -17.463 489 HG13 ILE 66 3HG1 ILE 66 -13.786 40.142 -15.793 490 HG21 ILE 66 1HG2 ILE 66 -15.632 41.667 -15.236 491 HG22 ILE 66 2HG2 ILE 66 -16.648 42.379 -16.499 492 HG23 ILE 66 3HG2 ILE 66 -16.833 40.672 -16.069 493 HD11 ILE 66 3HD1 ILE 66 -15.779 38.661 -16.153 494 HD12 ILE 66 1HD1 ILE 66 -15.017 38.246 -17.705 495 HD13 ILE 66 2HD1 ILE 66 -14.181 37.877 -16.198 496 H GLU 67 H GLU 67 -14.052 42.626 -19.726 497 HA GLU 67 HA GLU 67 -12.965 40.872 -21.810 498 HB2 GLU 67 2HB GLU 67 -12.204 43.679 -20.918 499 HB3 GLU 67 3HB GLU 67 -11.483 42.816 -22.282 500 HG2 GLU 67 2HG GLU 67 -13.705 42.656 -23.372 501 HG3 GLU 67 3HG GLU 67 -14.436 43.539 -22.032 502 H GLY 68 H GLY 68 -11.013 39.854 -21.854 503 HA2 GLY 68 HA2 GLY 68 -9.705 39.144 -19.417 504 HA3 GLY 68 HA3 GLY 68 -9.167 38.745 -21.052 505 H ASP 69 H ASP 69 -9.048 41.768 -21.614 506 HA ASP 69 HA ASP 69 -7.707 43.459 -21.661 507 HB2 ASP 69 2HB ASP 69 -8.368 43.546 -19.242 508 HB3 ASP 69 3HB ASP 69 -6.801 42.834 -18.849 509 H LEU 70 H LEU 70 -5.731 44.313 -21.869 510 HA LEU 70 HA LEU 70 -3.620 42.645 -23.003 511 HB2 LEU 70 2HB LEU 70 -4.247 45.577 -22.708 512 HB3 LEU 70 3HB LEU 70 -2.577 45.138 -22.933 513 HG LEU 70 HG LEU 70 -3.139 43.892 -25.008 514 HD11 LEU 70 1HD1 LEU 70 -5.508 43.352 -24.632 515 HD12 LEU 70 2HD1 LEU 70 -5.920 45.083 -24.619 516 HD13 LEU 70 3HD1 LEU 70 -5.326 44.307 -26.105 517 HD21 LEU 70 3HD2 LEU 70 -4.068 46.794 -24.949 518 HD22 LEU 70 1HD2 LEU 70 -2.384 46.239 -25.079 519 HD23 LEU 70 2HD2 LEU 70 -3.528 45.893 -26.385 520 HA PRO 71 HA PRO 71 -1.048 43.790 -23.188 521 HB2 PRO 71 2HB PRO 71 1.326 42.546 -22.880 522 HB3 PRO 71 3HB PRO 71 0.914 44.076 -22.053 523 HG2 PRO 71 2HG PRO 71 0.731 41.257 -20.928 524 HG3 PRO 71 3HG PRO 71 1.525 42.691 -20.199 525 HD2 PRO 71 2HD PRO 71 -1.012 41.955 -19.530 526 HD3 PRO 71 3HD PRO 71 -0.543 43.675 -19.657 527 H GLU 72 H GLU 72 -1.662 40.527 -21.961 528 HA GLU 72 HA GLU 72 -1.232 39.414 -24.715 529 HB2 GLU 72 2HB GLU 72 -0.511 38.189 -22.037 530 HB3 GLU 72 3HB GLU 72 -0.390 37.390 -23.614 531 HG2 GLU 72 2HG GLU 72 1.141 39.245 -24.367 532 HG3 GLU 72 3HG GLU 72 1.161 39.847 -22.715 533 HA PRO 73 HA PRO 73 -5.489 37.838 -23.869 534 HB2 PRO 73 2HB PRO 73 -6.722 38.872 -26.056 535 HB3 PRO 73 3HB PRO 73 -6.573 39.798 -24.528 536 HG2 PRO 73 2HG PRO 73 -4.813 39.974 -26.997 537 HG3 PRO 73 3HG PRO 73 -5.563 41.314 -26.079 538 HD2 PRO 73 2HD PRO 73 -2.974 40.503 -25.681 539 HD3 PRO 73 3HD PRO 73 -3.986 41.137 -24.353 540 H LYS 74 H LYS 74 -6.137 35.983 -24.986 541 HA LYS 74 HA LYS 74 -4.933 35.290 -27.598 542 HB2 LYS 74 2HB LYS 74 -4.103 33.133 -26.874 543 HB3 LYS 74 3HB LYS 74 -3.306 34.441 -26.005 544 HG2 LYS 74 2HG LYS 74 -4.876 34.014 -24.058 545 HG3 LYS 74 3HG LYS 74 -5.475 32.587 -24.911 546 HD2 LYS 74 2HD LYS 74 -2.556 33.055 -24.144 547 HD3 LYS 74 3HD LYS 74 -3.716 32.140 -23.173 548 HE2 LYS 74 2HE LYS 74 -4.066 30.554 -25.048 549 HE3 LYS 74 3HE LYS 74 -2.892 31.445 -26.026 550 HZ1 LYS 74 HZ1 LYS 74 -2.276 30.079 -23.458 551 HZ2 LYS 74 HZ2 LYS 74 -1.862 29.535 -24.938 552 HZ3 LYS 74 HZ3 LYS 74 -1.193 30.906 -24.361 553 H LYS 75 H LYS 75 -6.164 34.126 -28.878 554 HA LYS 75 HA LYS 75 -8.196 33.649 -29.828 555 HB2 LYS 75 2HB LYS 75 -8.945 31.387 -29.284 556 HB3 LYS 75 3HB LYS 75 -7.204 31.535 -29.482 557 HG2 LYS 75 2HG LYS 75 -6.866 31.430 -27.042 558 HG3 LYS 75 3HG LYS 75 -8.610 31.419 -26.781 559 HD2 LYS 75 2HD LYS 75 -7.792 29.174 -26.538 560 HD3 LYS 75 3HD LYS 75 -8.739 29.241 -28.033 561 HE2 LYS 75 2HE LYS 75 -6.651 29.424 -29.360 562 HE3 LYS 75 3HE LYS 75 -5.694 29.442 -27.875 563 HZ1 LYS 75 HZ1 LYS 75 -6.502 27.186 -27.409 564 HZ2 LYS 75 HZ2 LYS 75 -7.379 27.169 -28.790 565 HZ3 LYS 75 HZ3 LYS 75 -5.751 27.229 -28.855 566 H VAL 76 H VAL 76 -8.671 35.723 -28.191 567 HA VAL 76 HA VAL 76 -10.947 35.277 -26.472 568 HB VAL 76 HB VAL 76 -11.026 37.751 -26.263 569 HG11 VAL 76 1HG1 VAL 76 -8.249 36.596 -25.868 570 HG12 VAL 76 2HG1 VAL 76 -8.979 37.967 -25.010 571 HG13 VAL 76 3HG1 VAL 76 -9.632 36.335 -24.783 572 HG21 VAL 76 3HG2 VAL 76 -9.271 39.144 -27.200 573 HG22 VAL 76 1HG2 VAL 76 -8.557 37.769 -28.061 574 HG23 VAL 76 2HG2 VAL 76 -10.163 38.379 -28.519 575 H LYS 77 H LYS 77 -12.991 36.474 -26.617 576 HA LYS 77 HA LYS 77 -14.469 36.199 -29.055 577 HB2 LYS 77 2HB LYS 77 -16.128 37.729 -27.914 578 HB3 LYS 77 3HB LYS 77 -15.678 36.298 -26.993 579 HG2 LYS 77 2HG LYS 77 -14.211 37.566 -25.537 580 HG3 LYS 77 3HG LYS 77 -14.407 39.023 -26.509 581 HD2 LYS 77 2HD LYS 77 -16.579 37.637 -24.897 582 HD3 LYS 77 3HD LYS 77 -15.712 39.085 -24.416 583 HE2 LYS 77 2HE LYS 77 -17.579 38.854 -26.829 584 HE3 LYS 77 3HE LYS 77 -17.999 39.537 -25.263 585 HZ1 LYS 77 HZ1 LYS 77 -16.021 40.656 -27.177 586 HZ2 LYS 77 HZ2 LYS 77 -17.429 41.316 -26.718 587 HZ3 LYS 77 HZ3 LYS 77 -16.208 41.218 -25.640 588 HA PRO 78 HA PRO 78 -13.563 39.949 -31.351 589 HB2 PRO 78 2HB PRO 78 -16.539 40.269 -31.694 590 HB3 PRO 78 3HB PRO 78 -15.255 40.285 -32.942 591 HG2 PRO 78 2HG PRO 78 -16.824 38.107 -32.637 592 HG3 PRO 78 3HG PRO 78 -15.057 37.913 -32.887 593 HD2 PRO 78 2HD PRO 78 -16.601 37.858 -30.273 594 HD3 PRO 78 3HD PRO 78 -15.367 36.714 -30.882 595 HA PRO 79 HA PRO 79 -14.290 42.312 -32.460 596 HB2 PRO 79 2HB PRO 79 -12.865 44.659 -31.254 597 HB3 PRO 79 3HB PRO 79 -13.937 44.594 -32.686 598 HG2 PRO 79 2HG PRO 79 -14.848 45.611 -30.348 599 HG3 PRO 79 3HG PRO 79 -15.893 44.505 -31.305 600 HD2 PRO 79 2HD PRO 79 -14.113 43.813 -28.938 601 HD3 PRO 79 3HD PRO 79 -15.838 43.413 -29.197 602 H ARG 80 H ARG 80 -12.302 42.383 -33.685 603 HA ARG 80 HA ARG 80 -9.729 41.982 -32.330 604 HB2 ARG 80 2HB ARG 80 -9.204 39.881 -33.306 605 HB3 ARG 80 3HB ARG 80 -10.728 39.717 -32.433 606 HG2 ARG 80 2HG ARG 80 -11.963 39.851 -34.624 607 HG3 ARG 80 3HG ARG 80 -10.408 40.002 -35.453 608 HD2 ARG 80 2HD ARG 80 -10.903 37.762 -35.710 609 HD3 ARG 80 3HD ARG 80 -9.762 37.750 -34.375 610 HE ARG 80 HE ARG 80 -12.657 37.138 -34.343 611 HH11 ARG 80 1HH1 ARG 80 -9.834 37.528 -32.257 612 HH12 ARG 80 2HH1 ARG 80 -10.653 36.689 -30.947 613 HH21 ARG 80 1HH2 ARG 80 -13.457 35.932 -32.650 614 HH22 ARG 80 2HH2 ARG 80 -12.517 35.836 -31.167 Start of MODEL 17 1 H1 SER 1 1H SER 1 0.440 10.114 -12.403 2 H2 SER 1 2H SER 1 -0.959 9.314 -12.094 3 H3 SER 1 3H SER 1 -0.982 10.698 -12.983 4 HA SER 1 HA SER 1 0.194 9.718 -14.764 5 HB2 SER 1 2HB SER 1 0.252 7.203 -13.055 6 HB3 SER 1 3HB SER 1 0.844 7.356 -14.724 7 HG SER 1 HG SER 1 2.522 7.629 -13.171 8 H MET 2 H MET 2 -2.706 8.128 -16.175 9 HA MET 2 HA MET 2 0.103 8.407 -16.787 10 HB2 MET 2 2HB MET 2 -1.564 7.181 -18.129 11 HB3 MET 2 3HB MET 2 -2.376 8.698 -18.531 12 HG2 MET 2 2HG MET 2 -0.414 9.469 -19.762 13 HG3 MET 2 3HG MET 2 0.522 8.067 -19.218 14 HE1 MET 2 3HE MET 2 1.228 7.759 -21.745 15 HE2 MET 2 1HE MET 2 0.103 7.369 -23.065 16 HE3 MET 2 2HE MET 2 0.130 9.006 -22.387 17 H ALA 3 H ALA 3 -2.577 10.730 -16.595 18 HA ALA 3 HA ALA 3 -0.823 13.010 -17.262 19 HB1 ALA 3 3HB ALA 3 -3.130 12.983 -18.119 20 HB2 ALA 3 1HB ALA 3 -3.761 12.844 -16.461 21 HB3 ALA 3 2HB ALA 3 -2.924 14.319 -16.974 22 H ASP 4 H ASP 4 -0.539 14.326 -13.872 23 HA ASP 4 HA ASP 4 -0.954 15.268 -16.632 24 HB2 ASP 4 2HB ASP 4 -0.291 17.412 -15.758 25 HB3 ASP 4 3HB ASP 4 -1.515 16.699 -14.736 26 H ARG 5 H ARG 5 2.444 15.583 -17.654 27 HA ARG 5 HA ARG 5 -0.017 17.102 -17.924 28 HB2 ARG 5 2HB ARG 5 0.925 17.708 -20.124 29 HB3 ARG 5 3HB ARG 5 2.025 18.014 -18.792 30 HG2 ARG 5 2HG ARG 5 3.489 16.289 -19.378 31 HG3 ARG 5 3HG ARG 5 2.274 15.394 -20.289 32 HD2 ARG 5 2HD ARG 5 3.344 18.088 -21.196 33 HD3 ARG 5 3HD ARG 5 4.071 16.536 -21.654 34 HE ARG 5 HE ARG 5 1.270 16.416 -22.216 35 HH11 ARG 5 1HH1 ARG 5 4.098 18.006 -23.555 36 HH12 ARG 5 2HH1 ARG 5 3.413 18.021 -25.159 37 HH21 ARG 5 2HH2 ARG 5 0.510 16.420 -24.178 38 HH22 ARG 5 1HH2 ARG 5 1.399 17.113 -25.521 39 H VAL 6 H VAL 6 -1.294 17.036 -19.989 40 HA VAL 6 HA VAL 6 -2.352 14.334 -20.466 41 HB VAL 6 HB VAL 6 -4.116 15.484 -21.729 42 HG11 VAL 6 1HG1 VAL 6 -3.683 16.692 -18.968 43 HG12 VAL 6 2HG1 VAL 6 -5.222 16.542 -19.840 44 HG13 VAL 6 3HG1 VAL 6 -4.366 15.086 -19.309 45 HG21 VAL 6 3HG2 VAL 6 -2.804 18.107 -20.885 46 HG22 VAL 6 1HG2 VAL 6 -2.843 17.467 -22.544 47 HG23 VAL 6 2HG2 VAL 6 -4.349 17.905 -21.728 48 H LEU 7 H LEU 7 -2.914 13.749 -22.647 49 HA LEU 7 HA LEU 7 -2.296 12.950 -24.678 50 HB2 LEU 7 2HB LEU 7 -1.545 15.835 -25.215 51 HB3 LEU 7 3HB LEU 7 -1.957 14.615 -26.415 52 HG LEU 7 HG LEU 7 -3.866 15.754 -24.327 53 HD11 LEU 7 1HD1 LEU 7 -3.245 17.359 -26.090 54 HD12 LEU 7 2HD1 LEU 7 -3.695 16.174 -27.338 55 HD13 LEU 7 3HD1 LEU 7 -4.931 16.844 -26.248 56 HD21 LEU 7 3HD2 LEU 7 -5.633 14.608 -25.626 57 HD22 LEU 7 1HD2 LEU 7 -4.390 13.846 -26.645 58 HD23 LEU 7 2HD2 LEU 7 -4.507 13.444 -24.918 59 H ARG 8 H ARG 8 -0.424 12.165 -23.023 60 HA ARG 8 HA ARG 8 2.312 12.768 -23.989 61 HB2 ARG 8 2HB ARG 8 1.259 10.847 -21.875 62 HB3 ARG 8 3HB ARG 8 2.970 11.064 -22.268 63 HG2 ARG 8 2HG ARG 8 2.884 13.413 -21.582 64 HG3 ARG 8 3HG ARG 8 1.141 13.294 -21.304 65 HD2 ARG 8 2HD ARG 8 2.211 13.131 -19.163 66 HD3 ARG 8 3HD ARG 8 1.550 11.544 -19.575 67 HE ARG 8 HE ARG 8 4.352 11.892 -20.350 68 HH11 ARG 8 1HH1 ARG 8 2.309 10.925 -17.652 69 HH12 ARG 8 2HH1 ARG 8 3.634 10.121 -16.846 70 HH21 ARG 8 1HH2 ARG 8 5.958 10.798 -19.281 71 HH22 ARG 8 2HH2 ARG 8 5.624 10.028 -17.759 72 H GLY 9 H GLY 9 1.184 12.108 -26.143 73 HA2 GLY 9 HA2 GLY 9 1.219 10.631 -27.980 74 HA3 GLY 9 HA3 GLY 9 1.854 9.341 -26.954 75 H SER 10 H SER 10 -0.452 10.041 -24.941 76 HA SER 10 HA SER 10 -2.488 8.245 -25.829 77 HB2 SER 10 2HB SER 10 -3.793 9.389 -23.933 78 HB3 SER 10 3HB SER 10 -2.317 8.507 -23.525 79 HG SER 10 HG SER 10 -2.476 10.573 -22.504 80 H ARG 11 H ARG 11 -4.245 8.540 -27.023 81 HA ARG 11 HA ARG 11 -5.547 9.385 -28.691 82 HB2 ARG 11 2HB ARG 11 -5.819 11.754 -26.807 83 HB3 ARG 11 3HB ARG 11 -6.914 11.340 -28.129 84 HG2 ARG 11 2HG ARG 11 -7.452 9.182 -27.019 85 HG3 ARG 11 3HG ARG 11 -6.411 9.637 -25.652 86 HD2 ARG 11 2HD ARG 11 -7.799 11.643 -25.254 87 HD3 ARG 11 3HD ARG 11 -8.848 11.188 -26.613 88 HE ARG 11 HE ARG 11 -8.719 8.987 -24.818 89 HH11 ARG 11 1HH2 ARG 11 -10.091 12.211 -24.842 90 HH12 ARG 11 2HH2 ARG 11 -11.359 11.779 -23.725 91 HH21 ARG 11 1HH1 ARG 11 -10.360 8.503 -23.399 92 HH22 ARG 11 2HH1 ARG 11 -11.499 9.731 -22.933 93 H LEU 12 H LEU 12 -2.658 10.066 -28.894 94 HA LEU 12 HA LEU 12 -2.836 12.253 -30.930 95 HB2 LEU 12 2HB LEU 12 -2.116 13.131 -28.723 96 HB3 LEU 12 3HB LEU 12 -0.812 11.951 -28.674 97 HG LEU 12 HG LEU 12 0.249 13.035 -30.653 98 HD11 LEU 12 1HD1 LEU 12 -1.709 14.038 -31.752 99 HD12 LEU 12 2HD1 LEU 12 -1.995 15.081 -30.338 100 HD13 LEU 12 3HD1 LEU 12 -0.541 15.295 -31.339 101 HD21 LEU 12 3HD2 LEU 12 0.979 15.065 -29.479 102 HD22 LEU 12 1HD2 LEU 12 -0.394 14.929 -28.358 103 HD23 LEU 12 2HD2 LEU 12 0.881 13.690 -28.369 104 H GLY 13 H GLY 13 -1.001 9.417 -29.755 105 HA2 GLY 13 HA2 GLY 13 0.354 7.918 -30.898 106 HA3 GLY 13 HA3 GLY 13 0.012 8.742 -32.419 107 H ALA 14 H ALA 14 2.415 8.209 -32.598 108 HA ALA 14 HA ALA 14 4.302 9.917 -31.174 109 HB1 ALA 14 3HB ALA 14 5.945 8.945 -32.726 110 HB2 ALA 14 1HB ALA 14 4.943 7.686 -31.977 111 HB3 ALA 14 2HB ALA 14 4.637 8.185 -33.658 112 H VAL 15 H VAL 15 5.023 11.901 -31.716 113 HA VAL 15 HA VAL 15 4.450 13.096 -34.375 114 HB VAL 15 HB VAL 15 3.860 15.211 -33.201 115 HG11 VAL 15 1HG1 VAL 15 1.923 12.931 -32.654 116 HG12 VAL 15 2HG1 VAL 15 1.526 14.653 -32.815 117 HG13 VAL 15 3HG1 VAL 15 2.133 13.754 -34.214 118 HG21 VAL 15 3HG2 VAL 15 3.025 15.214 -30.924 119 HG22 VAL 15 1HG2 VAL 15 3.424 13.497 -30.722 120 HG23 VAL 15 2HG2 VAL 15 4.717 14.703 -30.922 121 H SER 16 H SER 16 5.776 14.726 -35.042 122 HA SER 16 HA SER 16 8.302 15.248 -33.549 123 HB2 SER 16 2HB SER 16 8.119 14.144 -36.382 124 HB3 SER 16 3HB SER 16 9.593 14.726 -35.594 125 HG SER 16 HG SER 16 9.372 12.441 -35.462 126 H TYR 17 H TYR 17 9.226 17.202 -33.969 127 HA TYR 17 HA TYR 17 8.490 18.847 -36.273 128 HB2 TYR 17 2HB TYR 17 7.805 20.780 -34.833 129 HB3 TYR 17 3HB TYR 17 6.656 19.464 -34.900 130 HD1 TYR 17 HD1 TYR 17 9.033 21.281 -32.723 131 HD2 TYR 17 HD2 TYR 17 6.137 18.093 -32.942 132 HE1 TYR 17 HE1 TYR 17 8.969 21.167 -30.234 133 HE2 TYR 17 HE2 TYR 17 6.077 17.977 -30.458 134 HH TYR 17 HH TYR 17 6.888 18.826 -28.489 135 H GLU 18 H GLU 18 9.930 20.552 -36.657 136 HA GLU 18 HA GLU 18 12.592 20.147 -35.473 137 HB2 GLU 18 2HB GLU 18 12.084 20.166 -37.948 138 HB3 GLU 18 3HB GLU 18 11.840 21.909 -37.826 139 HG2 GLU 18 2HG GLU 18 14.196 22.137 -36.980 140 HG3 GLU 18 3HG GLU 18 14.381 20.387 -37.057 141 H THR 19 H THR 19 11.444 21.060 -33.447 142 HA THR 19 HA THR 19 11.071 22.665 -31.891 143 HB THR 19 HB THR 19 13.394 24.241 -32.996 144 HG1 THR 19 HG1 THR 19 14.743 22.764 -32.000 145 HG21 THR 19 1HG2 THR 19 12.561 23.442 -30.158 146 HG22 THR 19 2HG2 THR 19 13.973 24.434 -30.590 147 HG23 THR 19 3HG2 THR 19 12.345 25.053 -30.869 148 H ASP 20 H ASP 20 9.435 22.985 -34.148 149 HA ASP 20 HA ASP 20 9.249 25.701 -35.026 150 HB2 ASP 20 2HB ASP 20 8.475 23.677 -36.251 151 HB3 ASP 20 3HB ASP 20 7.170 23.484 -35.082 152 H ARG 21 H ARG 21 8.143 27.409 -34.296 153 HA ARG 21 HA ARG 21 6.881 27.355 -31.626 154 HB2 ARG 21 2HB ARG 21 8.592 29.017 -32.255 155 HB3 ARG 21 3HB ARG 21 7.544 29.669 -33.507 156 HG2 ARG 21 2HG ARG 21 6.509 29.552 -30.666 157 HG3 ARG 21 3HG ARG 21 7.762 30.729 -31.046 158 HD2 ARG 21 2HD ARG 21 6.438 31.811 -32.717 159 HD3 ARG 21 3HD ARG 21 5.189 30.581 -32.669 160 HE ARG 21 HE ARG 21 5.570 32.799 -30.810 161 HH11 ARG 21 2HH2 ARG 21 4.027 29.641 -31.088 162 HH12 ARG 21 1HH2 ARG 21 2.851 30.033 -29.857 163 HH21 ARG 21 1HH1 ARG 21 4.048 33.195 -29.254 164 HH22 ARG 21 2HH1 ARG 21 2.871 31.980 -28.852 165 H ASN 22 H ASN 22 5.764 27.195 -34.893 166 HA ASN 22 HA ASN 22 3.226 28.509 -34.539 167 HB2 ASN 22 2HB ASN 22 4.302 28.121 -36.737 168 HB3 ASN 22 3HB ASN 22 4.108 26.379 -36.529 169 HD21 ASN 22 2HD2 ASN 22 2.229 29.439 -36.786 170 HD22 ASN 22 1HD2 ASN 22 0.808 28.648 -37.448 171 H HIS 23 H HIS 23 1.146 27.663 -34.260 172 HA HIS 23 HA HIS 23 0.811 24.885 -33.273 173 HB2 HIS 23 2HB HIS 23 1.304 26.343 -31.308 174 HB3 HIS 23 3HB HIS 23 -0.079 27.355 -31.734 175 HD2 HIS 23 HD2 HIS 23 -1.939 26.842 -30.009 176 HE1 HIS 23 HE1 HIS 23 -1.727 22.581 -29.923 177 HE2 HIS 23 HE2 HIS 23 -2.984 24.618 -29.053 178 H ASP 24 H ASP 24 -1.474 24.291 -33.039 179 HA ASP 24 HA ASP 24 -2.994 24.956 -35.414 180 HB2 ASP 24 2HB ASP 24 -3.636 23.285 -32.955 181 HB3 ASP 24 3HB ASP 24 -4.713 23.448 -34.337 182 H LEU 25 H LEU 25 -5.153 25.658 -35.516 183 HA LEU 25 HA LEU 25 -6.184 27.396 -33.339 184 HB2 LEU 25 2HB LEU 25 -6.028 28.084 -36.302 185 HB3 LEU 25 3HB LEU 25 -6.970 28.990 -35.124 186 HG LEU 25 HG LEU 25 -3.934 28.683 -35.031 187 HD11 LEU 25 1HD1 LEU 25 -3.893 31.026 -35.768 188 HD12 LEU 25 2HD1 LEU 25 -4.692 30.002 -36.971 189 HD13 LEU 25 3HD1 LEU 25 -5.667 31.033 -35.899 190 HD21 LEU 25 3HD2 LEU 25 -4.057 30.555 -33.402 191 HD22 LEU 25 1HD2 LEU 25 -5.832 30.469 -33.436 192 HD23 LEU 25 2HD2 LEU 25 -4.874 29.117 -32.791 193 H ALA 26 H ALA 26 -8.448 27.637 -33.330 194 HA ALA 26 HA ALA 26 -10.039 25.683 -34.906 195 HB1 ALA 26 3HB ALA 26 -9.352 24.583 -32.821 196 HB2 ALA 26 1HB ALA 26 -9.989 25.939 -31.866 197 HB3 ALA 26 2HB ALA 26 -11.095 24.902 -32.795 198 HA PRO 27 HA PRO 27 -12.923 29.045 -35.076 199 HB2 PRO 27 2HB PRO 27 -15.222 27.845 -35.868 200 HB3 PRO 27 3HB PRO 27 -13.743 27.820 -36.866 201 HG2 PRO 27 2HG PRO 27 -14.711 25.662 -34.954 202 HG3 PRO 27 3HG PRO 27 -14.231 25.480 -36.673 203 HD2 PRO 27 2HD PRO 27 -12.493 25.005 -34.625 204 HD3 PRO 27 3HD PRO 27 -11.952 25.732 -36.166 205 H ARG 28 H ARG 28 -12.483 29.206 -32.660 206 HA ARG 28 HA ARG 28 -15.054 29.209 -31.185 207 HB2 ARG 28 2HB ARG 28 -14.077 28.193 -29.233 208 HB3 ARG 28 3HB ARG 28 -13.929 27.142 -30.644 209 HG2 ARG 28 2HG ARG 28 -11.544 27.760 -30.903 210 HG3 ARG 28 3HG ARG 28 -11.692 28.884 -29.549 211 HD2 ARG 28 2HD ARG 28 -10.660 26.918 -28.726 212 HD3 ARG 28 3HD ARG 28 -12.301 26.955 -28.060 213 HE ARG 28 HE ARG 28 -12.471 25.436 -30.414 214 HH11 ARG 28 1HH2 ARG 28 -10.732 25.083 -27.391 215 HH12 ARG 28 2HH2 ARG 28 -10.716 23.345 -27.501 216 HH21 ARG 28 1HH1 ARG 28 -12.414 23.213 -30.486 217 HH22 ARG 28 2HH1 ARG 28 -11.642 22.325 -29.209 218 H GLN 29 H GLN 29 -14.974 30.331 -29.147 219 HA GLN 29 HA GLN 29 -13.406 32.874 -29.153 220 HB2 GLN 29 2HB GLN 29 -16.410 32.637 -28.744 221 HB3 GLN 29 3HB GLN 29 -15.460 34.115 -28.747 222 HG2 GLN 29 2HG GLN 29 -15.749 34.364 -30.964 223 HG3 GLN 29 3HG GLN 29 -15.103 32.757 -31.294 224 HE21 GLN 29 1HE2 GLN 29 -16.825 31.005 -30.216 225 HE22 GLN 29 2HE2 GLN 29 -18.416 31.184 -30.954 226 H ILE 30 H ILE 30 -12.269 32.381 -27.277 227 HA ILE 30 HA ILE 30 -13.616 31.495 -24.839 228 HB ILE 30 HB ILE 30 -10.755 32.367 -25.354 229 HG12 ILE 30 2HG1 ILE 30 -10.222 29.985 -25.019 230 HG13 ILE 30 3HG1 ILE 30 -11.938 29.608 -24.870 231 HG21 ILE 30 1HG2 ILE 30 -11.349 32.748 -22.989 232 HG22 ILE 30 2HG2 ILE 30 -12.073 31.128 -22.884 233 HG23 ILE 30 3HG2 ILE 30 -10.322 31.326 -23.110 234 HD11 ILE 30 3HD1 ILE 30 -12.306 29.877 -27.194 235 HD12 ILE 30 1HD1 ILE 30 -10.730 30.700 -27.423 236 HD13 ILE 30 2HD1 ILE 30 -10.802 28.970 -27.030 237 H ALA 31 H ALA 31 -14.957 32.882 -23.950 238 HA ALA 31 HA ALA 31 -14.151 35.712 -23.448 239 HB1 ALA 31 3HB ALA 31 -16.529 35.889 -22.648 240 HB2 ALA 31 1HB ALA 31 -16.362 35.493 -24.366 241 HB3 ALA 31 2HB ALA 31 -16.795 34.219 -23.201 242 H ARG 32 H ARG 32 -14.586 36.523 -21.249 243 HA ARG 32 HA ARG 32 -14.120 34.529 -19.058 244 HB2 ARG 32 2HB ARG 32 -12.862 37.211 -19.586 245 HB3 ARG 32 3HB ARG 32 -13.210 36.782 -17.910 246 HG2 ARG 32 2HG ARG 32 -11.820 34.896 -17.903 247 HG3 ARG 32 3HG ARG 32 -11.730 34.826 -19.667 248 HD2 ARG 32 2HD ARG 32 -9.656 35.681 -18.936 249 HD3 ARG 32 3HD ARG 32 -10.549 37.045 -19.636 250 HE ARG 32 HE ARG 32 -11.128 37.297 -16.967 251 HH11 ARG 32 2HH1 ARG 32 -8.035 36.978 -18.600 252 HH12 ARG 32 1HH1 ARG 32 -7.218 37.942 -17.403 253 HH21 ARG 32 1HH2 ARG 32 -10.054 38.507 -15.527 254 HH22 ARG 32 2HH2 ARG 32 -8.328 38.787 -15.693 255 H TYR 33 H TYR 33 -15.201 34.810 -17.144 256 HA TYR 33 HA TYR 33 -17.230 36.954 -16.992 257 HB2 TYR 33 2HB TYR 33 -17.895 34.024 -16.580 258 HB3 TYR 33 3HB TYR 33 -18.938 35.366 -16.215 259 HD1 TYR 33 HD2 TYR 33 -17.179 33.664 -19.057 260 HD2 TYR 33 HD1 TYR 33 -20.384 36.236 -17.806 261 HE1 TYR 33 HE2 TYR 33 -18.210 33.500 -21.323 262 HE2 TYR 33 HE1 TYR 33 -21.391 36.099 -20.080 263 HH TYR 33 HH TYR 33 -21.305 35.156 -22.088 264 H ARG 34 H ARG 34 -17.672 37.643 -14.989 265 HA ARG 34 HA ARG 34 -15.986 36.665 -12.726 266 HB2 ARG 34 2HB ARG 34 -15.620 38.977 -13.644 267 HB3 ARG 34 3HB ARG 34 -17.283 39.380 -13.216 268 HG2 ARG 34 2HG ARG 34 -16.776 38.928 -10.822 269 HG3 ARG 34 3HG ARG 34 -15.137 38.453 -11.249 270 HD2 ARG 34 2HD ARG 34 -15.099 40.722 -10.410 271 HD3 ARG 34 3HD ARG 34 -14.684 40.718 -12.114 272 HE ARG 34 HE ARG 34 -16.453 42.117 -12.503 273 HH11 ARG 34 2HH2 ARG 34 -17.367 40.399 -9.570 274 HH12 ARG 34 1HH2 ARG 34 -18.747 41.426 -9.318 275 HH21 ARG 34 1HH1 ARG 34 -18.257 43.324 -12.131 276 HH22 ARG 34 2HH1 ARG 34 -19.243 43.010 -10.736 277 H THR 35 H THR 35 -16.892 35.791 -11.028 278 HA THR 35 HA THR 35 -19.795 35.531 -10.763 279 HB THR 35 HB THR 35 -19.323 34.132 -8.790 280 HG1 THR 35 HG1 THR 35 -16.631 34.538 -9.371 281 HG21 THR 35 1HG2 THR 35 -18.098 32.347 -9.885 282 HG22 THR 35 2HG2 THR 35 -19.284 33.072 -10.989 283 HG23 THR 35 3HG2 THR 35 -17.559 33.438 -11.173 284 H ASP 36 H ASP 36 -20.532 35.694 -8.275 285 HA ASP 36 HA ASP 36 -20.412 38.576 -7.741 286 HB2 ASP 36 2HB ASP 36 -22.554 37.286 -7.766 287 HB3 ASP 36 3HB ASP 36 -21.998 36.371 -6.363 288 H ASN 37 H ASN 37 -18.680 35.862 -6.721 289 HA ASN 37 HA ASN 37 -17.837 37.011 -4.123 290 HB2 ASN 37 2HB ASN 37 -18.668 34.695 -4.279 291 HB3 ASN 37 3HB ASN 37 -17.435 34.310 -5.451 292 HD21 ASN 37 1HD2 ASN 37 -16.089 32.888 -4.394 293 HD22 ASN 37 2HD2 ASN 37 -15.522 33.119 -2.777 294 H GLY 38 H GLY 38 -17.139 37.780 -7.121 295 HA2 GLY 38 HA2 GLY 38 -15.376 39.060 -7.967 296 HA3 GLY 38 HA3 GLY 38 -14.326 38.531 -6.645 297 H GLU 39 H GLU 39 -15.664 35.770 -7.862 298 HA GLU 39 HA GLU 39 -12.991 35.024 -8.722 299 HB2 GLU 39 2HB GLU 39 -15.341 33.137 -8.763 300 HB3 GLU 39 3HB GLU 39 -13.638 32.813 -8.521 301 HG2 GLU 39 2HG GLU 39 -14.164 34.429 -6.353 302 HG3 GLU 39 3HG GLU 39 -15.796 33.811 -6.697 303 H GLU 40 H GLU 40 -12.296 35.212 -10.718 304 HA GLU 40 HA GLU 40 -14.216 35.288 -12.985 305 HB2 GLU 40 2HB GLU 40 -11.310 36.105 -12.715 306 HB3 GLU 40 3HB GLU 40 -12.153 36.004 -14.269 307 HG2 GLU 40 2HG GLU 40 -13.855 37.588 -13.484 308 HG3 GLU 40 3HG GLU 40 -13.038 37.721 -11.922 309 H PHE 41 H PHE 41 -14.464 33.799 -14.427 310 HA PHE 41 HA PHE 41 -12.467 31.601 -14.789 311 HB2 PHE 41 2HB PHE 41 -15.493 31.421 -14.733 312 HB3 PHE 41 3HB PHE 41 -14.429 30.122 -15.198 313 HD1 PHE 41 HD2 PHE 41 -15.579 32.167 -12.250 314 HD2 PHE 41 HD1 PHE 41 -13.194 28.813 -13.596 315 HE1 PHE 41 HE2 PHE 41 -15.295 31.419 -9.953 316 HE2 PHE 41 HE1 PHE 41 -12.870 28.110 -11.244 317 HZ PHE 41 HZ PHE 41 -13.914 29.416 -9.405 318 H GLU 42 H GLU 42 -12.654 30.514 -16.843 319 HA GLU 42 HA GLU 42 -13.317 32.381 -19.068 320 HB2 GLU 42 2HB GLU 42 -11.381 30.071 -19.299 321 HB3 GLU 42 3HB GLU 42 -11.617 31.450 -20.361 322 HG2 GLU 42 2HG GLU 42 -9.733 32.194 -19.366 323 HG3 GLU 42 3HG GLU 42 -10.850 32.810 -18.161 324 H VAL 43 H VAL 43 -14.664 31.795 -20.636 325 HA VAL 43 HA VAL 43 -15.694 28.972 -20.761 326 HB VAL 43 HB VAL 43 -17.320 31.463 -21.259 327 HG11 VAL 43 1HG1 VAL 43 -18.033 29.439 -22.536 328 HG12 VAL 43 2HG1 VAL 43 -18.158 28.551 -21.003 329 HG13 VAL 43 3HG1 VAL 43 -19.200 29.956 -21.335 330 HG21 VAL 43 3HG2 VAL 43 -18.448 31.067 -19.201 331 HG22 VAL 43 1HG2 VAL 43 -17.492 29.597 -18.870 332 HG23 VAL 43 2HG2 VAL 43 -16.747 31.209 -18.822 333 HA PRO 44 HA PRO 44 -14.471 29.565 -25.116 334 HB2 PRO 44 2HB PRO 44 -14.636 26.601 -25.154 335 HB3 PRO 44 3HB PRO 44 -13.314 27.666 -25.695 336 HG2 PRO 44 2HG PRO 44 -13.140 26.184 -23.391 337 HG3 PRO 44 3HG PRO 44 -12.431 27.825 -23.501 338 HD2 PRO 44 2HD PRO 44 -15.088 27.011 -22.294 339 HD3 PRO 44 3HD PRO 44 -13.837 28.138 -21.673 340 H PHE 45 H PHE 45 -16.000 30.098 -26.434 341 HA PHE 45 HA PHE 45 -18.512 28.499 -26.804 342 HB2 PHE 45 2HB PHE 45 -17.762 31.369 -27.414 343 HB3 PHE 45 3HB PHE 45 -19.160 30.628 -28.124 344 HD1 PHE 45 HD1 PHE 45 -17.597 31.751 -24.931 345 HD2 PHE 45 HD2 PHE 45 -21.166 30.173 -26.795 346 HE1 PHE 45 HE1 PHE 45 -18.905 32.258 -22.897 347 HE2 PHE 45 HE2 PHE 45 -22.459 30.682 -24.730 348 HZ PHE 45 HZ PHE 45 -21.311 31.725 -22.773 349 H ALA 46 H ALA 46 -19.062 27.743 -28.843 350 HA ALA 46 HA ALA 46 -16.882 27.511 -30.844 351 HB1 ALA 46 3HB ALA 46 -18.393 25.908 -31.935 352 HB2 ALA 46 1HB ALA 46 -18.171 25.494 -30.225 353 HB3 ALA 46 2HB ALA 46 -19.673 26.283 -30.761 354 H ASP 47 H ASP 47 -17.257 28.109 -33.095 355 HA ASP 47 HA ASP 47 -18.306 30.686 -33.522 356 HB2 ASP 47 2HB ASP 47 -16.565 29.600 -34.866 357 HB3 ASP 47 3HB ASP 47 -17.744 28.451 -35.507 358 H ASP 48 H ASP 48 -20.049 27.691 -33.494 359 HA ASP 48 HA ASP 48 -22.410 28.551 -34.970 360 HB2 ASP 48 2HB ASP 48 -21.662 26.186 -34.631 361 HB3 ASP 48 3HB ASP 48 -22.038 26.345 -32.916 362 H ALA 49 H ALA 49 -21.176 29.375 -31.904 363 HA ALA 49 HA ALA 49 -23.809 30.355 -30.880 364 HB1 ALA 49 3HB ALA 49 -22.915 30.014 -28.630 365 HB2 ALA 49 1HB ALA 49 -22.887 28.489 -29.537 366 HB3 ALA 49 2HB ALA 49 -21.383 29.414 -29.302 367 H GLU 50 H GLU 50 -23.691 32.297 -29.562 368 HA GLU 50 HA GLU 50 -21.306 34.042 -29.944 369 HB2 GLU 50 2HB GLU 50 -24.194 34.796 -30.507 370 HB3 GLU 50 3HB GLU 50 -22.946 35.992 -30.125 371 HG2 GLU 50 2HG GLU 50 -21.588 35.278 -32.029 372 HG3 GLU 50 3HG GLU 50 -22.747 34.010 -32.417 373 H ILE 51 H ILE 51 -20.758 35.202 -28.271 374 HA ILE 51 HA ILE 51 -21.181 34.363 -25.705 375 HB ILE 51 HB ILE 51 -20.277 37.179 -26.313 376 HG12 ILE 51 2HG1 ILE 51 -19.089 35.760 -27.914 377 HG13 ILE 51 3HG1 ILE 51 -18.015 36.421 -26.689 378 HG21 ILE 51 1HG2 ILE 51 -20.502 36.555 -23.897 379 HG22 ILE 51 2HG2 ILE 51 -19.421 35.180 -24.174 380 HG23 ILE 51 3HG2 ILE 51 -18.820 36.820 -24.383 381 HD11 ILE 51 3HD1 ILE 51 -17.453 34.108 -27.238 382 HD12 ILE 51 1HD1 ILE 51 -17.967 34.206 -25.556 383 HD13 ILE 51 2HD1 ILE 51 -19.083 33.575 -26.796 384 HA PRO 52 HA PRO 52 -24.966 36.681 -24.616 385 HB2 PRO 52 2HB PRO 52 -25.590 35.184 -22.427 386 HB3 PRO 52 3HB PRO 52 -25.958 34.653 -24.098 387 HG2 PRO 52 2HG PRO 52 -23.664 33.833 -22.312 388 HG3 PRO 52 3HG PRO 52 -24.677 32.808 -23.389 389 HD2 PRO 52 2HD PRO 52 -22.156 33.827 -24.026 390 HD3 PRO 52 3HD PRO 52 -23.356 33.371 -25.242 391 H GLY 53 H GLY 53 -25.235 38.224 -23.030 392 HA2 GLY 53 HA2 GLY 53 -23.143 39.584 -21.868 393 HA3 GLY 53 HA3 GLY 53 -24.811 39.668 -21.292 394 H THR 54 H THR 54 -24.847 36.833 -20.354 395 HA THR 54 HA THR 54 -22.655 36.725 -18.420 396 HB THR 54 HB THR 54 -24.276 36.110 -16.561 397 HG1 THR 54 HG1 THR 54 -26.502 36.430 -16.936 398 HG21 THR 54 1HG2 THR 54 -25.296 38.223 -16.057 399 HG22 THR 54 2HG2 THR 54 -23.757 38.558 -16.846 400 HG23 THR 54 3HG2 THR 54 -25.255 38.731 -17.762 401 H TRP 55 H TRP 55 -22.449 34.607 -17.305 402 HA TRP 55 HA TRP 55 -23.755 32.270 -18.486 403 HB2 TRP 55 2HB TRP 55 -21.955 32.991 -20.135 404 HB3 TRP 55 3HB TRP 55 -20.772 32.653 -18.882 405 HD1 TRP 55 HD1 TRP 55 -20.211 30.160 -18.357 406 HE1 TRP 55 HE1 TRP 55 -20.513 27.989 -19.656 407 HE3 TRP 55 HE3 TRP 55 -23.835 31.694 -21.591 408 HZ2 TRP 55 HZ2 TRP 55 -22.288 26.961 -21.717 409 HZ3 TRP 55 HZ3 TRP 55 -24.867 30.087 -23.195 410 HH2 TRP 55 HH2 TRP 55 -24.090 27.728 -23.272 411 H LEU 56 H LEU 56 -23.359 30.321 -17.277 412 HA LEU 56 HA LEU 56 -22.732 30.759 -14.501 413 HB2 LEU 56 2HB LEU 56 -24.258 28.943 -15.952 414 HB3 LEU 56 3HB LEU 56 -22.891 27.965 -15.418 415 HG LEU 56 HG LEU 56 -24.615 29.657 -13.567 416 HD11 LEU 56 1HD1 LEU 56 -25.674 27.533 -12.901 417 HD12 LEU 56 2HD1 LEU 56 -25.945 27.867 -14.618 418 HD13 LEU 56 3HD1 LEU 56 -24.729 26.663 -14.132 419 HD21 LEU 56 3HD2 LEU 56 -23.645 28.213 -11.792 420 HD22 LEU 56 1HD2 LEU 56 -22.597 27.437 -13.004 421 HD23 LEU 56 2HD2 LEU 56 -22.400 29.155 -12.617 422 H CYS 57 H CYS 57 -20.891 30.553 -13.439 423 HA CYS 57 HA CYS 57 -18.444 29.667 -14.871 424 HB2 CYS 57 2HB CYS 57 -18.961 31.330 -12.382 425 HB3 CYS 57 3HB CYS 57 -17.347 30.813 -12.884 426 HG CYS 57 HG CYS 57 -19.547 32.355 -14.810 427 H ARG 58 H ARG 58 -16.757 28.528 -13.640 428 HA ARG 58 HA ARG 58 -17.802 26.038 -12.683 429 HB2 ARG 58 2HB ARG 58 -14.917 26.984 -12.553 430 HB3 ARG 58 3HB ARG 58 -15.496 25.327 -12.454 431 HG2 ARG 58 2HG ARG 58 -16.397 25.550 -14.809 432 HG3 ARG 58 3HG ARG 58 -15.672 27.164 -14.883 433 HD2 ARG 58 2HD ARG 58 -14.171 25.661 -15.964 434 HD3 ARG 58 3HD ARG 58 -13.433 26.169 -14.435 435 HE ARG 58 HE ARG 58 -14.914 23.706 -14.107 436 HH11 ARG 58 1HH1 ARG 58 -11.872 24.824 -15.441 437 HH12 ARG 58 2HH1 ARG 58 -11.100 23.278 -15.211 438 HH21 ARG 58 1HH2 ARG 58 -13.866 21.766 -13.835 439 HH22 ARG 58 2HH2 ARG 58 -12.207 21.596 -14.332 440 H ASN 59 H ASN 59 -17.092 28.873 -10.853 441 HA ASN 59 HA ASN 59 -16.782 27.598 -8.297 442 HB2 ASN 59 2HB ASN 59 -16.175 29.899 -8.648 443 HB3 ASN 59 3HB ASN 59 -17.830 30.316 -9.115 444 HD21 ASN 59 1HD2 ASN 59 -17.724 32.013 -7.493 445 HD22 ASN 59 2HD2 ASN 59 -17.869 31.597 -5.817 446 H GLY 60 H GLY 60 -19.486 27.967 -10.409 447 HA2 GLY 60 HA2 GLY 60 -21.560 26.834 -10.237 448 HA3 GLY 60 HA3 GLY 60 -21.411 26.761 -8.479 449 H MET 61 H MET 61 -20.669 29.834 -9.893 450 HA MET 61 HA MET 61 -23.353 30.944 -9.216 451 HB2 MET 61 2HB MET 61 -21.441 31.600 -7.703 452 HB3 MET 61 3HB MET 61 -20.661 32.336 -9.091 453 HG2 MET 61 2HG MET 61 -21.844 34.001 -7.730 454 HG3 MET 61 3HG MET 61 -22.515 33.914 -9.356 455 HE1 MET 61 3HE MET 61 -24.124 35.496 -7.199 456 HE2 MET 61 1HE MET 61 -24.659 35.172 -8.866 457 HE3 MET 61 2HE MET 61 -25.750 34.855 -7.499 458 H GLU 62 H GLU 62 -24.344 32.289 -10.689 459 HA GLU 62 HA GLU 62 -23.603 32.426 -13.428 460 HB2 GLU 62 2HB GLU 62 -25.331 34.369 -11.840 461 HB3 GLU 62 3HB GLU 62 -25.202 34.259 -13.593 462 HG2 GLU 62 2HG GLU 62 -27.076 33.027 -13.357 463 HG3 GLU 62 3HG GLU 62 -25.918 31.719 -13.182 464 H GLY 63 H GLY 63 -21.789 33.245 -14.198 465 HA2 GLY 63 HA2 GLY 63 -20.436 35.548 -12.979 466 HA3 GLY 63 HA3 GLY 63 -19.817 34.567 -14.287 467 H THR 64 H THR 64 -20.160 37.541 -14.034 468 HA THR 64 HA THR 64 -21.793 37.995 -16.490 469 HB THR 64 HB THR 64 -20.652 40.020 -14.536 470 HG1 THR 64 HG1 THR 64 -22.782 40.218 -13.848 471 HG21 THR 64 1HG2 THR 64 -22.342 41.574 -15.667 472 HG22 THR 64 2HG2 THR 64 -20.944 41.139 -16.652 473 HG23 THR 64 3HG2 THR 64 -22.504 40.350 -16.947 474 H LEU 65 H LEU 65 -20.961 38.858 -18.336 475 HA LEU 65 HA LEU 65 -18.319 38.175 -19.010 476 HB2 LEU 65 2HB LEU 65 -20.355 38.313 -20.463 477 HB3 LEU 65 3HB LEU 65 -20.293 40.065 -20.351 478 HG LEU 65 HG LEU 65 -17.911 39.827 -21.441 479 HD11 LEU 65 1HD1 LEU 65 -17.623 37.433 -21.047 480 HD12 LEU 65 2HD1 LEU 65 -19.027 37.087 -22.051 481 HD13 LEU 65 3HD1 LEU 65 -17.571 37.843 -22.763 482 HD21 LEU 65 3HD2 LEU 65 -20.395 38.972 -22.993 483 HD22 LEU 65 1HD2 LEU 65 -19.905 40.648 -22.660 484 HD23 LEU 65 2HD2 LEU 65 -18.898 39.627 -23.697 485 H ILE 66 H ILE 66 -16.421 39.150 -18.652 486 HA ILE 66 HA ILE 66 -16.257 42.118 -18.431 487 HB ILE 66 HB ILE 66 -14.619 42.045 -16.727 488 HG12 ILE 66 2HG1 ILE 66 -13.386 40.029 -17.035 489 HG13 ILE 66 3HG1 ILE 66 -14.041 40.028 -15.399 490 HG21 ILE 66 1HG2 ILE 66 -15.934 41.433 -14.809 491 HG22 ILE 66 2HG2 ILE 66 -16.964 42.179 -16.047 492 HG23 ILE 66 3HG2 ILE 66 -16.999 40.425 -15.799 493 HD11 ILE 66 3HD1 ILE 66 -15.874 38.528 -16.269 494 HD12 ILE 66 1HD1 ILE 66 -14.837 38.369 -17.713 495 HD13 ILE 66 2HD1 ILE 66 -14.234 37.853 -16.130 496 H GLU 67 H GLU 67 -14.252 43.080 -18.953 497 HA GLU 67 HA GLU 67 -12.720 41.716 -21.068 498 HB2 GLU 67 2HB GLU 67 -12.468 44.488 -19.841 499 HB3 GLU 67 3HB GLU 67 -11.469 43.865 -21.160 500 HG2 GLU 67 2HG GLU 67 -13.481 43.568 -22.572 501 HG3 GLU 67 3HG GLU 67 -14.500 44.190 -21.272 502 H GLY 68 H GLY 68 -10.583 41.131 -20.955 503 HA2 GLY 68 HA2 GLY 68 -8.640 41.705 -19.070 504 HA3 GLY 68 HA3 GLY 68 -9.477 40.295 -18.403 505 H ASP 69 H ASP 69 -10.076 38.955 -20.828 506 HA ASP 69 HA ASP 69 -7.727 38.850 -22.550 507 HB2 ASP 69 2HB ASP 69 -7.164 37.143 -20.835 508 HB3 ASP 69 3HB ASP 69 -8.698 36.325 -21.146 509 H LEU 70 H LEU 70 -8.444 38.781 -24.577 510 HA LEU 70 HA LEU 70 -11.293 38.060 -25.140 511 HB2 LEU 70 2HB LEU 70 -9.570 40.398 -26.000 512 HB3 LEU 70 3HB LEU 70 -10.855 39.819 -27.039 513 HG LEU 70 HG LEU 70 -12.539 40.209 -25.286 514 HD11 LEU 70 1HD1 LEU 70 -10.212 41.419 -23.732 515 HD12 LEU 70 2HD1 LEU 70 -11.926 41.764 -23.399 516 HD13 LEU 70 3HD1 LEU 70 -11.321 40.121 -23.208 517 HD21 LEU 70 3HD2 LEU 70 -12.027 41.897 -27.017 518 HD22 LEU 70 1HD2 LEU 70 -12.516 42.658 -25.498 519 HD23 LEU 70 2HD2 LEU 70 -10.798 42.619 -25.954 520 HA PRO 71 HA PRO 71 -9.628 35.411 -28.327 521 HB2 PRO 71 2HB PRO 71 -11.833 34.794 -29.763 522 HB3 PRO 71 3HB PRO 71 -11.713 34.413 -28.023 523 HG2 PRO 71 2HG PRO 71 -13.037 36.844 -29.282 524 HG3 PRO 71 3HG PRO 71 -13.746 35.694 -28.102 525 HD2 PRO 71 2HD PRO 71 -12.574 38.058 -27.347 526 HD3 PRO 71 3HD PRO 71 -12.512 36.592 -26.333 527 H GLU 72 H GLU 72 -8.874 38.046 -28.762 528 HA GLU 72 HA GLU 72 -8.737 39.900 -30.127 529 HB2 GLU 72 2HB GLU 72 -7.689 37.537 -31.669 530 HB3 GLU 72 3HB GLU 72 -7.413 39.219 -32.180 531 HG2 GLU 72 2HG GLU 72 -6.339 39.704 -30.004 532 HG3 GLU 72 3HG GLU 72 -6.567 38.023 -29.512 533 HA PRO 73 HA PRO 73 -12.624 39.354 -32.711 534 HB2 PRO 73 2HB PRO 73 -14.148 41.315 -31.544 535 HB3 PRO 73 3HB PRO 73 -14.084 39.628 -30.946 536 HG2 PRO 73 2HG PRO 73 -12.513 42.021 -29.933 537 HG3 PRO 73 3HG PRO 73 -13.438 40.810 -28.985 538 HD2 PRO 73 2HD PRO 73 -10.749 40.617 -29.314 539 HD3 PRO 73 3HD PRO 73 -11.790 39.161 -29.297 540 H LYS 74 H LYS 74 -12.936 40.577 -34.491 541 HA LYS 74 HA LYS 74 -12.058 41.689 -36.261 542 HB2 LYS 74 2HB LYS 74 -12.467 44.048 -36.330 543 HB3 LYS 74 3HB LYS 74 -13.777 43.206 -35.516 544 HG2 LYS 74 2HG LYS 74 -13.033 44.015 -33.331 545 HG3 LYS 74 3HG LYS 74 -11.556 44.681 -34.039 546 HD2 LYS 74 2HD LYS 74 -13.037 46.499 -33.660 547 HD3 LYS 74 3HD LYS 74 -12.972 46.248 -35.411 548 HE2 LYS 74 2HE LYS 74 -15.125 44.989 -35.292 549 HE3 LYS 74 3HE LYS 74 -15.157 45.206 -33.537 550 HZ1 LYS 74 HZ1 LYS 74 -15.264 47.412 -35.530 551 HZ2 LYS 74 HZ2 LYS 74 -16.530 46.863 -34.660 552 HZ3 LYS 74 HZ3 LYS 74 -15.293 47.614 -33.906 553 H LYS 75 H LYS 75 -9.965 40.690 -34.583 554 HA LYS 75 HA LYS 75 -7.800 40.848 -33.992 555 HB2 LYS 75 2HB LYS 75 -7.912 40.982 -36.680 556 HB3 LYS 75 3HB LYS 75 -7.045 42.480 -36.401 557 HG2 LYS 75 2HG LYS 75 -6.247 39.710 -35.366 558 HG3 LYS 75 3HG LYS 75 -5.627 40.463 -36.836 559 HD2 LYS 75 2HD LYS 75 -4.715 42.350 -35.436 560 HD3 LYS 75 3HD LYS 75 -5.159 41.436 -33.987 561 HE2 LYS 75 2HE LYS 75 -3.243 40.508 -36.175 562 HE3 LYS 75 3HE LYS 75 -2.773 41.188 -34.615 563 HZ1 LYS 75 HZ1 LYS 75 -2.691 38.803 -34.490 564 HZ2 LYS 75 HZ2 LYS 75 -3.925 39.297 -33.536 565 HZ3 LYS 75 HZ3 LYS 75 -4.232 38.634 -35.000 566 H VAL 76 H VAL 76 -9.378 42.641 -32.740 567 HA VAL 76 HA VAL 76 -9.496 44.425 -31.439 568 HB VAL 76 HB VAL 76 -6.506 44.430 -31.057 569 HG11 VAL 76 1HG1 VAL 76 -7.925 45.952 -29.641 570 HG12 VAL 76 2HG1 VAL 76 -8.874 44.551 -29.117 571 HG13 VAL 76 3HG1 VAL 76 -7.156 44.692 -28.685 572 HG21 VAL 76 3HG2 VAL 76 -6.784 42.521 -29.466 573 HG22 VAL 76 1HG2 VAL 76 -8.434 42.278 -30.080 574 HG23 VAL 76 2HG2 VAL 76 -7.020 42.036 -31.139 575 H LYS 77 H LYS 77 -9.314 45.137 -34.241 576 HA LYS 77 HA LYS 77 -7.834 47.584 -34.522 577 HB2 LYS 77 2HB LYS 77 -10.123 46.319 -36.064 578 HB3 LYS 77 3HB LYS 77 -9.503 47.905 -36.498 579 HG2 LYS 77 2HG LYS 77 -7.164 46.877 -36.579 580 HG3 LYS 77 3HG LYS 77 -7.934 45.297 -36.477 581 HD2 LYS 77 2HD LYS 77 -8.346 47.422 -38.631 582 HD3 LYS 77 3HD LYS 77 -7.404 45.950 -38.809 583 HE2 LYS 77 2HE LYS 77 -10.423 46.083 -38.359 584 HE3 LYS 77 3HE LYS 77 -9.623 45.837 -39.912 585 HZ1 LYS 77 HZ1 LYS 77 -10.286 43.724 -38.996 586 HZ2 LYS 77 HZ2 LYS 77 -8.655 43.777 -38.998 587 HZ3 LYS 77 HZ3 LYS 77 -9.486 43.989 -37.593 588 HA PRO 78 HA PRO 78 -8.740 49.839 -36.060 589 HB2 PRO 78 2HB PRO 78 -8.284 52.244 -34.317 590 HB3 PRO 78 3HB PRO 78 -8.724 52.167 -36.050 591 HG2 PRO 78 2HG PRO 78 -10.614 52.741 -34.216 592 HG3 PRO 78 3HG PRO 78 -10.985 51.560 -35.521 593 HD2 PRO 78 2HD PRO 78 -10.087 50.987 -32.673 594 HD3 PRO 78 3HD PRO 78 -11.468 50.293 -33.574 595 HA PRO 79 HA PRO 79 -4.488 48.995 -35.123 596 HB2 PRO 79 2HB PRO 79 -3.756 51.459 -36.711 597 HB3 PRO 79 3HB PRO 79 -3.070 49.805 -36.813 598 HG2 PRO 79 2HG PRO 79 -4.880 50.614 -38.645 599 HG3 PRO 79 3HG PRO 79 -5.042 48.983 -37.910 600 HD2 PRO 79 2HD PRO 79 -6.511 51.532 -37.170 601 HD3 PRO 79 3HD PRO 79 -7.158 49.884 -37.434 602 H ARG 80 H ARG 80 -2.658 49.575 -33.884 603 HA ARG 80 HA ARG 80 -2.983 51.918 -32.052 604 HB2 ARG 80 2HB ARG 80 -2.527 49.047 -31.144 605 HB3 ARG 80 3HB ARG 80 -2.787 50.472 -30.129 606 HG2 ARG 80 2HG ARG 80 -5.094 50.697 -31.146 607 HG3 ARG 80 3HG ARG 80 -4.789 49.183 -32.021 608 HD2 ARG 80 2HD ARG 80 -4.495 48.004 -29.859 609 HD3 ARG 80 3HD ARG 80 -4.977 49.483 -29.014 610 HE ARG 80 HE ARG 80 -6.658 47.799 -30.841 611 HH11 ARG 80 1HH1 ARG 80 -6.669 50.514 -28.611 612 HH12 ARG 80 2HH1 ARG 80 -8.404 50.657 -28.699 613 HH21 ARG 80 1HH2 ARG 80 -8.743 48.036 -30.914 614 HH22 ARG 80 2HH2 ARG 80 -9.580 49.250 -29.963 Start of MODEL 18 1 H1 SER 1 1H SER 1 -10.615 -2.229 -14.678 2 H2 SER 1 2H SER 1 -9.264 -1.348 -14.393 3 H3 SER 1 3H SER 1 -10.505 -0.690 -15.240 4 HA SER 1 HA SER 1 -11.930 -0.793 -13.298 5 HB2 SER 1 2HB SER 1 -10.812 -1.282 -11.096 6 HB3 SER 1 3HB SER 1 -10.976 -2.683 -12.164 7 HG SER 1 HG SER 1 -8.876 -2.523 -11.239 8 H MET 2 H MET 2 -11.908 0.905 -11.590 9 HA MET 2 HA MET 2 -10.690 3.304 -12.606 10 HB2 MET 2 2HB MET 2 -11.785 4.399 -10.714 11 HB3 MET 2 3HB MET 2 -12.887 3.401 -11.649 12 HG2 MET 2 2HG MET 2 -11.565 2.258 -9.166 13 HG3 MET 2 3HG MET 2 -12.888 3.395 -8.996 14 HE1 MET 2 3HE MET 2 -15.054 2.813 -11.145 15 HE2 MET 2 1HE MET 2 -16.016 1.582 -10.306 16 HE3 MET 2 2HE MET 2 -15.366 2.964 -9.400 17 H ALA 3 H ALA 3 -9.232 4.710 -11.677 18 HA ALA 3 HA ALA 3 -7.221 5.286 -10.892 19 HB1 ALA 3 3HB ALA 3 -8.182 3.946 -8.345 20 HB2 ALA 3 1HB ALA 3 -6.967 5.234 -8.480 21 HB3 ALA 3 2HB ALA 3 -8.654 5.565 -8.910 22 H ASP 4 H ASP 4 -7.245 2.572 -12.196 23 HA ASP 4 HA ASP 4 -5.182 0.995 -10.916 24 HB2 ASP 4 2HB ASP 4 -6.901 -0.016 -12.296 25 HB3 ASP 4 3HB ASP 4 -6.393 0.926 -13.700 26 H ARG 5 H ARG 5 -3.397 2.209 -10.552 27 HA ARG 5 HA ARG 5 -1.719 3.128 -12.853 28 HB2 ARG 5 2HB ARG 5 -2.350 4.702 -10.316 29 HB3 ARG 5 3HB ARG 5 -1.191 5.183 -11.557 30 HG2 ARG 5 2HG ARG 5 -3.007 5.323 -13.235 31 HG3 ARG 5 3HG ARG 5 -4.200 4.893 -12.003 32 HD2 ARG 5 2HD ARG 5 -2.404 7.339 -11.910 33 HD3 ARG 5 3HD ARG 5 -4.092 7.321 -12.451 34 HE ARG 5 HE ARG 5 -3.942 6.177 -9.835 35 HH11 ARG 5 1HH2 ARG 5 -3.791 9.344 -11.338 36 HH12 ARG 5 2HH2 ARG 5 -4.265 10.155 -9.875 37 HH21 ARG 5 1HH1 ARG 5 -4.547 7.282 -8.008 38 HH22 ARG 5 2HH1 ARG 5 -4.706 9.013 -8.052 39 H VAL 6 H VAL 6 0.529 3.445 -12.302 40 HA VAL 6 HA VAL 6 1.517 1.330 -10.518 41 HB VAL 6 HB VAL 6 3.203 3.124 -12.290 42 HG11 VAL 6 1HG1 VAL 6 4.746 1.186 -12.239 43 HG12 VAL 6 2HG1 VAL 6 4.451 1.759 -10.598 44 HG13 VAL 6 3HG1 VAL 6 3.627 0.300 -11.183 45 HG21 VAL 6 3HG2 VAL 6 1.842 0.480 -12.970 46 HG22 VAL 6 1HG2 VAL 6 1.550 2.053 -13.749 47 HG23 VAL 6 2HG2 VAL 6 3.109 1.259 -13.943 48 H LEU 7 H LEU 7 0.448 2.701 -8.794 49 HA LEU 7 HA LEU 7 0.488 3.908 -6.906 50 HB2 LEU 7 2HB LEU 7 3.475 3.406 -6.960 51 HB3 LEU 7 3HB LEU 7 2.504 3.783 -5.543 52 HG LEU 7 HG LEU 7 2.295 1.236 -7.208 53 HD11 LEU 7 1HD1 LEU 7 3.353 1.729 -4.396 54 HD12 LEU 7 2HD1 LEU 7 3.233 0.156 -5.219 55 HD13 LEU 7 3HD1 LEU 7 4.338 1.395 -5.837 56 HD21 LEU 7 3HD2 LEU 7 0.096 1.766 -6.244 57 HD22 LEU 7 1HD2 LEU 7 0.833 0.423 -5.367 58 HD23 LEU 7 2HD2 LEU 7 0.839 2.051 -4.652 59 H ARG 8 H ARG 8 1.317 5.483 -9.507 60 HA ARG 8 HA ARG 8 1.501 8.115 -8.176 61 HB2 ARG 8 2HB ARG 8 3.846 7.276 -8.513 62 HB3 ARG 8 3HB ARG 8 3.546 7.177 -10.247 63 HG2 ARG 8 2HG ARG 8 3.206 9.614 -10.358 64 HG3 ARG 8 3HG ARG 8 3.377 9.750 -8.600 65 HD2 ARG 8 2HD ARG 8 5.532 8.722 -10.495 66 HD3 ARG 8 3HD ARG 8 5.421 10.390 -9.909 67 HE ARG 8 HE ARG 8 5.421 8.791 -7.609 68 HH11 ARG 8 1HH2 ARG 8 7.704 9.410 -10.195 69 HH12 ARG 8 2HH2 ARG 8 9.081 9.071 -9.181 70 HH21 ARG 8 1HH1 ARG 8 7.219 8.368 -6.376 71 HH22 ARG 8 2HH1 ARG 8 8.806 8.501 -7.077 72 H GLY 9 H GLY 9 0.610 9.764 -9.372 73 HA2 GLY 9 HA2 GLY 9 0.130 9.731 -12.206 74 HA3 GLY 9 HA3 GLY 9 -1.318 9.190 -11.356 75 H SER 10 H SER 10 0.925 11.702 -10.166 76 HA SER 10 HA SER 10 -1.175 13.368 -9.289 77 HB2 SER 10 2HB SER 10 1.174 13.259 -8.424 78 HB3 SER 10 3HB SER 10 1.704 14.180 -9.844 79 HG SER 10 HG SER 10 1.294 15.502 -7.987 80 H ARG 11 H ARG 11 0.472 13.404 -12.402 81 HA ARG 11 HA ARG 11 -0.530 16.012 -13.267 82 HB2 ARG 11 2HB ARG 11 0.732 13.712 -14.816 83 HB3 ARG 11 3HB ARG 11 0.358 15.306 -15.487 84 HG2 ARG 11 2HG ARG 11 1.850 16.361 -13.776 85 HG3 ARG 11 3HG ARG 11 2.334 14.751 -13.229 86 HD2 ARG 11 2HD ARG 11 2.691 15.853 -16.050 87 HD3 ARG 11 3HD ARG 11 3.953 15.799 -14.830 88 HE ARG 11 HE ARG 11 2.904 13.565 -16.428 89 HH11 ARG 11 1HH1 ARG 11 4.865 14.339 -13.626 90 HH12 ARG 11 2HH1 ARG 11 5.663 12.790 -13.649 91 HH21 ARG 11 1HH2 ARG 11 3.954 11.616 -16.392 92 HH22 ARG 11 2HH2 ARG 11 5.153 11.293 -15.175 93 H LEU 12 H LEU 12 -2.096 13.078 -12.940 94 HA LEU 12 HA LEU 12 -3.969 12.118 -13.583 95 HB2 LEU 12 2HB LEU 12 -4.949 14.185 -12.886 96 HB3 LEU 12 3HB LEU 12 -4.828 14.878 -14.494 97 HG LEU 12 HG LEU 12 -6.351 12.288 -14.171 98 HD11 LEU 12 1HD1 LEU 12 -7.449 15.033 -13.433 99 HD12 LEU 12 2HD1 LEU 12 -8.402 13.540 -13.604 100 HD13 LEU 12 3HD1 LEU 12 -7.189 13.670 -12.321 101 HD21 LEU 12 3HD2 LEU 12 -6.879 14.800 -15.835 102 HD22 LEU 12 1HD2 LEU 12 -6.075 13.344 -16.440 103 HD23 LEU 12 2HD2 LEU 12 -7.761 13.261 -15.932 104 H GLY 13 H GLY 13 -4.456 10.673 -15.053 105 HA2 GLY 13 HA2 GLY 13 -3.126 10.753 -17.668 106 HA3 GLY 13 HA3 GLY 13 -3.971 9.391 -16.948 107 H ALA 14 H ALA 14 -4.061 10.669 -19.648 108 HA ALA 14 HA ALA 14 -5.460 11.174 -21.330 109 HB1 ALA 14 3HB ALA 14 -6.306 8.936 -20.663 110 HB2 ALA 14 1HB ALA 14 -7.574 9.725 -19.700 111 HB3 ALA 14 2HB ALA 14 -7.526 9.933 -21.462 112 H VAL 15 H VAL 15 -8.034 11.909 -21.717 113 HA VAL 15 HA VAL 15 -8.498 14.418 -20.184 114 HB VAL 15 HB VAL 15 -9.014 15.541 -22.320 115 HG11 VAL 15 1HG1 VAL 15 -6.137 14.559 -22.221 116 HG12 VAL 15 2HG1 VAL 15 -6.738 16.057 -22.962 117 HG13 VAL 15 3HG1 VAL 15 -6.817 15.848 -21.205 118 HG21 VAL 15 3HG2 VAL 15 -7.656 13.187 -23.699 119 HG22 VAL 15 1HG2 VAL 15 -9.389 13.584 -23.789 120 HG23 VAL 15 2HG2 VAL 15 -8.190 14.696 -24.455 121 H SER 16 H SER 16 -10.560 15.274 -20.305 122 HA SER 16 HA SER 16 -12.730 13.287 -20.856 123 HB2 SER 16 2HB SER 16 -12.625 15.447 -18.725 124 HB3 SER 16 3HB SER 16 -13.902 14.244 -18.952 125 HG SER 16 HG SER 16 -12.415 12.610 -18.442 126 H TYR 17 H TYR 17 -11.562 15.587 -22.531 127 HA TYR 17 HA TYR 17 -14.013 16.964 -23.399 128 HB2 TYR 17 2HB TYR 17 -12.807 19.194 -23.006 129 HB3 TYR 17 3HB TYR 17 -13.461 18.393 -21.593 130 HD1 TYR 17 HD1 TYR 17 -10.279 19.062 -23.451 131 HD2 TYR 17 HD2 TYR 17 -12.073 17.684 -19.774 132 HE1 TYR 17 HE1 TYR 17 -8.044 19.034 -22.372 133 HE2 TYR 17 HE2 TYR 17 -9.825 17.636 -18.700 134 HH TYR 17 HH TYR 17 -6.854 18.618 -20.452 135 H GLU 18 H GLU 18 -13.722 18.236 -25.273 136 HA GLU 18 HA GLU 18 -12.351 16.902 -27.284 137 HB2 GLU 18 2HB GLU 18 -13.335 19.778 -27.397 138 HB3 GLU 18 3HB GLU 18 -12.935 18.733 -28.757 139 HG2 GLU 18 2HG GLU 18 -15.174 18.406 -28.770 140 HG3 GLU 18 3HG GLU 18 -14.758 17.117 -27.653 141 H THR 19 H THR 19 -10.278 16.629 -27.493 142 HA THR 19 HA THR 19 -8.362 18.938 -27.269 143 HB THR 19 HB THR 19 -7.898 16.072 -26.363 144 HG1 THR 19 HG1 THR 19 -9.290 17.149 -24.980 145 HG21 THR 19 1HG2 THR 19 -5.883 17.037 -25.274 146 HG22 THR 19 2HG2 THR 19 -5.804 17.182 -27.034 147 HG23 THR 19 3HG2 THR 19 -6.218 18.603 -26.046 148 H ASP 20 H ASP 20 -7.317 19.314 -29.131 149 HA ASP 20 HA ASP 20 -7.541 17.571 -31.382 150 HB2 ASP 20 2HB ASP 20 -6.286 19.198 -32.585 151 HB3 ASP 20 3HB ASP 20 -7.322 20.079 -31.476 152 H ARG 21 H ARG 21 -4.722 15.605 -31.648 153 HA ARG 21 HA ARG 21 -6.714 17.042 -33.312 154 HB2 ARG 21 2HB ARG 21 -4.444 15.119 -33.794 155 HB3 ARG 21 3HB ARG 21 -5.783 15.130 -34.923 156 HG2 ARG 21 2HG ARG 21 -4.193 16.623 -35.822 157 HG3 ARG 21 3HG ARG 21 -5.547 17.585 -35.241 158 HD2 ARG 21 2HD ARG 21 -3.555 18.745 -34.639 159 HD3 ARG 21 3HD ARG 21 -4.226 18.076 -33.156 160 HE ARG 21 HE ARG 21 -2.159 16.457 -34.516 161 HH11 ARG 21 1HH2 ARG 21 -2.737 18.816 -31.932 162 HH12 ARG 21 2HH2 ARG 21 -1.218 18.424 -31.169 163 HH21 ARG 21 2HH1 ARG 21 -0.267 16.037 -33.443 164 HH22 ARG 21 1HH1 ARG 21 0.130 16.911 -31.993 165 H ASN 22 H ASN 22 -7.165 14.942 -30.941 166 HA ASN 22 HA ASN 22 -9.029 13.065 -32.208 167 HB2 ASN 22 2HB ASN 22 -7.565 12.640 -30.142 168 HB3 ASN 22 3HB ASN 22 -8.649 13.710 -29.257 169 HD21 ASN 22 1HD2 ASN 22 -8.723 11.584 -27.972 170 HD22 ASN 22 2HD2 ASN 22 -9.973 10.449 -28.461 171 H HIS 23 H HIS 23 -11.272 12.975 -31.151 172 HA HIS 23 HA HIS 23 -13.402 13.738 -31.014 173 HB2 HIS 23 2HB HIS 23 -12.222 16.262 -29.810 174 HB3 HIS 23 3HB HIS 23 -13.841 15.628 -29.578 175 HD2 HIS 23 HD2 HIS 23 -14.099 13.365 -28.039 176 HE1 HIS 23 HE1 HIS 23 -10.310 13.787 -26.123 177 HE2 HIS 23 HE2 HIS 23 -12.562 12.597 -26.041 178 H ASP 24 H ASP 24 -14.889 15.863 -31.388 179 HA ASP 24 HA ASP 24 -14.455 16.815 -34.145 180 HB2 ASP 24 2HB ASP 24 -16.552 17.579 -32.091 181 HB3 ASP 24 3HB ASP 24 -16.495 18.143 -33.753 182 H LEU 25 H LEU 25 -14.026 18.937 -34.707 183 HA LEU 25 HA LEU 25 -12.953 20.799 -32.644 184 HB2 LEU 25 2HB LEU 25 -11.465 19.815 -35.111 185 HB3 LEU 25 3HB LEU 25 -10.928 21.136 -34.082 186 HG LEU 25 HG LEU 25 -11.245 18.250 -33.133 187 HD11 LEU 25 1HD1 LEU 25 -8.729 19.781 -33.896 188 HD12 LEU 25 2HD1 LEU 25 -8.825 18.124 -33.248 189 HD13 LEU 25 3HD1 LEU 25 -9.486 18.482 -34.846 190 HD21 LEU 25 3HD2 LEU 25 -11.377 19.909 -31.283 191 HD22 LEU 25 1HD2 LEU 25 -9.883 18.976 -31.217 192 HD23 LEU 25 2HD2 LEU 25 -9.855 20.642 -31.837 193 H ALA 26 H ALA 26 -13.275 22.892 -33.061 194 HA ALA 26 HA ALA 26 -13.979 23.869 -35.756 195 HB1 ALA 26 3HB ALA 26 -16.048 24.945 -34.891 196 HB2 ALA 26 1HB ALA 26 -16.128 23.184 -34.726 197 HB3 ALA 26 2HB ALA 26 -15.778 24.196 -33.306 198 HA PRO 27 HA PRO 27 -11.968 27.625 -34.231 199 HB2 PRO 27 2HB PRO 27 -14.018 29.272 -35.640 200 HB3 PRO 27 3HB PRO 27 -12.242 29.268 -35.833 201 HG2 PRO 27 2HG PRO 27 -13.867 28.169 -37.728 202 HG3 PRO 27 3HG PRO 27 -12.316 27.380 -37.278 203 HD2 PRO 27 2HD PRO 27 -15.091 26.787 -36.191 204 HD3 PRO 27 3HD PRO 27 -13.906 25.641 -36.915 205 H ARG 28 H ARG 28 -12.262 29.165 -32.655 206 HA ARG 28 HA ARG 28 -14.839 29.241 -31.176 207 HB2 ARG 28 2HB ARG 28 -13.910 28.323 -29.172 208 HB3 ARG 28 3HB ARG 28 -13.615 27.232 -30.514 209 HG2 ARG 28 2HG ARG 28 -11.254 28.522 -30.624 210 HG3 ARG 28 3HG ARG 28 -11.682 28.955 -28.965 211 HD2 ARG 28 2HD ARG 28 -10.334 26.993 -28.892 212 HD3 ARG 28 3HD ARG 28 -11.981 26.483 -28.485 213 HE ARG 28 HE ARG 28 -11.966 26.028 -31.161 214 HH11 ARG 28 1HH1 ARG 28 -9.583 25.019 -28.791 215 HH12 ARG 28 2HH1 ARG 28 -9.032 23.708 -29.796 216 HH21 ARG 28 1HH2 ARG 28 -11.231 24.430 -32.362 217 HH22 ARG 28 2HH2 ARG 28 -9.941 23.379 -31.801 218 H GLN 29 H GLN 29 -14.765 30.452 -29.188 219 HA GLN 29 HA GLN 29 -13.221 33.004 -29.265 220 HB2 GLN 29 2HB GLN 29 -16.221 32.812 -28.768 221 HB3 GLN 29 3HB GLN 29 -15.242 34.254 -28.851 222 HG2 GLN 29 2HG GLN 29 -15.652 34.468 -31.052 223 HG3 GLN 29 3HG GLN 29 -14.971 32.873 -31.375 224 HE21 GLN 29 1HE2 GLN 29 -16.683 31.141 -30.127 225 HE22 GLN 29 2HE2 GLN 29 -18.262 31.259 -30.902 226 H ILE 30 H ILE 30 -12.272 33.081 -27.316 227 HA ILE 30 HA ILE 30 -13.443 31.737 -24.951 228 HB ILE 30 HB ILE 30 -10.824 33.257 -25.027 229 HG12 ILE 30 2HG1 ILE 30 -10.568 31.619 -26.760 230 HG13 ILE 30 3HG1 ILE 30 -9.657 31.132 -25.342 231 HG21 ILE 30 1HG2 ILE 30 -10.316 31.775 -23.090 232 HG22 ILE 30 2HG2 ILE 30 -11.714 32.811 -22.795 233 HG23 ILE 30 3HG2 ILE 30 -11.955 31.099 -23.185 234 HD11 ILE 30 3HD1 ILE 30 -12.316 29.957 -26.240 235 HD12 ILE 30 1HD1 ILE 30 -10.719 29.210 -26.392 236 HD13 ILE 30 2HD1 ILE 30 -11.407 29.473 -24.783 237 H ALA 31 H ALA 31 -15.017 32.897 -23.994 238 HA ALA 31 HA ALA 31 -14.584 35.796 -23.400 239 HB1 ALA 31 3HB ALA 31 -17.045 34.013 -23.222 240 HB2 ALA 31 1HB ALA 31 -16.951 35.664 -22.586 241 HB3 ALA 31 2HB ALA 31 -16.764 35.385 -24.322 242 H ARG 32 H ARG 32 -14.996 36.453 -21.155 243 HA ARG 32 HA ARG 32 -14.424 34.375 -19.084 244 HB2 ARG 32 2HB ARG 32 -12.982 36.986 -19.560 245 HB3 ARG 32 3HB ARG 32 -13.240 36.437 -17.900 246 HG2 ARG 32 2HG ARG 32 -12.116 34.385 -18.247 247 HG3 ARG 32 3HG ARG 32 -11.977 34.637 -19.983 248 HD2 ARG 32 2HD ARG 32 -9.896 35.380 -19.464 249 HD3 ARG 32 3HD ARG 32 -10.713 36.895 -19.088 250 HE ARG 32 HE ARG 32 -9.639 34.879 -17.189 251 HH11 ARG 32 1HH2 ARG 32 -11.211 38.040 -17.467 252 HH12 ARG 32 2HH2 ARG 32 -10.928 38.337 -15.745 253 HH21 ARG 32 2HH1 ARG 32 -9.279 35.520 -15.055 254 HH22 ARG 32 1HH1 ARG 32 -9.946 37.075 -14.546 255 H TYR 33 H TYR 33 -15.318 34.718 -17.107 256 HA TYR 33 HA TYR 33 -17.359 36.886 -16.890 257 HB2 TYR 33 2HB TYR 33 -17.963 33.952 -16.478 258 HB3 TYR 33 3HB TYR 33 -19.021 35.277 -16.088 259 HD1 TYR 33 HD2 TYR 33 -17.370 33.503 -18.929 260 HD2 TYR 33 HD1 TYR 33 -20.399 36.287 -17.695 261 HE1 TYR 33 HE2 TYR 33 -18.448 33.346 -21.182 262 HE2 TYR 33 HE1 TYR 33 -21.459 36.145 -19.952 263 HH TYR 33 HH TYR 33 -21.462 35.138 -21.935 264 H ARG 34 H ARG 34 -17.564 37.777 -14.947 265 HA ARG 34 HA ARG 34 -15.996 36.721 -12.653 266 HB2 ARG 34 2HB ARG 34 -15.506 38.986 -13.443 267 HB3 ARG 34 3HB ARG 34 -17.183 39.468 -13.188 268 HG2 ARG 34 2HG ARG 34 -16.997 39.335 -10.822 269 HG3 ARG 34 3HG ARG 34 -15.555 38.312 -10.906 270 HD2 ARG 34 2HD ARG 34 -14.966 40.557 -10.177 271 HD3 ARG 34 3HD ARG 34 -14.210 40.141 -11.704 272 HE ARG 34 HE ARG 34 -16.658 41.868 -11.484 273 HH11 ARG 34 1HH1 ARG 34 -13.534 41.325 -13.088 274 HH12 ARG 34 2HH1 ARG 34 -13.593 42.906 -13.818 275 HH21 ARG 34 1HH2 ARG 34 -16.673 43.771 -12.594 276 HH22 ARG 34 2HH2 ARG 34 -15.339 44.197 -13.622 277 H THR 35 H THR 35 -16.920 35.842 -10.965 278 HA THR 35 HA THR 35 -19.814 35.520 -10.752 279 HB THR 35 HB THR 35 -19.341 34.107 -8.818 280 HG1 THR 35 HG1 THR 35 -16.639 34.601 -9.306 281 HG21 THR 35 1HG2 THR 35 -17.494 33.503 -11.142 282 HG22 THR 35 2HG2 THR 35 -17.994 32.388 -9.856 283 HG23 THR 35 3HG2 THR 35 -19.206 33.058 -10.974 284 H ASP 36 H ASP 36 -20.626 35.575 -8.308 285 HA ASP 36 HA ASP 36 -20.651 38.363 -7.667 286 HB2 ASP 36 2HB ASP 36 -22.624 36.801 -7.540 287 HB3 ASP 36 3HB ASP 36 -21.873 36.012 -6.153 288 H ASN 37 H ASN 37 -18.558 35.824 -6.534 289 HA ASN 37 HA ASN 37 -17.813 37.450 -4.152 290 HB2 ASN 37 2HB ASN 37 -16.342 34.999 -4.925 291 HB3 ASN 37 3HB ASN 37 -16.540 35.736 -3.374 292 HD21 ASN 37 1HD2 ASN 37 -16.994 33.004 -4.482 293 HD22 ASN 37 2HD2 ASN 37 -18.605 32.584 -3.860 294 H GLY 38 H GLY 38 -17.245 37.853 -7.333 295 HA2 GLY 38 HA2 GLY 38 -15.629 39.067 -8.482 296 HA3 GLY 38 HA3 GLY 38 -14.538 39.013 -7.095 297 H GLU 39 H GLU 39 -15.689 35.877 -7.777 298 HA GLU 39 HA GLU 39 -12.988 35.073 -8.572 299 HB2 GLU 39 2HB GLU 39 -15.352 33.203 -8.693 300 HB3 GLU 39 3HB GLU 39 -13.679 32.870 -8.335 301 HG2 GLU 39 2HG GLU 39 -14.282 34.483 -6.217 302 HG3 GLU 39 3HG GLU 39 -15.909 33.926 -6.655 303 H GLU 40 H GLU 40 -12.293 35.268 -10.639 304 HA GLU 40 HA GLU 40 -14.258 35.328 -12.857 305 HB2 GLU 40 2HB GLU 40 -11.307 36.003 -12.883 306 HB3 GLU 40 3HB GLU 40 -12.470 36.226 -14.205 307 HG2 GLU 40 2HG GLU 40 -13.780 37.742 -12.664 308 HG3 GLU 40 3HG GLU 40 -12.436 37.668 -11.525 309 H PHE 41 H PHE 41 -14.513 33.857 -14.348 310 HA PHE 41 HA PHE 41 -12.541 31.632 -14.713 311 HB2 PHE 41 2HB PHE 41 -15.570 31.477 -14.650 312 HB3 PHE 41 3HB PHE 41 -14.522 30.173 -15.138 313 HD1 PHE 41 HD1 PHE 41 -15.476 32.269 -12.134 314 HD2 PHE 41 HD2 PHE 41 -13.505 28.716 -13.616 315 HE1 PHE 41 HE1 PHE 41 -15.136 31.471 -9.848 316 HE2 PHE 41 HE2 PHE 41 -13.063 27.992 -11.282 317 HZ PHE 41 HZ PHE 41 -13.854 29.386 -9.387 318 H GLU 42 H GLU 42 -12.716 30.557 -16.750 319 HA GLU 42 HA GLU 42 -13.370 32.395 -18.990 320 HB2 GLU 42 2HB GLU 42 -11.521 30.023 -19.258 321 HB3 GLU 42 3HB GLU 42 -11.640 31.485 -20.216 322 HG2 GLU 42 2HG GLU 42 -9.755 32.021 -19.100 323 HG3 GLU 42 3HG GLU 42 -10.889 32.650 -17.910 324 H VAL 43 H VAL 43 -14.688 31.786 -20.611 325 HA VAL 43 HA VAL 43 -15.682 28.961 -20.743 326 HB VAL 43 HB VAL 43 -17.427 31.388 -21.191 327 HG11 VAL 43 1HG1 VAL 43 -19.224 29.762 -21.277 328 HG12 VAL 43 2HG1 VAL 43 -18.033 29.355 -22.503 329 HG13 VAL 43 3HG1 VAL 43 -18.087 28.422 -20.994 330 HG21 VAL 43 3HG2 VAL 43 -16.839 31.104 -18.755 331 HG22 VAL 43 1HG2 VAL 43 -18.528 30.894 -19.149 332 HG23 VAL 43 2HG2 VAL 43 -17.514 29.461 -18.844 333 HA PRO 44 HA PRO 44 -14.347 29.727 -25.039 334 HB2 PRO 44 2HB PRO 44 -14.532 26.778 -25.160 335 HB3 PRO 44 3HB PRO 44 -13.193 27.821 -25.657 336 HG2 PRO 44 2HG PRO 44 -13.068 26.291 -23.383 337 HG3 PRO 44 3HG PRO 44 -12.341 27.926 -23.439 338 HD2 PRO 44 2HD PRO 44 -15.006 27.105 -22.274 339 HD3 PRO 44 3HD PRO 44 -13.765 28.240 -21.643 340 H PHE 45 H PHE 45 -15.772 30.147 -26.516 341 HA PHE 45 HA PHE 45 -18.343 28.591 -26.845 342 HB2 PHE 45 2HB PHE 45 -17.653 31.496 -27.285 343 HB3 PHE 45 3HB PHE 45 -18.990 30.776 -28.123 344 HD1 PHE 45 HD1 PHE 45 -17.632 31.629 -24.761 345 HD2 PHE 45 HD2 PHE 45 -21.099 30.319 -26.963 346 HE1 PHE 45 HE1 PHE 45 -19.048 32.014 -22.771 347 HE2 PHE 45 HE2 PHE 45 -22.514 30.726 -24.958 348 HZ PHE 45 HZ PHE 45 -21.463 31.531 -22.830 349 H ALA 46 H ALA 46 -18.956 27.982 -28.968 350 HA ALA 46 HA ALA 46 -16.715 27.742 -30.900 351 HB1 ALA 46 3HB ALA 46 -18.177 26.117 -32.009 352 HB2 ALA 46 1HB ALA 46 -17.956 25.715 -30.296 353 HB3 ALA 46 2HB ALA 46 -19.473 26.467 -30.841 354 H ASP 47 H ASP 47 -16.974 28.328 -33.125 355 HA ASP 47 HA ASP 47 -17.859 30.961 -33.508 356 HB2 ASP 47 2HB ASP 47 -16.088 29.815 -34.764 357 HB3 ASP 47 3HB ASP 47 -17.286 28.795 -35.565 358 H ASP 48 H ASP 48 -19.793 28.106 -33.685 359 HA ASP 48 HA ASP 48 -21.922 29.332 -35.342 360 HB2 ASP 48 2HB ASP 48 -23.067 27.278 -35.142 361 HB3 ASP 48 3HB ASP 48 -21.382 26.933 -35.525 362 H ALA 49 H ALA 49 -20.990 29.498 -32.153 363 HA ALA 49 HA ALA 49 -23.696 30.159 -31.075 364 HB1 ALA 49 3HB ALA 49 -21.107 29.577 -29.584 365 HB2 ALA 49 1HB ALA 49 -22.724 29.779 -28.885 366 HB3 ALA 49 2HB ALA 49 -22.381 28.380 -29.915 367 H GLU 50 H GLU 50 -23.511 31.889 -29.291 368 HA GLU 50 HA GLU 50 -21.594 34.066 -29.875 369 HB2 GLU 50 2HB GLU 50 -24.622 34.378 -29.693 370 HB3 GLU 50 3HB GLU 50 -23.499 35.718 -29.438 371 HG2 GLU 50 2HG GLU 50 -22.586 35.464 -31.694 372 HG3 GLU 50 3HG GLU 50 -23.632 34.076 -31.986 373 H ILE 51 H ILE 51 -21.345 35.526 -28.092 374 HA ILE 51 HA ILE 51 -21.392 34.301 -25.484 375 HB ILE 51 HB ILE 51 -20.462 37.098 -26.125 376 HG12 ILE 51 2HG1 ILE 51 -19.390 35.701 -27.795 377 HG13 ILE 51 3HG1 ILE 51 -18.240 36.313 -26.602 378 HG21 ILE 51 1HG2 ILE 51 -19.567 35.058 -24.050 379 HG22 ILE 51 2HG2 ILE 51 -18.943 36.691 -24.267 380 HG23 ILE 51 3HG2 ILE 51 -20.611 36.453 -23.725 381 HD11 ILE 51 3HD1 ILE 51 -18.193 34.060 -25.544 382 HD12 ILE 51 1HD1 ILE 51 -19.358 33.496 -26.768 383 HD13 ILE 51 2HD1 ILE 51 -17.733 34.018 -27.250 384 HA PRO 52 HA PRO 52 -25.131 36.740 -24.417 385 HB2 PRO 52 2HB PRO 52 -25.755 35.300 -22.182 386 HB3 PRO 52 3HB PRO 52 -26.184 34.764 -23.837 387 HG2 PRO 52 2HG PRO 52 -23.869 33.891 -22.101 388 HG3 PRO 52 3HG PRO 52 -24.952 32.884 -23.129 389 HD2 PRO 52 2HD PRO 52 -22.427 33.760 -23.884 390 HD3 PRO 52 3HD PRO 52 -23.714 33.418 -25.051 391 H GLY 53 H GLY 53 -25.371 38.291 -22.821 392 HA2 GLY 53 HA2 GLY 53 -23.239 39.642 -21.714 393 HA3 GLY 53 HA3 GLY 53 -24.893 39.745 -21.104 394 H THR 54 H THR 54 -24.938 36.916 -20.158 395 HA THR 54 HA THR 54 -22.708 36.784 -18.268 396 HB THR 54 HB THR 54 -24.285 36.214 -16.369 397 HG1 THR 54 HG1 THR 54 -26.075 35.471 -17.558 398 HG21 THR 54 1HG2 THR 54 -25.235 38.840 -17.565 399 HG22 THR 54 2HG2 THR 54 -25.268 38.337 -15.861 400 HG23 THR 54 3HG2 THR 54 -23.728 38.629 -16.668 401 H TRP 55 H TRP 55 -22.478 34.672 -17.177 402 HA TRP 55 HA TRP 55 -23.846 32.339 -18.284 403 HB2 TRP 55 2HB TRP 55 -22.089 33.024 -20.013 404 HB3 TRP 55 3HB TRP 55 -20.879 32.660 -18.797 405 HD1 TRP 55 HD1 TRP 55 -20.333 30.170 -18.326 406 HE1 TRP 55 HE1 TRP 55 -20.709 28.011 -19.622 407 HE3 TRP 55 HE3 TRP 55 -24.095 31.756 -21.363 408 HZ2 TRP 55 HZ2 TRP 55 -22.524 27.040 -21.674 409 HZ3 TRP 55 HZ3 TRP 55 -25.157 30.192 -22.992 410 HH2 TRP 55 HH2 TRP 55 -24.372 27.840 -23.158 411 H LEU 56 H LEU 56 -23.429 30.419 -17.069 412 HA LEU 56 HA LEU 56 -22.702 30.866 -14.331 413 HB2 LEU 56 2HB LEU 56 -24.274 29.057 -15.733 414 HB3 LEU 56 3HB LEU 56 -22.894 28.069 -15.258 415 HG LEU 56 HG LEU 56 -24.516 29.759 -13.309 416 HD11 LEU 56 1HD1 LEU 56 -25.950 28.046 -14.353 417 HD12 LEU 56 2HD1 LEU 56 -24.757 26.789 -13.958 418 HD13 LEU 56 3HD1 LEU 56 -25.618 27.650 -12.661 419 HD21 LEU 56 3HD2 LEU 56 -22.566 27.445 -12.896 420 HD22 LEU 56 1HD2 LEU 56 -22.280 29.141 -12.473 421 HD23 LEU 56 2HD2 LEU 56 -23.531 28.228 -11.623 422 H CYS 57 H CYS 57 -20.824 30.632 -13.316 423 HA CYS 57 HA CYS 57 -18.420 29.823 -14.832 424 HB2 CYS 57 2HB CYS 57 -18.876 31.246 -12.186 425 HB3 CYS 57 3HB CYS 57 -17.278 30.769 -12.767 426 HG CYS 57 HG CYS 57 -17.497 33.285 -13.278 427 H ARG 58 H ARG 58 -16.703 28.598 -13.696 428 HA ARG 58 HA ARG 58 -17.736 26.045 -12.920 429 HB2 ARG 58 2HB ARG 58 -14.825 26.837 -12.611 430 HB3 ARG 58 3HB ARG 58 -15.506 25.251 -12.923 431 HG2 ARG 58 2HG ARG 58 -16.297 26.095 -15.167 432 HG3 ARG 58 3HG ARG 58 -15.406 27.595 -14.884 433 HD2 ARG 58 2HD ARG 58 -14.167 24.822 -14.946 434 HD3 ARG 58 3HD ARG 58 -14.227 25.935 -16.312 435 HE ARG 58 HE ARG 58 -12.513 26.142 -13.917 436 HH11 ARG 58 2HH1 ARG 58 -13.403 27.677 -17.015 437 HH12 ARG 58 1HH1 ARG 58 -11.921 28.629 -16.948 438 HH21 ARG 58 1HH2 ARG 58 -10.699 27.514 -14.073 439 HH22 ARG 58 2HH2 ARG 58 -10.624 28.608 -15.456 440 H ASN 59 H ASN 59 -17.046 28.743 -10.957 441 HA ASN 59 HA ASN 59 -16.736 27.426 -8.415 442 HB2 ASN 59 2HB ASN 59 -16.131 29.741 -8.815 443 HB3 ASN 59 3HB ASN 59 -17.787 30.155 -9.262 444 HD21 ASN 59 1HD2 ASN 59 -17.807 31.853 -7.715 445 HD22 ASN 59 2HD2 ASN 59 -17.790 31.506 -5.999 446 H GLY 60 H GLY 60 -19.465 27.765 -10.517 447 HA2 GLY 60 HA2 GLY 60 -21.583 26.769 -10.270 448 HA3 GLY 60 HA3 GLY 60 -21.365 26.650 -8.523 449 H MET 61 H MET 61 -20.531 29.743 -9.849 450 HA MET 61 HA MET 61 -23.135 30.914 -8.999 451 HB2 MET 61 2HB MET 61 -21.117 31.393 -7.571 452 HB3 MET 61 3HB MET 61 -20.373 32.181 -8.936 453 HG2 MET 61 2HG MET 61 -21.404 33.793 -7.393 454 HG3 MET 61 3HG MET 61 -22.094 33.882 -9.009 455 HE1 MET 61 3HE MET 61 -24.238 32.303 -5.216 456 HE2 MET 61 1HE MET 61 -22.864 31.428 -5.919 457 HE3 MET 61 2HE MET 61 -22.633 33.062 -5.252 458 H GLU 62 H GLU 62 -24.035 32.561 -10.237 459 HA GLU 62 HA GLU 62 -23.597 32.528 -13.090 460 HB2 GLU 62 2HB GLU 62 -25.800 32.954 -11.978 461 HB3 GLU 62 3HB GLU 62 -25.166 34.488 -11.390 462 HG2 GLU 62 2HG GLU 62 -26.240 35.228 -13.267 463 HG3 GLU 62 3HG GLU 62 -24.660 34.943 -13.977 464 H GLY 63 H GLY 63 -21.840 33.345 -14.013 465 HA2 GLY 63 HA2 GLY 63 -20.373 35.634 -12.884 466 HA3 GLY 63 HA3 GLY 63 -19.856 34.593 -14.182 467 H THR 64 H THR 64 -20.058 37.584 -13.974 468 HA THR 64 HA THR 64 -21.738 38.053 -16.390 469 HB THR 64 HB THR 64 -20.618 40.074 -14.414 470 HG1 THR 64 HG1 THR 64 -22.743 40.229 -13.730 471 HG21 THR 64 1HG2 THR 64 -22.468 40.413 -16.825 472 HG22 THR 64 2HG2 THR 64 -22.309 41.623 -15.532 473 HG23 THR 64 3HG2 THR 64 -20.913 41.208 -16.529 474 H LEU 65 H LEU 65 -20.972 38.881 -18.229 475 HA LEU 65 HA LEU 65 -18.455 38.075 -19.017 476 HB2 LEU 65 2HB LEU 65 -20.493 38.328 -20.379 477 HB3 LEU 65 3HB LEU 65 -20.349 40.078 -20.305 478 HG LEU 65 HG LEU 65 -18.086 39.764 -21.536 479 HD11 LEU 65 1HD1 LEU 65 -17.715 37.742 -22.732 480 HD12 LEU 65 2HD1 LEU 65 -17.659 37.451 -21.001 481 HD13 LEU 65 3HD1 LEU 65 -19.096 36.958 -21.901 482 HD21 LEU 65 3HD2 LEU 65 -20.151 40.451 -22.703 483 HD22 LEU 65 1HD2 LEU 65 -19.173 39.381 -23.720 484 HD23 LEU 65 2HD2 LEU 65 -20.617 38.748 -22.894 485 H ILE 66 H ILE 66 -16.512 38.782 -18.827 486 HA ILE 66 HA ILE 66 -15.855 41.625 -19.266 487 HB ILE 66 HB ILE 66 -13.982 41.544 -17.809 488 HG12 ILE 66 2HG1 ILE 66 -13.425 39.110 -17.909 489 HG13 ILE 66 3HG1 ILE 66 -13.368 39.835 -16.311 490 HG21 ILE 66 1HG2 ILE 66 -15.088 41.555 -15.623 491 HG22 ILE 66 2HG2 ILE 66 -16.083 42.344 -16.863 492 HG23 ILE 66 3HG2 ILE 66 -16.490 40.714 -16.291 493 HD11 ILE 66 3HD1 ILE 66 -14.269 37.584 -16.262 494 HD12 ILE 66 1HD1 ILE 66 -15.321 38.825 -15.564 495 HD13 ILE 66 2HD1 ILE 66 -15.682 38.190 -17.155 496 H GLU 67 H GLU 67 -13.753 41.916 -20.356 497 HA GLU 67 HA GLU 67 -13.578 40.292 -22.674 498 HB2 GLU 67 2HB GLU 67 -11.572 42.241 -21.477 499 HB3 GLU 67 3HB GLU 67 -11.449 41.536 -23.095 500 HG2 GLU 67 2HG GLU 67 -13.555 42.591 -23.769 501 HG3 GLU 67 3HG GLU 67 -13.799 43.228 -22.143 502 H GLY 68 H GLY 68 -13.034 38.212 -22.732 503 HA2 GLY 68 HA2 GLY 68 -10.692 37.120 -21.266 504 HA3 GLY 68 HA3 GLY 68 -11.818 36.223 -22.288 505 H ASP 69 H ASP 69 -11.708 36.696 -24.645 506 HA ASP 69 HA ASP 69 -9.150 37.845 -25.654 507 HB2 ASP 69 2HB ASP 69 -9.045 35.318 -25.372 508 HB3 ASP 69 3HB ASP 69 -10.324 35.195 -26.578 509 H LEU 70 H LEU 70 -12.058 38.690 -25.575 510 HA LEU 70 HA LEU 70 -12.600 39.100 -28.488 511 HB2 LEU 70 2HB LEU 70 -14.095 37.587 -26.524 512 HB3 LEU 70 3HB LEU 70 -15.036 38.991 -26.974 513 HG LEU 70 HG LEU 70 -14.909 38.385 -29.347 514 HD11 LEU 70 1HD1 LEU 70 -12.784 37.181 -29.489 515 HD12 LEU 70 2HD1 LEU 70 -13.383 35.931 -28.376 516 HD13 LEU 70 3HD1 LEU 70 -14.093 36.127 -30.001 517 HD21 LEU 70 3HD2 LEU 70 -16.724 37.534 -27.886 518 HD22 LEU 70 1HD2 LEU 70 -16.353 36.394 -29.185 519 HD23 LEU 70 2HD2 LEU 70 -15.769 36.092 -27.527 520 HA PRO 71 HA PRO 71 -12.800 43.267 -26.667 521 HB2 PRO 71 2HB PRO 71 -11.671 44.685 -28.688 522 HB3 PRO 71 3HB PRO 71 -10.714 43.689 -27.551 523 HG2 PRO 71 2HG PRO 71 -11.603 42.980 -30.356 524 HG3 PRO 71 3HG PRO 71 -10.003 42.736 -29.599 525 HD2 PRO 71 2HD PRO 71 -11.947 40.771 -29.780 526 HD3 PRO 71 3HD PRO 71 -10.718 40.823 -28.483 527 H GLU 72 H GLU 72 -13.708 42.525 -30.069 528 HA GLU 72 HA GLU 72 -16.286 43.938 -29.712 529 HB2 GLU 72 2HB GLU 72 -15.965 45.088 -31.825 530 HB3 GLU 72 3HB GLU 72 -14.763 45.521 -30.609 531 HG2 GLU 72 2HG GLU 72 -13.012 44.341 -31.713 532 HG3 GLU 72 3HG GLU 72 -14.112 43.565 -32.841 533 HA PRO 73 HA PRO 73 -17.077 39.849 -31.918 534 HB2 PRO 73 2HB PRO 73 -19.084 39.033 -30.203 535 HB3 PRO 73 3HB PRO 73 -17.366 38.558 -30.062 536 HG2 PRO 73 2HG PRO 73 -18.805 40.811 -28.618 537 HG3 PRO 73 3HG PRO 73 -17.727 39.554 -27.939 538 HD2 PRO 73 2HD PRO 73 -16.791 42.023 -28.482 539 HD3 PRO 73 3HD PRO 73 -15.791 40.588 -28.825 540 H LYS 74 H LYS 74 -18.459 40.032 -33.462 541 HA LYS 74 HA LYS 74 -20.692 42.026 -33.458 542 HB2 LYS 74 2HB LYS 74 -19.608 43.420 -35.082 543 HB3 LYS 74 3HB LYS 74 -18.489 43.167 -33.757 544 HG2 LYS 74 2HG LYS 74 -17.517 41.224 -35.239 545 HG3 LYS 74 3HG LYS 74 -18.397 41.977 -36.566 546 HD2 LYS 74 2HD LYS 74 -16.338 43.388 -34.791 547 HD3 LYS 74 3HD LYS 74 -15.979 42.638 -36.347 548 HE2 LYS 74 2HE LYS 74 -17.554 44.181 -37.480 549 HE3 LYS 74 3HE LYS 74 -17.932 44.930 -35.920 550 HZ1 LYS 74 HZ1 LYS 74 -15.274 44.936 -37.239 551 HZ2 LYS 74 HZ2 LYS 74 -16.245 46.230 -37.021 552 HZ3 LYS 74 HZ3 LYS 74 -15.533 45.505 -35.732 553 H LYS 75 H LYS 75 -20.328 38.989 -34.265 554 HA LYS 75 HA LYS 75 -20.431 38.879 -37.083 555 HB2 LYS 75 2HB LYS 75 -20.985 36.580 -36.940 556 HB3 LYS 75 3HB LYS 75 -19.797 36.958 -35.699 557 HG2 LYS 75 2HG LYS 75 -21.476 36.793 -33.940 558 HG3 LYS 75 3HG LYS 75 -22.788 36.744 -35.119 559 HD2 LYS 75 2HD LYS 75 -22.482 34.499 -34.348 560 HD3 LYS 75 3HD LYS 75 -21.954 34.602 -36.018 561 HE2 LYS 75 2HE LYS 75 -20.311 33.282 -35.012 562 HE3 LYS 75 3HE LYS 75 -19.551 34.869 -35.113 563 HZ1 LYS 75 HZ1 LYS 75 -20.788 33.622 -32.710 564 HZ2 LYS 75 HZ2 LYS 75 -19.214 33.941 -32.916 565 HZ3 LYS 75 HZ3 LYS 75 -20.255 35.185 -32.738 566 H VAL 76 H VAL 76 -21.948 38.455 -38.604 567 HA VAL 76 HA VAL 76 -24.564 39.680 -38.319 568 HB VAL 76 HB VAL 76 -24.990 38.886 -40.606 569 HG11 VAL 76 1HG1 VAL 76 -22.252 40.185 -40.298 570 HG12 VAL 76 2HG1 VAL 76 -23.316 40.258 -41.717 571 HG13 VAL 76 3HG1 VAL 76 -23.818 41.021 -40.200 572 HG21 VAL 76 3HG2 VAL 76 -23.256 37.792 -41.933 573 HG22 VAL 76 1HG2 VAL 76 -22.200 37.649 -40.517 574 HG23 VAL 76 2HG2 VAL 76 -23.730 36.746 -40.590 575 H LYS 77 H LYS 77 -26.628 38.662 -38.679 576 HA LYS 77 HA LYS 77 -27.085 36.431 -36.964 577 HB2 LYS 77 2HB LYS 77 -28.679 38.288 -37.399 578 HB3 LYS 77 3HB LYS 77 -28.941 37.671 -39.037 579 HG2 LYS 77 2HG LYS 77 -29.824 35.544 -38.074 580 HG3 LYS 77 3HG LYS 77 -29.547 36.181 -36.440 581 HD2 LYS 77 2HD LYS 77 -31.141 38.024 -36.889 582 HD3 LYS 77 3HD LYS 77 -31.398 37.405 -38.536 583 HE2 LYS 77 2HE LYS 77 -32.224 35.257 -37.593 584 HE3 LYS 77 3HE LYS 77 -31.974 35.876 -35.956 585 HZ1 LYS 77 HZ1 LYS 77 -33.621 37.611 -36.432 586 HZ2 LYS 77 HZ2 LYS 77 -33.852 37.039 -37.947 587 HZ3 LYS 77 HZ3 LYS 77 -34.284 36.139 -36.657 588 HA PRO 78 HA PRO 78 -26.294 33.180 -39.963 589 HB2 PRO 78 2HB PRO 78 -27.099 30.970 -38.561 590 HB3 PRO 78 3HB PRO 78 -25.623 31.899 -38.166 591 HG2 PRO 78 2HG PRO 78 -28.372 32.161 -36.899 592 HG3 PRO 78 3HG PRO 78 -26.787 31.977 -36.078 593 HD2 PRO 78 2HD PRO 78 -27.942 34.407 -36.440 594 HD3 PRO 78 3HD PRO 78 -26.170 34.198 -36.569 595 HA PRO 79 HA PRO 79 -30.147 32.595 -42.050 596 HB2 PRO 79 2HB PRO 79 -29.652 30.557 -43.780 597 HB3 PRO 79 3HB PRO 79 -28.756 32.104 -43.846 598 HG2 PRO 79 2HG PRO 79 -27.902 29.527 -42.474 599 HG3 PRO 79 3HG PRO 79 -26.969 30.510 -43.650 600 HD2 PRO 79 2HD PRO 79 -26.637 30.793 -40.961 601 HD3 PRO 79 3HD PRO 79 -26.567 32.203 -42.060 602 H ARG 80 H ARG 80 -29.249 30.221 -39.806 603 HA ARG 80 HA ARG 80 -31.164 28.147 -40.291 604 HB2 ARG 80 2HB ARG 80 -30.502 27.268 -38.149 605 HB3 ARG 80 3HB ARG 80 -29.083 27.821 -39.037 606 HG2 ARG 80 2HG ARG 80 -29.157 29.961 -37.653 607 HG3 ARG 80 3HG ARG 80 -30.448 29.219 -36.689 608 HD2 ARG 80 2HD ARG 80 -28.935 27.367 -36.074 609 HD3 ARG 80 3HD ARG 80 -27.664 28.068 -37.091 610 HE ARG 80 HE ARG 80 -28.789 29.727 -34.894 611 HH11 ARG 80 1HH2 ARG 80 -26.026 27.797 -35.929 612 HH12 ARG 80 2HH2 ARG 80 -25.000 28.561 -34.719 613 HH21 ARG 80 2HH1 ARG 80 -27.333 30.590 -33.406 614 HH22 ARG 80 1HH1 ARG 80 -25.673 30.015 -33.436 Start of MODEL 19 1 H1 SER 1 1H SER 1 -3.191 28.732 -2.549 2 H2 SER 1 2H SER 1 -3.786 30.260 -2.557 3 H3 SER 1 3H SER 1 -3.548 29.467 -1.131 4 HA SER 1 HA SER 1 -1.786 30.979 -1.303 5 HB2 SER 1 2HB SER 1 0.200 29.448 -1.575 6 HB3 SER 1 3HB SER 1 -1.029 28.892 -0.425 7 HG SER 1 HG SER 1 -0.367 27.212 -1.837 8 H MET 2 H MET 2 -1.373 28.868 -4.206 9 HA MET 2 HA MET 2 -1.121 31.314 -5.886 10 HB2 MET 2 2HB MET 2 0.732 28.900 -5.884 11 HB3 MET 2 3HB MET 2 0.650 30.068 -7.205 12 HG2 MET 2 2HG MET 2 1.256 31.894 -5.651 13 HG3 MET 2 3HG MET 2 1.396 30.721 -4.333 14 HE1 MET 2 3HE MET 2 3.702 32.814 -5.217 15 HE2 MET 2 1HE MET 2 3.804 31.701 -3.832 16 HE3 MET 2 2HE MET 2 5.122 31.764 -5.022 17 H ALA 3 H ALA 3 -2.827 29.539 -8.537 18 HA ALA 3 HA ALA 3 -0.854 31.648 -8.126 19 HB1 ALA 3 3HB ALA 3 -1.380 30.745 -10.345 20 HB2 ALA 3 1HB ALA 3 -3.064 31.302 -10.191 21 HB3 ALA 3 2HB ALA 3 -1.735 32.480 -10.254 22 H ASP 4 H ASP 4 -4.423 31.441 -7.884 23 HA ASP 4 HA ASP 4 -6.016 32.891 -7.163 24 HB2 ASP 4 2HB ASP 4 -3.936 33.309 -4.995 25 HB3 ASP 4 3HB ASP 4 -5.647 33.708 -4.849 26 H ARG 5 H ARG 5 -4.293 34.146 -9.123 27 HA ARG 5 HA ARG 5 -3.821 36.116 -10.146 28 HB2 ARG 5 2HB ARG 5 -6.099 37.193 -8.466 29 HB3 ARG 5 3HB ARG 5 -5.404 37.988 -9.872 30 HG2 ARG 5 2HG ARG 5 -6.125 36.246 -11.371 31 HG3 ARG 5 3HG ARG 5 -6.687 35.225 -10.042 32 HD2 ARG 5 2HD ARG 5 -7.834 37.976 -10.668 33 HD3 ARG 5 3HD ARG 5 -8.507 36.446 -11.255 34 HE ARG 5 HE ARG 5 -8.195 36.331 -8.404 35 HH11 ARG 5 1HH2 ARG 5 -10.337 37.853 -10.778 36 HH12 ARG 5 2HH2 ARG 5 -11.687 37.763 -9.647 37 HH21 ARG 5 1HH1 ARG 5 -10.007 36.376 -7.069 38 HH22 ARG 5 2HH1 ARG 5 -11.498 37.039 -7.704 39 H VAL 6 H VAL 6 -2.459 35.575 -7.501 40 HA VAL 6 HA VAL 6 -1.231 38.267 -7.135 41 HB VAL 6 HB VAL 6 -0.902 37.692 -4.763 42 HG11 VAL 6 1HG1 VAL 6 -3.131 38.257 -3.999 43 HG12 VAL 6 2HG1 VAL 6 -2.749 39.167 -5.471 44 HG13 VAL 6 3HG1 VAL 6 -3.833 37.761 -5.551 45 HG21 VAL 6 3HG2 VAL 6 -2.193 35.977 -3.643 46 HG22 VAL 6 1HG2 VAL 6 -2.895 35.442 -5.179 47 HG23 VAL 6 2HG2 VAL 6 -1.162 35.222 -4.867 48 H LEU 7 H LEU 7 0.881 38.224 -6.181 49 HA LEU 7 HA LEU 7 3.085 37.752 -6.177 50 HB2 LEU 7 2HB LEU 7 2.257 34.843 -5.937 51 HB3 LEU 7 3HB LEU 7 3.803 35.531 -5.472 52 HG LEU 7 HG LEU 7 1.136 36.163 -4.135 53 HD11 LEU 7 1HD1 LEU 7 3.508 34.509 -3.192 54 HD12 LEU 7 2HD1 LEU 7 2.046 34.886 -2.255 55 HD13 LEU 7 3HD1 LEU 7 1.923 33.878 -3.703 56 HD21 LEU 7 3HD2 LEU 7 2.534 37.250 -2.399 57 HD22 LEU 7 1HD2 LEU 7 3.977 37.005 -3.407 58 HD23 LEU 7 2HD2 LEU 7 2.669 38.082 -3.950 59 H ARG 8 H ARG 8 4.901 36.303 -7.126 60 HA ARG 8 HA ARG 8 6.218 35.956 -8.974 61 HB2 ARG 8 2HB ARG 8 3.811 34.243 -9.693 62 HB3 ARG 8 3HB ARG 8 5.416 34.104 -10.419 63 HG2 ARG 8 2HG ARG 8 6.405 33.572 -8.213 64 HG3 ARG 8 3HG ARG 8 4.819 33.736 -7.452 65 HD2 ARG 8 2HD ARG 8 5.286 31.407 -7.758 66 HD3 ARG 8 3HD ARG 8 3.945 31.875 -8.820 67 HE ARG 8 HE ARG 8 6.417 32.061 -10.262 68 HH11 ARG 8 1HH2 ARG 8 4.347 29.559 -8.955 69 HH12 ARG 8 2HH2 ARG 8 4.853 28.387 -10.141 70 HH21 ARG 8 1HH1 ARG 8 7.019 30.521 -11.754 71 HH22 ARG 8 2HH1 ARG 8 6.331 28.925 -11.680 72 H GLY 9 H GLY 9 5.147 38.405 -9.221 73 HA2 GLY 9 HA2 GLY 9 3.978 38.990 -11.788 74 HA3 GLY 9 HA3 GLY 9 4.762 40.137 -10.708 75 H SER 10 H SER 10 5.037 40.536 -13.319 76 HA SER 10 HA SER 10 7.247 39.208 -14.582 77 HB2 SER 10 2HB SER 10 5.784 41.731 -15.418 78 HB3 SER 10 3HB SER 10 6.819 40.715 -16.441 79 HG SER 10 HG SER 10 4.585 40.225 -16.697 80 H ARG 11 H ARG 11 8.418 40.029 -12.331 81 HA ARG 11 HA ARG 11 9.780 42.574 -12.409 82 HB2 ARG 11 2HB ARG 11 9.340 41.156 -10.392 83 HB3 ARG 11 3HB ARG 11 10.542 39.992 -10.967 84 HG2 ARG 11 2HG ARG 11 12.315 41.706 -10.777 85 HG3 ARG 11 3HG ARG 11 11.106 42.923 -10.310 86 HD2 ARG 11 2HD ARG 11 10.556 41.593 -8.295 87 HD3 ARG 11 3HD ARG 11 11.756 40.372 -8.772 88 HE ARG 11 HE ARG 11 13.049 42.907 -8.667 89 HH11 ARG 11 1HH2 ARG 11 11.667 40.622 -6.398 90 HH12 ARG 11 2HH2 ARG 11 12.712 41.136 -5.101 91 HH21 ARG 11 1HH1 ARG 11 14.350 43.515 -6.971 92 HH22 ARG 11 2HH1 ARG 11 14.190 42.733 -5.426 93 H LEU 12 H LEU 12 10.513 39.506 -13.889 94 HA LEU 12 HA LEU 12 12.743 40.731 -15.395 95 HB2 LEU 12 2HB LEU 12 13.727 39.440 -13.498 96 HB3 LEU 12 3HB LEU 12 12.852 38.007 -14.032 97 HG LEU 12 HG LEU 12 14.166 38.009 -16.157 98 HD11 LEU 12 1HD1 LEU 12 16.217 39.406 -16.293 99 HD12 LEU 12 2HD1 LEU 12 14.763 40.402 -16.337 100 HD13 LEU 12 3HD1 LEU 12 15.709 40.289 -14.836 101 HD21 LEU 12 3HD2 LEU 12 15.851 38.072 -13.621 102 HD22 LEU 12 1HD2 LEU 12 14.900 36.689 -14.210 103 HD23 LEU 12 2HD2 LEU 12 16.281 37.274 -15.150 104 H GLY 13 H GLY 13 12.827 40.079 -17.541 105 HA2 GLY 13 HA2 GLY 13 10.439 38.963 -18.709 106 HA3 GLY 13 HA3 GLY 13 11.907 39.420 -19.562 107 H ALA 14 H ALA 14 10.155 37.102 -19.935 108 HA ALA 14 HA ALA 14 12.217 35.012 -20.086 109 HB1 ALA 14 3HB ALA 14 10.743 33.308 -19.053 110 HB2 ALA 14 1HB ALA 14 11.140 34.590 -17.893 111 HB3 ALA 14 2HB ALA 14 9.544 34.563 -18.675 112 H VAL 15 H VAL 15 11.667 33.320 -21.591 113 HA VAL 15 HA VAL 15 10.017 34.280 -23.825 114 HB VAL 15 HB VAL 15 11.718 31.767 -23.764 115 HG11 VAL 15 1HG1 VAL 15 10.127 31.910 -25.680 116 HG12 VAL 15 2HG1 VAL 15 10.714 33.547 -26.047 117 HG13 VAL 15 3HG1 VAL 15 11.785 32.141 -26.223 118 HG21 VAL 15 3HG2 VAL 15 13.449 33.148 -24.906 119 HG22 VAL 15 1HG2 VAL 15 12.489 34.606 -24.570 120 HG23 VAL 15 2HG2 VAL 15 13.193 33.656 -23.240 121 H SER 16 H SER 16 8.212 34.039 -22.138 122 HA SER 16 HA SER 16 6.996 31.344 -22.026 123 HB2 SER 16 2HB SER 16 7.083 32.828 -20.037 124 HB3 SER 16 3HB SER 16 6.008 33.968 -20.869 125 HG SER 16 HG SER 16 4.881 32.499 -19.482 126 H TYR 17 H TYR 17 6.257 34.488 -23.316 127 HA TYR 17 HA TYR 17 4.774 35.383 -24.740 128 HB2 TYR 17 2HB TYR 17 4.855 34.503 -26.993 129 HB3 TYR 17 3HB TYR 17 6.413 34.541 -26.218 130 HD1 TYR 17 HD1 TYR 17 3.655 32.260 -27.305 131 HD2 TYR 17 HD2 TYR 17 7.752 32.582 -25.985 132 HE1 TYR 17 HE1 TYR 17 4.041 29.883 -27.922 133 HE2 TYR 17 HE2 TYR 17 8.139 30.201 -26.608 134 HH TYR 17 HH TYR 17 5.543 28.154 -28.009 135 H GLU 18 H GLU 18 2.910 35.046 -26.412 136 HA GLU 18 HA GLU 18 0.645 34.064 -24.793 137 HB2 GLU 18 2HB GLU 18 0.584 36.300 -25.809 138 HB3 GLU 18 3HB GLU 18 0.684 35.586 -27.423 139 HG2 GLU 18 2HG GLU 18 -1.464 34.388 -27.021 140 HG3 GLU 18 3HG GLU 18 -1.529 35.047 -25.387 141 H THR 19 H THR 19 0.482 31.889 -24.877 142 HA THR 19 HA THR 19 0.688 30.248 -27.234 143 HB THR 19 HB THR 19 -0.937 29.730 -24.712 144 HG1 THR 19 HG1 THR 19 0.921 28.669 -24.018 145 HG21 THR 19 1HG2 THR 19 0.249 27.830 -26.792 146 HG22 THR 19 2HG2 THR 19 -0.521 27.337 -25.267 147 HG23 THR 19 3HG2 THR 19 -1.482 28.134 -26.515 148 H ASP 20 H ASP 20 -0.724 29.969 -28.894 149 HA ASP 20 HA ASP 20 -3.130 31.569 -29.031 150 HB2 ASP 20 2HB ASP 20 -1.696 31.230 -30.955 151 HB3 ASP 20 3HB ASP 20 -1.963 29.490 -30.907 152 H ARG 21 H ARG 21 -4.924 31.076 -28.011 153 HA ARG 21 HA ARG 21 -5.665 28.384 -27.168 154 HB2 ARG 21 2HB ARG 21 -7.073 31.078 -26.965 155 HB3 ARG 21 3HB ARG 21 -7.699 29.571 -26.285 156 HG2 ARG 21 2HG ARG 21 -5.705 29.316 -24.875 157 HG3 ARG 21 3HG ARG 21 -5.035 30.836 -25.504 158 HD2 ARG 21 2HD ARG 21 -6.866 32.116 -24.573 159 HD3 ARG 21 3HD ARG 21 -7.752 30.636 -24.156 160 HE ARG 21 HE ARG 21 -5.209 30.620 -22.840 161 HH11 ARG 21 1HH2 ARG 21 -8.299 32.300 -22.560 162 HH12 ARG 21 2HH2 ARG 21 -8.191 32.250 -20.796 163 HH21 ARG 21 2HH1 ARG 21 -5.251 30.697 -20.554 164 HH22 ARG 21 1HH1 ARG 21 -6.659 31.426 -19.786 165 H ASN 22 H ASN 22 -6.072 29.853 -30.146 166 HA ASN 22 HA ASN 22 -8.410 28.124 -30.855 167 HB2 ASN 22 2HB ASN 22 -8.939 30.578 -30.629 168 HB3 ASN 22 3HB ASN 22 -7.741 30.913 -31.877 169 HD21 ASN 22 2HD2 ASN 22 -9.128 31.743 -33.453 170 HD22 ASN 22 1HD2 ASN 22 -10.439 30.809 -34.151 171 H HIS 23 H HIS 23 -5.517 27.501 -31.003 172 HA HIS 23 HA HIS 23 -4.507 27.964 -33.638 173 HB2 HIS 23 2HB HIS 23 -3.149 27.620 -31.589 174 HB3 HIS 23 3HB HIS 23 -3.640 25.930 -31.546 175 HD2 HIS 23 HD2 HIS 23 -1.682 28.406 -33.837 176 HE1 HIS 23 HE1 HIS 23 -0.195 24.486 -34.643 177 HE2 HIS 23 HE2 HIS 23 0.097 26.966 -35.151 178 H ASP 24 H ASP 24 -5.973 25.027 -32.225 179 HA ASP 24 HA ASP 24 -5.690 23.442 -34.653 180 HB2 ASP 24 2HB ASP 24 -7.002 21.768 -33.389 181 HB3 ASP 24 3HB ASP 24 -5.590 22.352 -32.515 182 H LEU 25 H LEU 25 -7.550 22.369 -35.704 183 HA LEU 25 HA LEU 25 -9.380 24.430 -36.676 184 HB2 LEU 25 2HB LEU 25 -8.994 21.553 -37.535 185 HB3 LEU 25 3HB LEU 25 -9.970 22.765 -38.366 186 HG LEU 25 HG LEU 25 -6.940 22.867 -38.009 187 HD11 LEU 25 1HD1 LEU 25 -8.655 22.373 -40.477 188 HD12 LEU 25 2HD1 LEU 25 -6.880 22.475 -40.429 189 HD13 LEU 25 3HD1 LEU 25 -7.710 21.147 -39.602 190 HD21 LEU 25 3HD2 LEU 25 -8.816 24.738 -39.523 191 HD22 LEU 25 1HD2 LEU 25 -7.821 25.153 -38.107 192 HD23 LEU 25 2HD2 LEU 25 -7.042 24.751 -39.636 193 H ALA 26 H ALA 26 -10.290 24.527 -34.535 194 HA ALA 26 HA ALA 26 -13.060 23.584 -34.805 195 HB1 ALA 26 3HB ALA 26 -13.252 22.967 -32.402 196 HB2 ALA 26 1HB ALA 26 -12.186 21.876 -33.305 197 HB3 ALA 26 2HB ALA 26 -11.488 23.106 -32.237 198 HA PRO 27 HA PRO 27 -11.995 28.031 -34.268 199 HB2 PRO 27 2HB PRO 27 -14.559 28.308 -35.844 200 HB3 PRO 27 3HB PRO 27 -13.040 29.252 -35.975 201 HG2 PRO 27 2HG PRO 27 -13.528 27.265 -37.731 202 HG3 PRO 27 3HG PRO 27 -11.899 27.380 -36.977 203 HD2 PRO 27 2HD PRO 27 -14.229 25.621 -36.144 204 HD3 PRO 27 3HD PRO 27 -12.516 25.171 -36.420 205 H ARG 28 H ARG 28 -12.303 28.942 -32.479 206 HA ARG 28 HA ARG 28 -14.978 29.237 -31.192 207 HB2 ARG 28 2HB ARG 28 -14.064 28.362 -29.083 208 HB3 ARG 28 3HB ARG 28 -13.983 27.190 -30.398 209 HG2 ARG 28 2HG ARG 28 -11.567 27.766 -30.733 210 HG3 ARG 28 3HG ARG 28 -11.660 28.847 -29.329 211 HD2 ARG 28 2HD ARG 28 -12.179 26.962 -27.879 212 HD3 ARG 28 3HD ARG 28 -12.355 25.878 -29.262 213 HE ARG 28 HE ARG 28 -9.805 27.001 -28.194 214 HH11 ARG 28 1HH2 ARG 28 -11.148 25.107 -30.854 215 HH12 ARG 28 2HH2 ARG 28 -9.675 24.154 -30.976 216 HH21 ARG 28 1HH1 ARG 28 -7.990 25.963 -28.618 217 HH22 ARG 28 2HH1 ARG 28 -7.927 24.652 -29.795 218 H GLN 29 H GLN 29 -14.914 30.427 -29.186 219 HA GLN 29 HA GLN 29 -13.253 32.904 -29.175 220 HB2 GLN 29 2HB GLN 29 -16.254 32.760 -28.660 221 HB3 GLN 29 3HB GLN 29 -15.249 34.204 -28.642 222 HG2 GLN 29 2HG GLN 29 -15.628 34.551 -30.833 223 HG3 GLN 29 3HG GLN 29 -15.011 32.949 -31.249 224 HE21 GLN 29 1HE2 GLN 29 -16.728 31.182 -30.186 225 HE22 GLN 29 2HE2 GLN 29 -18.329 31.402 -30.889 226 H ILE 30 H ILE 30 -12.178 32.672 -27.311 227 HA ILE 30 HA ILE 30 -13.398 31.404 -24.925 228 HB ILE 30 HB ILE 30 -10.646 32.665 -25.049 229 HG12 ILE 30 2HG1 ILE 30 -10.571 31.104 -26.857 230 HG13 ILE 30 3HG1 ILE 30 -9.691 30.463 -25.484 231 HG21 ILE 30 1HG2 ILE 30 -10.247 31.020 -23.197 232 HG22 ILE 30 2HG2 ILE 30 -11.500 32.214 -22.819 233 HG23 ILE 30 3HG2 ILE 30 -11.959 30.560 -23.270 234 HD11 ILE 30 3HD1 ILE 30 -10.930 28.706 -26.611 235 HD12 ILE 30 1HD1 ILE 30 -11.565 28.939 -24.976 236 HD13 ILE 30 2HD1 ILE 30 -12.458 29.576 -26.386 237 H ALA 31 H ALA 31 -14.862 32.724 -23.954 238 HA ALA 31 HA ALA 31 -14.218 35.600 -23.486 239 HB1 ALA 31 3HB ALA 31 -16.391 35.198 -24.469 240 HB2 ALA 31 1HB ALA 31 -16.799 34.012 -23.204 241 HB3 ALA 31 2HB ALA 31 -16.606 35.731 -22.794 242 H ARG 32 H ARG 32 -14.568 36.450 -21.347 243 HA ARG 32 HA ARG 32 -14.108 34.518 -19.099 244 HB2 ARG 32 2HB ARG 32 -12.846 37.176 -19.757 245 HB3 ARG 32 3HB ARG 32 -13.107 36.780 -18.056 246 HG2 ARG 32 2HG ARG 32 -11.772 34.876 -18.112 247 HG3 ARG 32 3HG ARG 32 -11.830 34.723 -19.875 248 HD2 ARG 32 2HD ARG 32 -10.377 36.644 -20.155 249 HD3 ARG 32 3HD ARG 32 -10.395 36.962 -18.404 250 HE ARG 32 HE ARG 32 -9.489 34.278 -18.965 251 HH11 ARG 32 1HH2 ARG 32 -8.196 37.513 -19.227 252 HH12 ARG 32 2HH2 ARG 32 -6.616 37.008 -18.666 253 HH21 ARG 32 1HH1 ARG 32 -7.462 33.664 -18.542 254 HH22 ARG 32 2HH1 ARG 32 -6.189 34.855 -18.371 255 H TYR 33 H TYR 33 -15.136 34.865 -17.151 256 HA TYR 33 HA TYR 33 -17.169 37.012 -16.994 257 HB2 TYR 33 2HB TYR 33 -17.784 34.089 -16.536 258 HB3 TYR 33 3HB TYR 33 -18.840 35.419 -16.147 259 HD1 TYR 33 HD1 TYR 33 -17.147 33.681 -18.994 260 HD2 TYR 33 HD2 TYR 33 -20.339 36.263 -17.727 261 HE1 TYR 33 HE1 TYR 33 -18.241 33.429 -21.211 262 HE2 TYR 33 HE2 TYR 33 -21.414 36.048 -19.961 263 HH TYR 33 HH TYR 33 -20.161 33.780 -22.419 264 H ARG 34 H ARG 34 -17.536 37.744 -14.944 265 HA ARG 34 HA ARG 34 -15.916 36.651 -12.686 266 HB2 ARG 34 2HB ARG 34 -15.384 38.933 -13.511 267 HB3 ARG 34 3HB ARG 34 -17.026 39.457 -13.153 268 HG2 ARG 34 2HG ARG 34 -16.715 39.308 -10.813 269 HG3 ARG 34 3HG ARG 34 -15.373 38.168 -10.968 270 HD2 ARG 34 2HD ARG 34 -14.507 40.300 -10.254 271 HD3 ARG 34 3HD ARG 34 -13.927 39.896 -11.859 272 HE ARG 34 HE ARG 34 -16.206 41.789 -11.420 273 HH11 ARG 34 1HH1 ARG 34 -13.094 41.189 -13.058 274 HH12 ARG 34 2HH1 ARG 34 -13.087 42.809 -13.695 275 HH21 ARG 34 1HH2 ARG 34 -16.093 43.771 -12.372 276 HH22 ARG 34 2HH2 ARG 34 -14.737 44.190 -13.373 277 H THR 35 H THR 35 -16.863 35.815 -10.987 278 HA THR 35 HA THR 35 -19.775 35.534 -10.855 279 HB THR 35 HB THR 35 -19.373 34.055 -8.950 280 HG1 THR 35 HG1 THR 35 -16.656 34.509 -9.368 281 HG21 THR 35 1HG2 THR 35 -19.217 33.041 -11.107 282 HG22 THR 35 2HG2 THR 35 -17.506 33.490 -11.268 283 HG23 THR 35 3HG2 THR 35 -18.006 32.350 -10.002 284 H ASP 36 H ASP 36 -20.644 35.550 -8.435 285 HA ASP 36 HA ASP 36 -20.649 38.322 -7.741 286 HB2 ASP 36 2HB ASP 36 -22.637 36.777 -7.679 287 HB3 ASP 36 3HB ASP 36 -21.921 35.956 -6.293 288 H ASN 37 H ASN 37 -18.598 35.745 -6.621 289 HA ASN 37 HA ASN 37 -17.880 37.314 -4.189 290 HB2 ASN 37 2HB ASN 37 -16.429 34.861 -5.003 291 HB3 ASN 37 3HB ASN 37 -16.625 35.567 -3.436 292 HD21 ASN 37 1HD2 ASN 37 -17.089 32.867 -4.567 293 HD22 ASN 37 2HD2 ASN 37 -18.712 32.450 -3.973 294 H GLY 38 H GLY 38 -17.257 37.751 -7.365 295 HA2 GLY 38 HA2 GLY 38 -15.600 38.932 -8.489 296 HA3 GLY 38 HA3 GLY 38 -14.544 38.883 -7.075 297 H GLU 39 H GLU 39 -15.738 35.751 -7.840 298 HA GLU 39 HA GLU 39 -13.021 34.917 -8.561 299 HB2 GLU 39 2HB GLU 39 -15.420 33.102 -8.772 300 HB3 GLU 39 3HB GLU 39 -13.758 32.721 -8.413 301 HG2 GLU 39 2HG GLU 39 -14.343 34.305 -6.263 302 HG3 GLU 39 3HG GLU 39 -15.980 33.790 -6.727 303 H GLU 40 H GLU 40 -12.259 35.122 -10.581 304 HA GLU 40 HA GLU 40 -14.116 35.343 -12.892 305 HB2 GLU 40 2HB GLU 40 -11.185 35.996 -12.487 306 HB3 GLU 40 3HB GLU 40 -11.993 36.101 -14.060 307 HG2 GLU 40 2HG GLU 40 -13.555 37.724 -13.280 308 HG3 GLU 40 3HG GLU 40 -13.020 37.581 -11.611 309 H PHE 41 H PHE 41 -14.380 33.875 -14.392 310 HA PHE 41 HA PHE 41 -12.405 31.659 -14.776 311 HB2 PHE 41 2HB PHE 41 -15.434 31.492 -14.716 312 HB3 PHE 41 3HB PHE 41 -14.377 30.190 -15.211 313 HD1 PHE 41 HD1 PHE 41 -15.538 32.175 -12.258 314 HD2 PHE 41 HD2 PHE 41 -13.051 28.911 -13.633 315 HE1 PHE 41 HE1 PHE 41 -15.225 31.410 -9.962 316 HE2 PHE 41 HE2 PHE 41 -12.715 28.182 -11.291 317 HZ PHE 41 HZ PHE 41 -13.789 29.444 -9.436 318 H GLU 42 H GLU 42 -12.633 30.546 -16.830 319 HA GLU 42 HA GLU 42 -13.400 32.385 -19.048 320 HB2 GLU 42 2HB GLU 42 -11.359 30.154 -19.157 321 HB3 GLU 42 3HB GLU 42 -11.819 31.250 -20.459 322 HG2 GLU 42 2HG GLU 42 -10.434 32.843 -19.811 323 HG3 GLU 42 3HG GLU 42 -10.993 32.806 -18.147 324 H VAL 43 H VAL 43 -14.742 31.752 -20.566 325 HA VAL 43 HA VAL 43 -15.763 28.932 -20.639 326 HB VAL 43 HB VAL 43 -17.412 31.414 -21.129 327 HG11 VAL 43 1HG1 VAL 43 -18.111 29.364 -22.392 328 HG12 VAL 43 2HG1 VAL 43 -18.224 28.492 -20.850 329 HG13 VAL 43 3HG1 VAL 43 -19.280 29.884 -21.193 330 HG21 VAL 43 3HG2 VAL 43 -18.532 30.999 -19.068 331 HG22 VAL 43 1HG2 VAL 43 -17.560 29.547 -18.737 332 HG23 VAL 43 2HG2 VAL 43 -16.830 31.175 -18.694 333 HA PRO 44 HA PRO 44 -14.452 29.511 -24.992 334 HB2 PRO 44 2HB PRO 44 -14.879 26.568 -24.999 335 HB3 PRO 44 3HB PRO 44 -13.492 27.491 -25.605 336 HG2 PRO 44 2HG PRO 44 -13.354 26.065 -23.276 337 HG3 PRO 44 3HG PRO 44 -12.559 27.665 -23.412 338 HD2 PRO 44 2HD PRO 44 -15.229 27.008 -22.151 339 HD3 PRO 44 3HD PRO 44 -13.913 28.091 -21.585 340 H PHE 45 H PHE 45 -15.862 30.042 -26.466 341 HA PHE 45 HA PHE 45 -18.493 28.605 -26.825 342 HB2 PHE 45 2HB PHE 45 -17.676 31.479 -27.275 343 HB3 PHE 45 3HB PHE 45 -19.056 30.807 -28.086 344 HD1 PHE 45 HD1 PHE 45 -17.610 31.591 -24.753 345 HD2 PHE 45 HD2 PHE 45 -21.159 30.472 -26.914 346 HE1 PHE 45 HE1 PHE 45 -18.970 32.004 -22.729 347 HE2 PHE 45 HE2 PHE 45 -22.533 30.950 -24.899 348 HZ PHE 45 HZ PHE 45 -21.427 31.663 -22.774 349 H ALA 46 H ALA 46 -19.078 27.974 -28.916 350 HA ALA 46 HA ALA 46 -16.838 27.650 -30.827 351 HB1 ALA 46 3HB ALA 46 -18.369 26.108 -31.974 352 HB2 ALA 46 1HB ALA 46 -18.240 25.699 -30.253 353 HB3 ALA 46 2HB ALA 46 -19.681 26.549 -30.860 354 H ASP 47 H ASP 47 -17.076 28.240 -33.094 355 HA ASP 47 HA ASP 47 -18.051 30.842 -33.615 356 HB2 ASP 47 2HB ASP 47 -16.261 29.697 -34.846 357 HB3 ASP 47 3HB ASP 47 -17.428 28.563 -35.532 358 H ASP 48 H ASP 48 -19.846 27.872 -33.618 359 HA ASP 48 HA ASP 48 -22.126 28.776 -35.204 360 HB2 ASP 48 2HB ASP 48 -21.417 26.396 -34.864 361 HB3 ASP 48 3HB ASP 48 -21.874 26.537 -33.168 362 H ALA 49 H ALA 49 -21.004 29.568 -32.101 363 HA ALA 49 HA ALA 49 -23.678 30.409 -31.065 364 HB1 ALA 49 3HB ALA 49 -21.195 29.565 -29.511 365 HB2 ALA 49 1HB ALA 49 -22.786 29.971 -28.837 366 HB3 ALA 49 2HB ALA 49 -22.598 28.517 -29.832 367 H GLU 50 H GLU 50 -23.389 32.140 -29.330 368 HA GLU 50 HA GLU 50 -21.230 34.100 -29.826 369 HB2 GLU 50 2HB GLU 50 -22.748 35.952 -29.884 370 HB3 GLU 50 3HB GLU 50 -23.199 34.806 -31.147 371 HG2 GLU 50 2HG GLU 50 -25.026 33.931 -29.659 372 HG3 GLU 50 3HG GLU 50 -24.598 35.151 -28.457 373 H ILE 51 H ILE 51 -21.098 35.702 -28.019 374 HA ILE 51 HA ILE 51 -21.223 34.387 -25.448 375 HB ILE 51 HB ILE 51 -20.202 37.178 -25.913 376 HG12 ILE 51 2HG1 ILE 51 -19.155 35.848 -27.671 377 HG13 ILE 51 3HG1 ILE 51 -17.985 36.350 -26.449 378 HG21 ILE 51 1HG2 ILE 51 -19.342 34.992 -23.979 379 HG22 ILE 51 2HG2 ILE 51 -18.707 36.632 -24.049 380 HG23 ILE 51 3HG2 ILE 51 -20.388 36.362 -23.568 381 HD11 ILE 51 3HD1 ILE 51 -19.202 33.584 -26.794 382 HD12 ILE 51 1HD1 ILE 51 -17.555 34.083 -27.216 383 HD13 ILE 51 2HD1 ILE 51 -18.042 34.028 -25.520 384 HA PRO 52 HA PRO 52 -24.978 36.849 -24.466 385 HB2 PRO 52 2HB PRO 52 -25.626 35.403 -22.216 386 HB3 PRO 52 3HB PRO 52 -26.058 34.899 -23.879 387 HG2 PRO 52 2HG PRO 52 -23.776 33.964 -22.138 388 HG3 PRO 52 3HG PRO 52 -24.854 32.995 -23.201 389 HD2 PRO 52 2HD PRO 52 -22.310 33.848 -23.891 390 HD3 PRO 52 3HD PRO 52 -23.578 33.555 -25.093 391 H GLY 53 H GLY 53 -25.289 38.402 -22.845 392 HA2 GLY 53 HA2 GLY 53 -23.190 39.755 -21.675 393 HA3 GLY 53 HA3 GLY 53 -24.848 39.818 -21.071 394 H THR 54 H THR 54 -24.860 36.962 -20.190 395 HA THR 54 HA THR 54 -22.653 36.803 -18.264 396 HB THR 54 HB THR 54 -24.250 36.223 -16.402 397 HG1 THR 54 HG1 THR 54 -26.475 36.597 -16.731 398 HG21 THR 54 1HG2 THR 54 -23.659 38.655 -16.752 399 HG22 THR 54 2HG2 THR 54 -25.204 38.863 -17.574 400 HG23 THR 54 3HG2 THR 54 -25.156 38.366 -15.863 401 H TRP 55 H TRP 55 -22.479 34.670 -17.181 402 HA TRP 55 HA TRP 55 -23.875 32.366 -18.337 403 HB2 TRP 55 2HB TRP 55 -22.097 33.026 -20.026 404 HB3 TRP 55 3HB TRP 55 -20.892 32.685 -18.795 405 HD1 TRP 55 HD1 TRP 55 -20.353 30.187 -18.305 406 HE1 TRP 55 HE1 TRP 55 -20.705 28.038 -19.612 407 HE3 TRP 55 HE3 TRP 55 -24.036 31.806 -21.427 408 HZ2 TRP 55 HZ2 TRP 55 -22.501 27.073 -21.705 409 HZ3 TRP 55 HZ3 TRP 55 -25.068 30.259 -23.081 410 HH2 TRP 55 HH2 TRP 55 -24.303 27.894 -23.231 411 H LEU 56 H LEU 56 -23.537 30.426 -17.125 412 HA LEU 56 HA LEU 56 -22.772 30.812 -14.380 413 HB2 LEU 56 2HB LEU 56 -24.405 29.055 -15.781 414 HB3 LEU 56 3HB LEU 56 -23.035 28.037 -15.330 415 HG LEU 56 HG LEU 56 -24.597 29.746 -13.355 416 HD11 LEU 56 1HD1 LEU 56 -24.886 26.781 -13.996 417 HD12 LEU 56 2HD1 LEU 56 -25.716 27.654 -12.686 418 HD13 LEU 56 3HD1 LEU 56 -26.070 28.053 -14.375 419 HD21 LEU 56 3HD2 LEU 56 -22.354 29.098 -12.556 420 HD22 LEU 56 1HD2 LEU 56 -23.603 28.207 -11.682 421 HD23 LEU 56 2HD2 LEU 56 -22.673 27.407 -12.971 422 H CYS 57 H CYS 57 -20.884 30.574 -13.420 423 HA CYS 57 HA CYS 57 -18.524 29.700 -14.994 424 HB2 CYS 57 2HB CYS 57 -18.881 31.308 -12.442 425 HB3 CYS 57 3HB CYS 57 -17.302 30.776 -13.037 426 HG CYS 57 HG CYS 57 -19.570 32.378 -14.829 427 H ARG 58 H ARG 58 -16.781 28.601 -13.830 428 HA ARG 58 HA ARG 58 -17.711 26.029 -13.061 429 HB2 ARG 58 2HB ARG 58 -14.859 27.008 -12.692 430 HB3 ARG 58 3HB ARG 58 -15.413 25.367 -13.015 431 HG2 ARG 58 2HG ARG 58 -16.167 26.121 -15.306 432 HG3 ARG 58 3HG ARG 58 -15.484 27.722 -14.957 433 HD2 ARG 58 2HD ARG 58 -13.258 26.564 -14.524 434 HD3 ARG 58 3HD ARG 58 -13.996 25.098 -15.200 435 HE ARG 58 HE ARG 58 -14.302 27.425 -16.939 436 HH11 ARG 58 1HH2 ARG 58 -12.005 24.897 -16.141 437 HH12 ARG 58 2HH2 ARG 58 -11.156 25.083 -17.651 438 HH21 ARG 58 2HH1 ARG 58 -13.152 27.672 -18.758 439 HH22 ARG 58 1HH1 ARG 58 -11.806 26.606 -19.119 440 H ASN 59 H ASN 59 -17.088 28.739 -11.067 441 HA ASN 59 HA ASN 59 -16.725 27.424 -8.549 442 HB2 ASN 59 2HB ASN 59 -16.169 29.733 -8.931 443 HB3 ASN 59 3HB ASN 59 -17.837 30.132 -9.361 444 HD21 ASN 59 1HD2 ASN 59 -17.902 31.805 -7.804 445 HD22 ASN 59 2HD2 ASN 59 -17.867 31.452 -6.089 446 H GLY 60 H GLY 60 -19.499 27.696 -10.602 447 HA2 GLY 60 HA2 GLY 60 -21.610 26.694 -10.311 448 HA3 GLY 60 HA3 GLY 60 -21.365 26.599 -8.564 449 H MET 61 H MET 61 -20.558 29.668 -9.951 450 HA MET 61 HA MET 61 -23.146 30.867 -9.093 451 HB2 MET 61 2HB MET 61 -21.118 31.333 -7.658 452 HB3 MET 61 3HB MET 61 -20.368 32.103 -9.031 453 HG2 MET 61 2HG MET 61 -21.383 33.732 -7.489 454 HG3 MET 61 3HG MET 61 -22.070 33.824 -9.106 455 HE1 MET 61 3HE MET 61 -24.235 32.277 -5.311 456 HE2 MET 61 1HE MET 61 -22.868 31.387 -6.009 457 HE3 MET 61 2HE MET 61 -22.622 33.021 -5.347 458 H GLU 62 H GLU 62 -24.005 32.539 -10.352 459 HA GLU 62 HA GLU 62 -23.495 32.484 -13.205 460 HB2 GLU 62 2HB GLU 62 -25.195 34.312 -11.473 461 HB3 GLU 62 3HB GLU 62 -25.112 34.388 -13.241 462 HG2 GLU 62 2HG GLU 62 -25.881 32.033 -13.388 463 HG3 GLU 62 3HG GLU 62 -26.005 31.956 -11.629 464 H GLY 63 H GLY 63 -21.728 33.292 -14.087 465 HA2 GLY 63 HA2 GLY 63 -20.302 35.577 -12.929 466 HA3 GLY 63 HA3 GLY 63 -19.740 34.593 -14.259 467 H THR 64 H THR 64 -20.001 37.557 -14.011 468 HA THR 64 HA THR 64 -21.709 38.047 -16.411 469 HB THR 64 HB THR 64 -20.536 40.050 -14.446 470 HG1 THR 64 HG1 THR 64 -22.238 38.865 -13.566 471 HG21 THR 64 1HG2 THR 64 -22.195 41.637 -15.539 472 HG22 THR 64 2HG2 THR 64 -20.815 41.195 -16.549 473 HG23 THR 64 3HG2 THR 64 -22.395 40.439 -16.838 474 H LEU 65 H LEU 65 -20.900 38.865 -18.267 475 HA LEU 65 HA LEU 65 -18.272 38.137 -18.979 476 HB2 LEU 65 2HB LEU 65 -20.393 38.262 -20.334 477 HB3 LEU 65 3HB LEU 65 -20.222 39.992 -20.384 478 HG LEU 65 HG LEU 65 -18.571 37.806 -21.704 479 HD11 LEU 65 1HD1 LEU 65 -20.017 40.259 -22.798 480 HD12 LEU 65 2HD1 LEU 65 -19.242 38.983 -23.758 481 HD13 LEU 65 3HD1 LEU 65 -20.664 38.607 -22.772 482 HD21 LEU 65 3HD2 LEU 65 -16.816 39.310 -21.092 483 HD22 LEU 65 1HD2 LEU 65 -17.174 39.576 -22.787 484 HD23 LEU 65 2HD2 LEU 65 -17.776 40.738 -21.583 485 H ILE 66 H ILE 66 -16.372 39.148 -18.674 486 HA ILE 66 HA ILE 66 -16.237 42.122 -18.502 487 HB ILE 66 HB ILE 66 -14.484 42.069 -16.903 488 HG12 ILE 66 2HG1 ILE 66 -13.313 39.995 -17.292 489 HG13 ILE 66 3HG1 ILE 66 -13.796 40.104 -15.609 490 HG21 ILE 66 1HG2 ILE 66 -16.880 40.504 -15.905 491 HG22 ILE 66 2HG2 ILE 66 -15.728 41.384 -14.906 492 HG23 ILE 66 3HG2 ILE 66 -16.746 42.262 -16.065 493 HD11 ILE 66 3HD1 ILE 66 -15.744 38.609 -16.156 494 HD12 ILE 66 1HD1 ILE 66 -14.929 38.342 -17.709 495 HD13 ILE 66 2HD1 ILE 66 -14.125 37.884 -16.197 496 H GLU 67 H GLU 67 -14.359 43.121 -19.274 497 HA GLU 67 HA GLU 67 -13.163 41.700 -21.571 498 HB2 GLU 67 2HB GLU 67 -12.976 44.614 -20.709 499 HB3 GLU 67 3HB GLU 67 -12.242 43.914 -22.142 500 HG2 GLU 67 2HG GLU 67 -14.202 44.976 -22.891 501 HG3 GLU 67 3HG GLU 67 -14.493 43.243 -22.980 502 H GLY 68 H GLY 68 -11.252 40.820 -21.612 503 HA2 GLY 68 HA2 GLY 68 -8.773 41.792 -20.781 504 HA3 GLY 68 HA3 GLY 68 -9.393 40.871 -19.393 505 H ASP 69 H ASP 69 -9.041 40.580 -22.980 506 HA ASP 69 HA ASP 69 -8.714 37.657 -22.802 507 HB2 ASP 69 2HB ASP 69 -10.575 39.132 -24.710 508 HB3 ASP 69 3HB ASP 69 -10.395 37.393 -24.523 509 H LEU 70 H LEU 70 -7.737 36.834 -24.573 510 HA LEU 70 HA LEU 70 -5.542 38.107 -25.777 511 HB2 LEU 70 2HB LEU 70 -7.068 35.633 -26.644 512 HB3 LEU 70 3HB LEU 70 -5.605 36.207 -27.427 513 HG LEU 70 HG LEU 70 -4.373 35.999 -25.239 514 HD11 LEU 70 1HD1 LEU 70 -6.920 34.563 -24.373 515 HD12 LEU 70 2HD1 LEU 70 -5.340 34.367 -23.581 516 HD13 LEU 70 3HD1 LEU 70 -6.122 35.938 -23.564 517 HD21 LEU 70 3HD2 LEU 70 -5.658 33.478 -26.364 518 HD22 LEU 70 1HD2 LEU 70 -4.238 34.315 -27.031 519 HD23 LEU 70 2HD2 LEU 70 -4.138 33.559 -25.438 520 HA PRO 71 HA PRO 71 -4.279 38.482 -27.668 521 HB2 PRO 71 2HB PRO 71 -4.069 41.114 -29.063 522 HB3 PRO 71 3HB PRO 71 -3.276 39.558 -29.445 523 HG2 PRO 71 2HG PRO 71 -5.330 40.483 -30.959 524 HG3 PRO 71 3HG PRO 71 -5.248 38.740 -30.522 525 HD2 PRO 71 2HD PRO 71 -6.793 40.946 -29.097 526 HD3 PRO 71 3HD PRO 71 -7.405 39.393 -29.733 527 H GLU 72 H GLU 72 -6.144 40.479 -25.836 528 HA GLU 72 HA GLU 72 -3.831 41.869 -24.545 529 HB2 GLU 72 2HB GLU 72 -6.568 43.036 -25.164 530 HB3 GLU 72 3HB GLU 72 -5.296 43.812 -24.213 531 HG2 GLU 72 2HG GLU 72 -3.800 43.548 -26.295 532 HG3 GLU 72 3HG GLU 72 -5.293 43.219 -27.187 533 HA PRO 73 HA PRO 73 -6.297 39.928 -21.105 534 HB2 PRO 73 2HB PRO 73 -4.865 37.788 -20.373 535 HB3 PRO 73 3HB PRO 73 -5.906 37.743 -21.828 536 HG2 PRO 73 2HG PRO 73 -2.906 38.262 -21.716 537 HG3 PRO 73 3HG PRO 73 -3.786 37.094 -22.747 538 HD2 PRO 73 2HD PRO 73 -3.078 39.624 -23.593 539 HD3 PRO 73 3HD PRO 73 -4.516 38.752 -24.180 540 H LYS 74 H LYS 74 -5.144 42.152 -20.966 541 HA LYS 74 HA LYS 74 -3.081 42.196 -18.773 542 HB2 LYS 74 2HB LYS 74 -1.733 43.744 -20.028 543 HB3 LYS 74 3HB LYS 74 -2.064 42.348 -21.050 544 HG2 LYS 74 2HG LYS 74 -3.923 43.670 -22.150 545 HG3 LYS 74 3HG LYS 74 -3.441 45.074 -21.191 546 HD2 LYS 74 2HD LYS 74 -1.183 45.012 -22.255 547 HD3 LYS 74 3HD LYS 74 -1.705 43.611 -23.225 548 HE2 LYS 74 2HE LYS 74 -3.646 45.022 -24.042 549 HE3 LYS 74 3HE LYS 74 -2.932 46.415 -23.236 550 HZ1 LYS 74 HZ1 LYS 74 -2.441 46.134 -25.662 551 HZ2 LYS 74 HZ2 LYS 74 -1.087 46.326 -24.735 552 HZ3 LYS 74 HZ3 LYS 74 -1.498 44.850 -25.316 553 H LYS 75 H LYS 75 -6.106 43.128 -19.209 554 HA LYS 75 HA LYS 75 -5.902 46.026 -18.953 555 HB2 LYS 75 2HB LYS 75 -8.323 44.199 -19.167 556 HB3 LYS 75 3HB LYS 75 -8.361 45.967 -19.248 557 HG2 LYS 75 2HG LYS 75 -6.887 45.940 -21.227 558 HG3 LYS 75 3HG LYS 75 -6.832 44.173 -21.182 559 HD2 LYS 75 2HD LYS 75 -9.308 44.102 -21.483 560 HD3 LYS 75 3HD LYS 75 -9.328 45.860 -21.669 561 HE2 LYS 75 2HE LYS 75 -7.673 43.955 -23.392 562 HE3 LYS 75 3HE LYS 75 -9.298 44.482 -23.831 563 HZ1 LYS 75 HZ1 LYS 75 -8.536 46.737 -23.989 564 HZ2 LYS 75 HZ2 LYS 75 -7.058 46.380 -23.391 565 HZ3 LYS 75 HZ3 LYS 75 -7.484 45.833 -24.863 566 H VAL 76 H VAL 76 -4.795 44.942 -16.730 567 HA VAL 76 HA VAL 76 -6.318 46.284 -14.581 568 HB VAL 76 HB VAL 76 -5.170 43.477 -14.212 569 HG11 VAL 76 1HG1 VAL 76 -4.895 44.872 -12.189 570 HG12 VAL 76 2HG1 VAL 76 -6.613 45.318 -12.252 571 HG13 VAL 76 3HG1 VAL 76 -6.127 43.640 -11.933 572 HG21 VAL 76 3HG2 VAL 76 -7.500 42.807 -13.660 573 HG22 VAL 76 1HG2 VAL 76 -8.071 44.412 -14.168 574 HG23 VAL 76 2HG2 VAL 76 -7.331 43.300 -15.343 575 H LYS 77 H LYS 77 -4.940 47.743 -13.764 576 HA LYS 77 HA LYS 77 -2.003 47.172 -13.542 577 HB2 LYS 77 2HB LYS 77 -3.243 49.585 -14.924 578 HB3 LYS 77 3HB LYS 77 -1.557 49.467 -14.405 579 HG2 LYS 77 2HG LYS 77 -1.250 47.478 -15.894 580 HG3 LYS 77 3HG LYS 77 -2.924 47.651 -16.438 581 HD2 LYS 77 2HD LYS 77 -1.496 48.616 -18.097 582 HD3 LYS 77 3HD LYS 77 -2.406 49.919 -17.319 583 HE2 LYS 77 2HE LYS 77 -0.423 50.463 -15.917 584 HE3 LYS 77 3HE LYS 77 0.470 49.124 -16.650 585 HZ1 LYS 77 HZ1 LYS 77 0.283 50.266 -18.796 586 HZ2 LYS 77 HZ2 LYS 77 -0.547 51.501 -18.119 587 HZ3 LYS 77 HZ3 LYS 77 1.010 51.241 -17.709 588 HA PRO 78 HA PRO 78 -3.911 48.527 -9.607 589 HB2 PRO 78 2HB PRO 78 -1.198 47.575 -8.685 590 HB3 PRO 78 3HB PRO 78 -2.787 47.419 -7.868 591 HG2 PRO 78 2HG PRO 78 -1.816 45.333 -9.275 592 HG3 PRO 78 3HG PRO 78 -3.535 45.803 -9.486 593 HD2 PRO 78 2HD PRO 78 -1.172 46.459 -11.264 594 HD3 PRO 78 3HD PRO 78 -2.810 45.906 -11.720 595 HA PRO 79 HA PRO 79 -4.075 49.808 -7.560 596 HB2 PRO 79 2HB PRO 79 -4.821 52.708 -7.706 597 HB3 PRO 79 3HB PRO 79 -4.610 51.661 -6.272 598 HG2 PRO 79 2HG PRO 79 -2.715 53.479 -6.930 599 HG3 PRO 79 3HG PRO 79 -2.224 51.826 -6.420 600 HD2 PRO 79 2HD PRO 79 -2.579 52.877 -9.255 601 HD3 PRO 79 3HD PRO 79 -1.165 52.052 -8.541 602 H ARG 80 H ARG 80 -4.444 50.651 -10.780 603 HA ARG 80 HA ARG 80 -7.421 50.256 -10.727 604 HB2 ARG 80 2HB ARG 80 -5.739 51.496 -12.926 605 HB3 ARG 80 3HB ARG 80 -7.486 51.289 -12.944 606 HG2 ARG 80 2HG ARG 80 -5.974 53.129 -11.022 607 HG3 ARG 80 3HG ARG 80 -6.715 53.611 -12.537 608 HD2 ARG 80 2HD ARG 80 -8.230 54.243 -10.848 609 HD3 ARG 80 3HD ARG 80 -8.949 52.845 -11.666 610 HE ARG 80 HE ARG 80 -7.488 51.826 -9.494 611 HH11 ARG 80 1HH1 ARG 80 -10.294 53.909 -9.771 612 HH12 ARG 80 2HH1 ARG 80 -10.911 53.393 -8.222 613 HH21 ARG 80 1HH2 ARG 80 -8.275 51.232 -7.636 614 HH22 ARG 80 2HH2 ARG 80 -9.778 51.888 -7.014 Start of MODEL 20 1 H1 SER 1 1H SER 1 7.885 7.745 -55.638 2 H2 SER 1 2H SER 1 9.522 7.861 -55.631 3 H3 SER 1 3H SER 1 8.637 8.757 -56.685 4 HA SER 1 HA SER 1 9.394 10.155 -54.902 5 HB2 SER 1 2HB SER 1 7.154 10.978 -54.113 6 HB3 SER 1 3HB SER 1 7.283 10.787 -55.866 7 HG SER 1 HG SER 1 5.331 9.905 -55.019 8 H MET 2 H MET 2 9.141 10.758 -52.602 9 HA MET 2 HA MET 2 9.801 8.532 -50.883 10 HB2 MET 2 2HB MET 2 9.331 11.473 -50.231 11 HB3 MET 2 3HB MET 2 9.976 10.264 -49.129 12 HG2 MET 2 2HG MET 2 11.865 11.387 -49.899 13 HG3 MET 2 3HG MET 2 11.858 9.854 -50.753 14 HE1 MET 2 3HE MET 2 9.954 13.352 -51.451 15 HE2 MET 2 1HE MET 2 11.613 13.732 -50.929 16 HE3 MET 2 2HE MET 2 11.110 14.050 -52.602 17 H ALA 3 H ALA 3 8.769 7.840 -48.971 18 HA ALA 3 HA ALA 3 5.886 7.665 -49.058 19 HB1 ALA 3 3HB ALA 3 6.179 6.351 -46.991 20 HB2 ALA 3 1HB ALA 3 7.307 5.827 -48.255 21 HB3 ALA 3 2HB ALA 3 7.883 6.840 -46.910 22 H ASP 4 H ASP 4 4.375 8.382 -47.490 23 HA ASP 4 HA ASP 4 4.761 11.121 -46.599 24 HB2 ASP 4 2HB ASP 4 2.668 10.368 -47.593 25 HB3 ASP 4 3HB ASP 4 2.442 9.177 -46.311 26 H ARG 5 H ARG 5 6.301 11.187 -45.030 27 HA ARG 5 HA ARG 5 5.708 10.062 -42.321 28 HB2 ARG 5 2HB ARG 5 8.371 9.899 -43.805 29 HB3 ARG 5 3HB ARG 5 8.095 9.397 -42.135 30 HG2 ARG 5 2HG ARG 5 6.471 7.676 -42.923 31 HG3 ARG 5 3HG ARG 5 6.838 8.105 -44.599 32 HD2 ARG 5 2HD ARG 5 8.848 7.065 -42.569 33 HD3 ARG 5 3HD ARG 5 8.060 6.107 -43.835 34 HE ARG 5 HE ARG 5 9.325 8.339 -45.070 35 HH11 ARG 5 1HH2 ARG 5 10.281 5.360 -43.495 36 HH12 ARG 5 2HH2 ARG 5 11.788 5.272 -44.366 37 HH21 ARG 5 1HH1 ARG 5 11.280 8.185 -46.125 38 HH22 ARG 5 2HH1 ARG 5 12.325 6.830 -45.822 39 H VAL 6 H VAL 6 7.110 10.999 -40.640 40 HA VAL 6 HA VAL 6 8.424 13.562 -41.254 41 HB VAL 6 HB VAL 6 6.111 14.130 -40.537 42 HG11 VAL 6 1HG1 VAL 6 5.755 12.330 -38.852 43 HG12 VAL 6 2HG1 VAL 6 6.928 13.125 -37.780 44 HG13 VAL 6 3HG1 VAL 6 5.427 13.953 -38.223 45 HG21 VAL 6 3HG2 VAL 6 6.746 15.911 -39.029 46 HG22 VAL 6 1HG2 VAL 6 8.262 15.098 -38.619 47 HG23 VAL 6 2HG2 VAL 6 7.991 15.708 -40.269 48 H LEU 7 H LEU 7 10.216 13.999 -39.988 49 HA LEU 7 HA LEU 7 11.354 11.605 -38.779 50 HB2 LEU 7 2HB LEU 7 13.435 12.607 -39.157 51 HB3 LEU 7 3HB LEU 7 12.465 12.889 -40.590 52 HG LEU 7 HG LEU 7 12.976 14.967 -38.409 53 HD11 LEU 7 1HD1 LEU 7 14.588 15.954 -39.979 54 HD12 LEU 7 2HD1 LEU 7 15.054 14.298 -39.572 55 HD13 LEU 7 3HD1 LEU 7 14.287 14.640 -41.139 56 HD21 LEU 7 3HD2 LEU 7 11.766 15.256 -41.185 57 HD22 LEU 7 1HD2 LEU 7 10.999 15.639 -39.613 58 HD23 LEU 7 2HD2 LEU 7 12.337 16.612 -40.193 59 H ARG 8 H ARG 8 9.913 14.389 -37.452 60 HA ARG 8 HA ARG 8 10.928 13.844 -34.736 61 HB2 ARG 8 2HB ARG 8 12.571 15.382 -35.863 62 HB3 ARG 8 3HB ARG 8 11.283 16.567 -36.074 63 HG2 ARG 8 2HG ARG 8 11.114 16.885 -33.659 64 HG3 ARG 8 3HG ARG 8 12.145 15.475 -33.356 65 HD2 ARG 8 2HD ARG 8 13.415 17.530 -33.025 66 HD3 ARG 8 3HD ARG 8 14.058 16.601 -34.391 67 HE ARG 8 HE ARG 8 12.080 18.651 -35.130 68 HH11 ARG 8 1HH2 ARG 8 15.523 18.202 -34.576 69 HH12 ARG 8 2HH2 ARG 8 15.948 19.538 -35.610 70 HH21 ARG 8 1HH1 ARG 8 12.677 20.284 -36.446 71 HH22 ARG 8 2HH1 ARG 8 14.369 20.705 -36.635 72 H GLY 9 H GLY 9 9.679 14.888 -33.076 73 HA2 GLY 9 HA2 GLY 9 7.660 15.576 -32.107 74 HA3 GLY 9 HA3 GLY 9 7.106 16.156 -33.679 75 H SER 10 H SER 10 5.027 15.195 -33.276 76 HA SER 10 HA SER 10 4.877 12.383 -34.142 77 HB2 SER 10 2HB SER 10 4.870 12.242 -31.666 78 HB3 SER 10 3HB SER 10 3.453 13.313 -31.619 79 HG SER 10 HG SER 10 3.040 10.961 -31.607 80 H ARG 11 H ARG 11 3.010 11.882 -35.244 81 HA ARG 11 HA ARG 11 1.683 14.144 -36.507 82 HB2 ARG 11 2HB ARG 11 1.232 11.153 -36.869 83 HB3 ARG 11 3HB ARG 11 0.588 12.436 -37.899 84 HG2 ARG 11 2HG ARG 11 2.994 13.169 -38.349 85 HG3 ARG 11 3HG ARG 11 3.522 11.719 -37.486 86 HD2 ARG 11 2HD ARG 11 3.590 11.163 -39.773 87 HD3 ARG 11 3HD ARG 11 2.158 10.343 -39.127 88 HE ARG 11 HE ARG 11 1.305 12.857 -40.113 89 HH11 ARG 11 1HH2 ARG 11 2.653 9.919 -41.547 90 HH12 ARG 11 2HH2 ARG 11 1.966 10.338 -43.112 91 HH21 ARG 11 1HH1 ARG 11 0.474 13.199 -42.204 92 HH22 ARG 11 2HH1 ARG 11 0.865 12.000 -43.440 93 H LEU 12 H LEU 12 0.832 12.254 -33.788 94 HA LEU 12 HA LEU 12 -1.954 13.272 -33.809 95 HB2 LEU 12 2HB LEU 12 -2.267 11.997 -31.745 96 HB3 LEU 12 3HB LEU 12 -1.832 11.042 -33.147 97 HG LEU 12 HG LEU 12 0.456 10.741 -32.305 98 HD11 LEU 12 1HD1 LEU 12 0.967 11.318 -29.918 99 HD12 LEU 12 2HD1 LEU 12 0.852 12.731 -30.961 100 HD13 LEU 12 3HD1 LEU 12 -0.500 12.320 -29.877 101 HD21 LEU 12 3HD2 LEU 12 -1.329 9.141 -31.726 102 HD22 LEU 12 1HD2 LEU 12 -0.117 9.257 -30.441 103 HD23 LEU 12 2HD2 LEU 12 -1.688 10.069 -30.252 104 H GLY 13 H GLY 13 0.845 14.742 -33.319 105 HA2 GLY 13 HA2 GLY 13 0.884 17.025 -32.696 106 HA3 GLY 13 HA3 GLY 13 -0.293 16.734 -31.419 107 H ALA 14 H ALA 14 2.554 17.851 -31.615 108 HA ALA 14 HA ALA 14 3.422 16.872 -28.997 109 HB1 ALA 14 3HB ALA 14 5.273 16.799 -31.427 110 HB2 ALA 14 1HB ALA 14 5.760 16.514 -29.742 111 HB3 ALA 14 2HB ALA 14 4.658 15.379 -30.544 112 H VAL 15 H VAL 15 4.743 18.433 -27.901 113 HA VAL 15 HA VAL 15 4.768 21.137 -29.152 114 HB VAL 15 HB VAL 15 4.576 22.054 -26.860 115 HG11 VAL 15 1HG1 VAL 15 2.233 20.385 -27.857 116 HG12 VAL 15 2HG1 VAL 15 2.141 21.790 -26.774 117 HG13 VAL 15 3HG1 VAL 15 2.696 21.998 -28.441 118 HG21 VAL 15 3HG2 VAL 15 5.136 20.047 -25.503 119 HG22 VAL 15 1HG2 VAL 15 3.558 20.721 -25.089 120 HG23 VAL 15 2HG2 VAL 15 3.652 19.253 -26.078 121 H SER 16 H SER 16 8.194 21.668 -28.314 122 HA SER 16 HA SER 16 5.846 23.048 -29.319 123 HB2 SER 16 2HB SER 16 7.530 24.426 -30.491 124 HB3 SER 16 3HB SER 16 7.870 24.257 -28.763 125 HG SER 16 HG SER 16 9.750 23.951 -30.051 126 H TYR 17 H TYR 17 5.903 23.618 -31.796 127 HA TYR 17 HA TYR 17 5.054 20.982 -32.795 128 HB2 TYR 17 2HB TYR 17 3.865 23.634 -32.534 129 HB3 TYR 17 3HB TYR 17 3.673 23.028 -34.158 130 HD1 TYR 17 HD2 TYR 17 2.728 20.698 -34.519 131 HD2 TYR 17 HD1 TYR 17 2.425 22.815 -30.782 132 HE1 TYR 17 HE2 TYR 17 0.825 19.258 -33.898 133 HE2 TYR 17 HE1 TYR 17 0.512 21.362 -30.125 134 HH TYR 17 HH TYR 17 -0.844 18.876 -32.326 135 H GLU 18 H GLU 18 5.601 20.095 -34.553 136 HA GLU 18 HA GLU 18 6.348 21.666 -36.984 137 HB2 GLU 18 2HB GLU 18 7.621 19.063 -36.036 138 HB3 GLU 18 3HB GLU 18 7.922 19.835 -37.598 139 HG2 GLU 18 2HG GLU 18 8.801 21.851 -36.446 140 HG3 GLU 18 3HG GLU 18 8.575 21.056 -34.882 141 H THR 19 H THR 19 4.080 19.778 -35.641 142 HA THR 19 HA THR 19 3.222 18.389 -38.134 143 HB THR 19 HB THR 19 2.293 16.630 -36.634 144 HG1 THR 19 HG1 THR 19 2.952 16.589 -34.532 145 HG21 THR 19 1HG2 THR 19 5.281 17.052 -36.220 146 HG22 THR 19 2HG2 THR 19 4.388 15.520 -36.174 147 HG23 THR 19 3HG2 THR 19 4.545 16.399 -37.701 148 H ASP 20 H ASP 20 2.412 21.087 -37.060 149 HA ASP 20 HA ASP 20 -0.299 20.837 -36.089 150 HB2 ASP 20 2HB ASP 20 1.218 22.739 -35.575 151 HB3 ASP 20 3HB ASP 20 1.142 23.237 -37.267 152 H ARG 21 H ARG 21 -2.225 21.526 -37.128 153 HA ARG 21 HA ARG 21 -2.555 20.427 -39.802 154 HB2 ARG 21 2HB ARG 21 -4.944 20.870 -39.481 155 HB3 ARG 21 3HB ARG 21 -4.217 20.028 -38.124 156 HG2 ARG 21 2HG ARG 21 -5.535 21.520 -36.995 157 HG3 ARG 21 3HG ARG 21 -4.029 22.421 -37.029 158 HD2 ARG 21 2HD ARG 21 -5.025 23.524 -39.214 159 HD3 ARG 21 3HD ARG 21 -6.535 22.793 -38.687 160 HE ARG 21 HE ARG 21 -6.726 24.406 -37.013 161 HH11 ARG 21 1HH1 ARG 21 -3.379 24.580 -38.151 162 HH12 ARG 21 2HH1 ARG 21 -3.050 25.924 -37.104 163 HH21 ARG 21 1HH2 ARG 21 -6.315 26.128 -35.951 164 HH22 ARG 21 2HH2 ARG 21 -4.721 26.885 -35.931 165 H ASN 22 H ASN 22 -3.093 21.389 -41.704 166 HA ASN 22 HA ASN 22 -1.645 23.742 -42.273 167 HB2 ASN 22 2HB ASN 22 -1.964 21.873 -43.833 168 HB3 ASN 22 3HB ASN 22 -3.695 22.203 -43.930 169 HD21 ASN 22 1HD2 ASN 22 -4.427 23.831 -45.354 170 HD22 ASN 22 2HD2 ASN 22 -3.308 24.747 -46.359 171 H HIS 23 H HIS 23 -5.183 23.337 -42.030 172 HA HIS 23 HA HIS 23 -5.565 26.251 -41.697 173 HB2 HIS 23 2HB HIS 23 -7.358 26.289 -43.394 174 HB3 HIS 23 3HB HIS 23 -5.780 25.969 -44.099 175 HD2 HIS 23 HD2 HIS 23 -9.207 24.338 -43.529 176 HE1 HIS 23 HE1 HIS 23 -6.971 21.614 -45.935 177 HE2 HIS 23 HE2 HIS 23 -9.269 22.129 -44.968 178 H ASP 24 H ASP 24 -7.443 26.799 -40.555 179 HA ASP 24 HA ASP 24 -8.208 24.692 -38.728 180 HB2 ASP 24 2HB ASP 24 -7.699 27.210 -38.275 181 HB3 ASP 24 3HB ASP 24 -9.415 27.448 -38.639 182 H LEU 25 H LEU 25 -10.290 24.270 -37.963 183 HA LEU 25 HA LEU 25 -12.603 24.583 -39.770 184 HB2 LEU 25 2HB LEU 25 -11.516 21.914 -38.783 185 HB3 LEU 25 3HB LEU 25 -13.133 22.125 -39.443 186 HG LEU 25 HG LEU 25 -10.556 22.622 -41.004 187 HD11 LEU 25 1HD1 LEU 25 -10.865 20.249 -40.427 188 HD12 LEU 25 2HD1 LEU 25 -12.512 20.290 -41.095 189 HD13 LEU 25 3HD1 LEU 25 -11.106 20.527 -42.158 190 HD21 LEU 25 3HD2 LEU 25 -12.055 22.594 -42.983 191 HD22 LEU 25 1HD2 LEU 25 -13.471 22.480 -41.914 192 HD23 LEU 25 2HD2 LEU 25 -12.451 23.935 -41.907 193 H ALA 26 H ALA 26 -14.385 24.954 -38.654 194 HA ALA 26 HA ALA 26 -15.747 25.566 -36.953 195 HB1 ALA 26 3HB ALA 26 -16.244 23.844 -35.291 196 HB2 ALA 26 1HB ALA 26 -16.076 23.154 -36.918 197 HB3 ALA 26 2HB ALA 26 -14.763 22.968 -35.737 198 HA PRO 27 HA PRO 27 -12.325 27.570 -34.546 199 HB2 PRO 27 2HB PRO 27 -13.930 30.017 -35.232 200 HB3 PRO 27 3HB PRO 27 -12.155 29.781 -35.261 201 HG2 PRO 27 2HG PRO 27 -13.562 29.803 -37.572 202 HG3 PRO 27 3HG PRO 27 -12.281 28.567 -37.325 203 HD2 PRO 27 2HD PRO 27 -15.268 28.283 -36.850 204 HD3 PRO 27 3HD PRO 27 -14.186 27.237 -37.821 205 H ARG 28 H ARG 28 -12.462 29.179 -32.718 206 HA ARG 28 HA ARG 28 -15.000 29.148 -31.201 207 HB2 ARG 28 2HB ARG 28 -14.091 28.145 -29.257 208 HB3 ARG 28 3HB ARG 28 -13.717 27.097 -30.625 209 HG2 ARG 28 2HG ARG 28 -11.389 27.994 -30.674 210 HG3 ARG 28 3HG ARG 28 -11.774 29.024 -29.276 211 HD2 ARG 28 2HD ARG 28 -12.306 27.013 -27.938 212 HD3 ARG 28 3HD ARG 28 -11.900 25.982 -29.327 213 HE ARG 28 HE ARG 28 -9.663 27.633 -28.864 214 HH11 ARG 28 1HH2 ARG 28 -11.296 25.061 -27.132 215 HH12 ARG 28 2HH2 ARG 28 -9.854 24.607 -26.266 216 HH21 ARG 28 1HH1 ARG 28 -7.860 26.995 -27.730 217 HH22 ARG 28 2HH1 ARG 28 -7.963 25.674 -26.605 218 H GLN 29 H GLN 29 -14.885 30.297 -29.169 219 HA GLN 29 HA GLN 29 -13.297 32.820 -29.185 220 HB2 GLN 29 2HB GLN 29 -16.288 32.599 -28.655 221 HB3 GLN 29 3HB GLN 29 -15.324 34.071 -28.629 222 HG2 GLN 29 2HG GLN 29 -15.683 34.425 -30.819 223 HG3 GLN 29 3HG GLN 29 -15.058 32.832 -31.245 224 HE21 GLN 29 1HE2 GLN 29 -16.778 31.060 -30.163 225 HE22 GLN 29 2HE2 GLN 29 -18.378 31.270 -30.875 226 H ILE 30 H ILE 30 -12.288 32.822 -27.328 227 HA ILE 30 HA ILE 30 -13.404 31.569 -24.875 228 HB ILE 30 HB ILE 30 -10.685 32.881 -25.153 229 HG12 ILE 30 2HG1 ILE 30 -10.632 31.163 -26.817 230 HG13 ILE 30 3HG1 ILE 30 -9.704 30.648 -25.422 231 HG21 ILE 30 1HG2 ILE 30 -11.461 32.594 -22.856 232 HG22 ILE 30 2HG2 ILE 30 -11.866 30.894 -23.157 233 HG23 ILE 30 3HG2 ILE 30 -10.172 31.432 -23.188 234 HD11 ILE 30 3HD1 ILE 30 -10.962 28.784 -26.319 235 HD12 ILE 30 1HD1 ILE 30 -11.589 29.190 -24.714 236 HD13 ILE 30 2HD1 ILE 30 -12.485 29.674 -26.185 237 H ALA 31 H ALA 31 -14.883 32.831 -23.920 238 HA ALA 31 HA ALA 31 -14.281 35.716 -23.428 239 HB1 ALA 31 3HB ALA 31 -16.827 34.085 -23.111 240 HB2 ALA 31 1HB ALA 31 -16.646 35.791 -22.645 241 HB3 ALA 31 2HB ALA 31 -16.473 35.321 -24.343 242 H ARG 32 H ARG 32 -14.574 36.508 -21.256 243 HA ARG 32 HA ARG 32 -14.138 34.508 -19.069 244 HB2 ARG 32 2HB ARG 32 -12.859 37.184 -19.573 245 HB3 ARG 32 3HB ARG 32 -13.208 36.734 -17.903 246 HG2 ARG 32 2HG ARG 32 -11.825 34.845 -17.916 247 HG3 ARG 32 3HG ARG 32 -11.753 34.785 -19.682 248 HD2 ARG 32 2HD ARG 32 -9.655 35.599 -18.959 249 HD3 ARG 32 3HD ARG 32 -10.528 36.973 -19.665 250 HE ARG 32 HE ARG 32 -11.032 37.100 -16.902 251 HH11 ARG 32 2HH1 ARG 32 -8.129 37.241 -18.886 252 HH12 ARG 32 1HH1 ARG 32 -7.413 38.461 -17.863 253 HH21 ARG 32 2HH2 ARG 32 -10.030 38.586 -15.649 254 HH22 ARG 32 1HH2 ARG 32 -8.441 39.192 -16.096 255 H TYR 33 H TYR 33 -15.188 34.831 -17.135 256 HA TYR 33 HA TYR 33 -17.229 36.955 -17.000 257 HB2 TYR 33 2HB TYR 33 -17.890 34.025 -16.563 258 HB3 TYR 33 3HB TYR 33 -18.926 35.368 -16.179 259 HD1 TYR 33 HD2 TYR 33 -17.221 33.675 -19.059 260 HD2 TYR 33 HD1 TYR 33 -20.418 36.221 -17.735 261 HE1 TYR 33 HE2 TYR 33 -18.316 33.489 -21.294 262 HE2 TYR 33 HE1 TYR 33 -21.471 36.077 -19.985 263 HH TYR 33 HH TYR 33 -21.442 35.110 -21.981 264 H ARG 34 H ARG 34 -17.625 37.674 -14.992 265 HA ARG 34 HA ARG 34 -15.942 36.677 -12.734 266 HB2 ARG 34 2HB ARG 34 -15.540 38.967 -13.681 267 HB3 ARG 34 3HB ARG 34 -17.186 39.417 -13.253 268 HG2 ARG 34 2HG ARG 34 -16.710 39.152 -10.874 269 HG3 ARG 34 3HG ARG 34 -15.105 38.484 -11.219 270 HD2 ARG 34 2HD ARG 34 -14.469 40.636 -12.325 271 HD3 ARG 34 3HD ARG 34 -16.079 41.259 -11.970 272 HE ARG 34 HE ARG 34 -15.570 41.427 -9.677 273 HH11 ARG 34 1HH1 ARG 34 -12.654 40.348 -11.422 274 HH12 ARG 34 2HH1 ARG 34 -11.665 40.703 -10.037 275 HH21 ARG 34 1HH2 ARG 34 -14.178 41.875 -8.034 276 HH22 ARG 34 2HH2 ARG 34 -12.480 41.554 -8.213 277 H THR 35 H THR 35 -16.854 35.856 -11.001 278 HA THR 35 HA THR 35 -19.760 35.540 -10.814 279 HB THR 35 HB THR 35 -19.332 34.122 -8.873 280 HG1 THR 35 HG1 THR 35 -16.619 34.548 -9.376 281 HG21 THR 35 1HG2 THR 35 -18.039 32.371 -9.920 282 HG22 THR 35 2HG2 THR 35 -19.227 33.076 -11.040 283 HG23 THR 35 3HG2 THR 35 -17.503 33.475 -11.202 284 H ASP 36 H ASP 36 -20.574 35.645 -8.346 285 HA ASP 36 HA ASP 36 -20.512 38.447 -7.715 286 HB2 ASP 36 2HB ASP 36 -22.530 36.965 -7.569 287 HB3 ASP 36 3HB ASP 36 -21.791 36.138 -6.195 288 H ASN 37 H ASN 37 -18.493 35.833 -6.600 289 HA ASN 37 HA ASN 37 -17.665 37.433 -4.225 290 HB2 ASN 37 2HB ASN 37 -16.258 34.968 -5.080 291 HB3 ASN 37 3HB ASN 37 -16.370 35.692 -3.514 292 HD21 ASN 37 1HD2 ASN 37 -16.888 32.979 -4.544 293 HD22 ASN 37 2HD2 ASN 37 -18.489 32.581 -3.877 294 H GLY 38 H GLY 38 -17.153 37.820 -7.433 295 HA2 GLY 38 HA2 GLY 38 -15.551 38.985 -8.633 296 HA3 GLY 38 HA3 GLY 38 -14.440 38.969 -7.257 297 H GLU 39 H GLU 39 -15.624 35.819 -7.881 298 HA GLU 39 HA GLU 39 -12.944 34.978 -8.696 299 HB2 GLU 39 2HB GLU 39 -15.336 33.144 -8.829 300 HB3 GLU 39 3HB GLU 39 -13.666 32.783 -8.489 301 HG2 GLU 39 2HG GLU 39 -14.220 34.385 -6.352 302 HG3 GLU 39 3HG GLU 39 -15.863 33.854 -6.779 303 H GLU 40 H GLU 40 -12.244 35.173 -10.753 304 HA GLU 40 HA GLU 40 -14.203 35.237 -12.988 305 HB2 GLU 40 2HB GLU 40 -11.327 36.135 -12.715 306 HB3 GLU 40 3HB GLU 40 -12.103 35.921 -14.297 307 HG2 GLU 40 2HG GLU 40 -13.902 37.439 -13.680 308 HG3 GLU 40 3HG GLU 40 -13.200 37.661 -12.066 309 H PHE 41 H PHE 41 -14.455 33.783 -14.452 310 HA PHE 41 HA PHE 41 -12.483 31.560 -14.825 311 HB2 PHE 41 2HB PHE 41 -15.512 31.415 -14.775 312 HB3 PHE 41 3HB PHE 41 -14.467 30.110 -15.263 313 HD1 PHE 41 HD1 PHE 41 -15.531 32.155 -12.268 314 HD2 PHE 41 HD2 PHE 41 -13.289 28.732 -13.700 315 HE1 PHE 41 HE1 PHE 41 -15.195 31.385 -9.982 316 HE2 PHE 41 HE2 PHE 41 -12.929 28.000 -11.364 317 HZ PHE 41 HZ PHE 41 -13.860 29.339 -9.488 318 H GLU 42 H GLU 42 -12.727 30.452 -16.927 319 HA GLU 42 HA GLU 42 -13.349 32.375 -19.105 320 HB2 GLU 42 2HB GLU 42 -11.447 30.037 -19.368 321 HB3 GLU 42 3HB GLU 42 -11.683 31.415 -20.431 322 HG2 GLU 42 2HG GLU 42 -9.795 32.179 -19.466 323 HG3 GLU 42 3HG GLU 42 -10.883 32.752 -18.209 324 H VAL 43 H VAL 43 -14.783 31.803 -20.598 325 HA VAL 43 HA VAL 43 -15.859 29.010 -20.615 326 HB VAL 43 HB VAL 43 -17.428 31.490 -21.252 327 HG11 VAL 43 1HG1 VAL 43 -19.325 29.991 -21.302 328 HG12 VAL 43 2HG1 VAL 43 -18.140 29.421 -22.464 329 HG13 VAL 43 3HG1 VAL 43 -18.295 28.592 -20.902 330 HG21 VAL 43 3HG2 VAL 43 -16.881 31.285 -18.789 331 HG22 VAL 43 1HG2 VAL 43 -18.584 31.184 -19.190 332 HG23 VAL 43 2HG2 VAL 43 -17.676 29.698 -18.809 333 HA PRO 44 HA PRO 44 -14.419 29.406 -24.943 334 HB2 PRO 44 2HB PRO 44 -14.390 26.730 -25.527 335 HB3 PRO 44 3HB PRO 44 -13.083 27.539 -24.623 336 HG2 PRO 44 2HG PRO 44 -15.363 25.913 -23.514 337 HG3 PRO 44 3HG PRO 44 -13.634 25.877 -23.052 338 HD2 PRO 44 2HD PRO 44 -15.559 27.259 -21.669 339 HD3 PRO 44 3HD PRO 44 -13.863 27.831 -21.729 340 H PHE 45 H PHE 45 -15.812 29.892 -26.494 341 HA PHE 45 HA PHE 45 -18.423 28.411 -26.813 342 HB2 PHE 45 2HB PHE 45 -17.667 31.301 -27.283 343 HB3 PHE 45 3HB PHE 45 -19.040 30.598 -28.073 344 HD1 PHE 45 HD1 PHE 45 -17.625 31.634 -24.818 345 HD2 PHE 45 HD2 PHE 45 -21.103 30.060 -26.825 346 HE1 PHE 45 HE1 PHE 45 -19.021 32.163 -22.841 347 HE2 PHE 45 HE2 PHE 45 -22.481 30.552 -24.813 348 HZ PHE 45 HZ PHE 45 -21.421 31.603 -22.809 349 H ALA 46 H ALA 46 -18.994 27.731 -28.857 350 HA ALA 46 HA ALA 46 -16.832 27.507 -30.864 351 HB1 ALA 46 3HB ALA 46 -18.369 25.947 -31.976 352 HB2 ALA 46 1HB ALA 46 -18.162 25.513 -30.271 353 HB3 ALA 46 2HB ALA 46 -19.646 26.337 -30.804 354 H ASP 47 H ASP 47 -17.186 28.107 -33.105 355 HA ASP 47 HA ASP 47 -18.161 30.707 -33.569 356 HB2 ASP 47 2HB ASP 47 -16.448 29.525 -34.893 357 HB3 ASP 47 3HB ASP 47 -17.675 28.429 -35.529 358 H ASP 48 H ASP 48 -19.992 27.762 -33.508 359 HA ASP 48 HA ASP 48 -22.321 28.672 -35.004 360 HB2 ASP 48 2HB ASP 48 -21.640 26.291 -34.634 361 HB3 ASP 48 3HB ASP 48 -22.019 26.480 -32.925 362 H ALA 49 H ALA 49 -21.078 29.494 -31.937 363 HA ALA 49 HA ALA 49 -23.699 30.510 -30.916 364 HB1 ALA 49 3HB ALA 49 -21.313 29.473 -29.337 365 HB2 ALA 49 1HB ALA 49 -22.839 30.087 -28.664 366 HB3 ALA 49 2HB ALA 49 -22.832 28.588 -29.613 367 H GLU 50 H GLU 50 -23.563 32.409 -29.550 368 HA GLU 50 HA GLU 50 -21.133 34.109 -29.816 369 HB2 GLU 50 2HB GLU 50 -23.985 34.950 -30.440 370 HB3 GLU 50 3HB GLU 50 -22.719 36.102 -29.994 371 HG2 GLU 50 2HG GLU 50 -21.327 35.398 -31.880 372 HG3 GLU 50 3HG GLU 50 -22.517 34.180 -32.337 373 H ILE 51 H ILE 51 -20.644 35.267 -28.111 374 HA ILE 51 HA ILE 51 -21.147 34.347 -25.572 375 HB ILE 51 HB ILE 51 -20.149 37.152 -26.077 376 HG12 ILE 51 2HG1 ILE 51 -18.975 35.779 -27.707 377 HG13 ILE 51 3HG1 ILE 51 -17.892 36.308 -26.425 378 HG21 ILE 51 1HG2 ILE 51 -18.738 36.704 -24.112 379 HG22 ILE 51 2HG2 ILE 51 -20.438 36.452 -23.695 380 HG23 ILE 51 3HG2 ILE 51 -19.378 35.067 -23.994 381 HD11 ILE 51 3HD1 ILE 51 -17.423 34.013 -27.086 382 HD12 ILE 51 1HD1 ILE 51 -18.026 34.018 -25.428 383 HD13 ILE 51 2HD1 ILE 51 -19.098 33.530 -26.761 384 HA PRO 52 HA PRO 52 -24.925 36.713 -24.578 385 HB2 PRO 52 2HB PRO 52 -25.648 35.203 -22.428 386 HB3 PRO 52 3HB PRO 52 -25.958 34.694 -24.118 387 HG2 PRO 52 2HG PRO 52 -23.737 33.832 -22.260 388 HG3 PRO 52 3HG PRO 52 -24.726 32.825 -23.374 389 HD2 PRO 52 2HD PRO 52 -22.177 33.802 -23.940 390 HD3 PRO 52 3HD PRO 52 -23.354 33.401 -25.193 391 H GLY 53 H GLY 53 -25.232 38.249 -22.993 392 HA2 GLY 53 HA2 GLY 53 -23.159 39.589 -21.791 393 HA3 GLY 53 HA3 GLY 53 -24.835 39.690 -21.241 394 H THR 54 H THR 54 -24.910 36.865 -20.268 395 HA THR 54 HA THR 54 -22.719 36.739 -18.328 396 HB THR 54 HB THR 54 -24.321 36.152 -16.471 397 HG1 THR 54 HG1 THR 54 -26.549 36.492 -16.818 398 HG21 THR 54 1HG2 THR 54 -25.323 38.277 -15.962 399 HG22 THR 54 2HG2 THR 54 -23.773 38.582 -16.740 400 HG23 THR 54 3HG2 THR 54 -25.264 38.788 -17.665 401 H TRP 55 H TRP 55 -22.536 34.611 -17.239 402 HA TRP 55 HA TRP 55 -23.863 32.279 -18.404 403 HB2 TRP 55 2HB TRP 55 -22.116 32.975 -20.100 404 HB3 TRP 55 3HB TRP 55 -20.891 32.676 -18.874 405 HD1 TRP 55 HD1 TRP 55 -20.304 30.180 -18.336 406 HE1 TRP 55 HE1 TRP 55 -20.608 28.008 -19.629 407 HE3 TRP 55 HE3 TRP 55 -23.953 31.703 -21.529 408 HZ2 TRP 55 HZ2 TRP 55 -22.394 26.974 -21.687 409 HZ3 TRP 55 HZ3 TRP 55 -24.982 30.102 -23.149 410 HH2 TRP 55 HH2 TRP 55 -24.201 27.743 -23.236 411 H LEU 56 H LEU 56 -23.431 30.333 -17.207 412 HA LEU 56 HA LEU 56 -22.748 30.785 -14.440 413 HB2 LEU 56 2HB LEU 56 -24.303 28.960 -15.857 414 HB3 LEU 56 3HB LEU 56 -22.926 27.986 -15.337 415 HG LEU 56 HG LEU 56 -24.596 29.706 -13.460 416 HD11 LEU 56 1HD1 LEU 56 -24.784 26.716 -14.028 417 HD12 LEU 56 2HD1 LEU 56 -25.681 27.601 -12.770 418 HD13 LEU 56 3HD1 LEU 56 -25.987 27.946 -14.480 419 HD21 LEU 56 3HD2 LEU 56 -23.616 28.249 -11.708 420 HD22 LEU 56 1HD2 LEU 56 -22.628 27.430 -12.941 421 HD23 LEU 56 2HD2 LEU 56 -22.362 29.141 -12.574 422 H CYS 57 H CYS 57 -20.876 30.580 -13.418 423 HA CYS 57 HA CYS 57 -18.466 29.697 -14.900 424 HB2 CYS 57 2HB CYS 57 -18.904 31.273 -12.336 425 HB3 CYS 57 3HB CYS 57 -17.316 30.728 -12.887 426 HG CYS 57 HG CYS 57 -17.514 33.227 -13.514 427 H ARG 58 H ARG 58 -16.794 28.453 -13.758 428 HA ARG 58 HA ARG 58 -17.872 25.967 -12.841 429 HB2 ARG 58 2HB ARG 58 -14.970 26.876 -12.705 430 HB3 ARG 58 3HB ARG 58 -15.565 25.222 -12.627 431 HG2 ARG 58 2HG ARG 58 -16.471 25.477 -14.965 432 HG3 ARG 58 3HG ARG 58 -15.748 27.094 -15.029 433 HD2 ARG 58 2HD ARG 58 -14.248 25.583 -16.145 434 HD3 ARG 58 3HD ARG 58 -13.503 26.118 -14.645 435 HE ARG 58 HE ARG 58 -13.574 23.955 -13.803 436 HH11 ARG 58 1HH2 ARG 58 -15.505 23.958 -16.733 437 HH12 ARG 58 2HH2 ARG 58 -15.628 22.220 -16.754 438 HH21 ARG 58 1HH1 ARG 58 -13.782 21.752 -13.894 439 HH22 ARG 58 2HH1 ARG 58 -14.677 21.013 -15.188 440 H ASN 59 H ASN 59 -17.082 28.744 -10.983 441 HA ASN 59 HA ASN 59 -16.751 27.494 -8.426 442 HB2 ASN 59 2HB ASN 59 -16.137 29.777 -8.851 443 HB3 ASN 59 3HB ASN 59 -17.798 30.209 -9.283 444 HD21 ASN 59 1HD2 ASN 59 -17.802 31.910 -7.742 445 HD22 ASN 59 2HD2 ASN 59 -17.769 31.572 -6.024 446 H GLY 60 H GLY 60 -19.512 27.803 -10.483 447 HA2 GLY 60 HA2 GLY 60 -21.606 26.767 -10.211 448 HA3 GLY 60 HA3 GLY 60 -21.387 26.698 -8.461 449 H MET 61 H MET 61 -20.586 29.766 -9.860 450 HA MET 61 HA MET 61 -23.241 30.896 -9.128 451 HB2 MET 61 2HB MET 61 -21.254 31.481 -7.639 452 HB3 MET 61 3HB MET 61 -20.552 32.318 -9.000 453 HG2 MET 61 2HG MET 61 -21.746 33.845 -7.475 454 HG3 MET 61 3HG MET 61 -22.409 33.881 -9.107 455 HE1 MET 61 3HE MET 61 -25.622 34.637 -7.056 456 HE2 MET 61 1HE MET 61 -23.990 35.186 -6.628 457 HE3 MET 61 2HE MET 61 -24.507 35.169 -8.333 458 H GLU 62 H GLU 62 -24.123 32.496 -10.442 459 HA GLU 62 HA GLU 62 -23.524 32.416 -13.275 460 HB2 GLU 62 2HB GLU 62 -25.311 34.233 -11.620 461 HB3 GLU 62 3HB GLU 62 -25.179 34.285 -13.385 462 HG2 GLU 62 2HG GLU 62 -25.901 31.918 -13.523 463 HG3 GLU 62 3HG GLU 62 -26.065 31.856 -11.766 464 H GLY 63 H GLY 63 -21.739 33.247 -14.108 465 HA2 GLY 63 HA2 GLY 63 -20.388 35.574 -12.951 466 HA3 GLY 63 HA3 GLY 63 -19.799 34.582 -14.269 467 H THR 64 H THR 64 -20.102 37.547 -14.040 468 HA THR 64 HA THR 64 -21.787 38.003 -16.461 469 HB THR 64 HB THR 64 -20.618 40.026 -14.518 470 HG1 THR 64 HG1 THR 64 -22.736 40.229 -13.807 471 HG21 THR 64 1HG2 THR 64 -22.504 40.374 -16.901 472 HG22 THR 64 2HG2 THR 64 -22.294 41.596 -15.626 473 HG23 THR 64 3HG2 THR 64 -20.926 41.140 -16.641 474 H LEU 65 H LEU 65 -20.975 38.827 -18.320 475 HA LEU 65 HA LEU 65 -18.342 38.117 -19.035 476 HB2 LEU 65 2HB LEU 65 -20.454 38.234 -20.394 477 HB3 LEU 65 3HB LEU 65 -20.316 39.972 -20.411 478 HG LEU 65 HG LEU 65 -18.629 37.846 -21.784 479 HD11 LEU 65 1HD1 LEU 65 -20.758 38.624 -22.809 480 HD12 LEU 65 2HD1 LEU 65 -20.143 40.288 -22.814 481 HD13 LEU 65 3HD1 LEU 65 -19.355 39.045 -23.805 482 HD21 LEU 65 3HD2 LEU 65 -17.914 40.798 -21.612 483 HD22 LEU 65 1HD2 LEU 65 -16.910 39.392 -21.149 484 HD23 LEU 65 2HD2 LEU 65 -17.286 39.674 -22.840 485 H ILE 66 H ILE 66 -16.457 39.134 -18.694 486 HA ILE 66 HA ILE 66 -16.338 42.106 -18.505 487 HB ILE 66 HB ILE 66 -14.624 42.062 -16.868 488 HG12 ILE 66 2HG1 ILE 66 -13.397 40.047 -17.202 489 HG13 ILE 66 3HG1 ILE 66 -13.989 40.062 -15.543 490 HG21 ILE 66 1HG2 ILE 66 -15.871 41.469 -14.897 491 HG22 ILE 66 2HG2 ILE 66 -16.950 42.186 -16.107 492 HG23 ILE 66 3HG2 ILE 66 -16.957 40.435 -15.835 493 HD11 ILE 66 3HD1 ILE 66 -14.845 38.374 -17.831 494 HD12 ILE 66 1HD1 ILE 66 -14.215 37.871 -16.254 495 HD13 ILE 66 2HD1 ILE 66 -15.860 38.537 -16.374 496 H GLU 67 H GLU 67 -14.416 43.109 -19.176 497 HA GLU 67 HA GLU 67 -12.888 41.763 -21.292 498 HB2 GLU 67 2HB GLU 67 -12.575 44.490 -19.974 499 HB3 GLU 67 3HB GLU 67 -11.580 43.885 -21.307 500 HG2 GLU 67 2HG GLU 67 -13.622 43.637 -22.714 501 HG3 GLU 67 3HG GLU 67 -14.600 44.312 -21.409 502 H GLY 68 H GLY 68 -10.714 41.184 -21.201 503 HA2 GLY 68 HA2 GLY 68 -9.926 39.852 -18.864 504 HA3 GLY 68 HA3 GLY 68 -8.926 40.082 -20.297 505 H ASP 69 H ASP 69 -9.317 43.116 -19.579 506 HA ASP 69 HA ASP 69 -8.204 44.811 -18.694 507 HB2 ASP 69 2HB ASP 69 -9.225 44.008 -16.629 508 HB3 ASP 69 3HB ASP 69 -7.784 43.056 -16.267 509 H LEU 70 H LEU 70 -6.375 45.853 -18.930 510 HA LEU 70 HA LEU 70 -3.762 44.463 -18.727 511 HB2 LEU 70 2HB LEU 70 -4.671 46.280 -20.985 512 HB3 LEU 70 3HB LEU 70 -2.999 45.810 -20.717 513 HG LEU 70 HG LEU 70 -5.218 43.803 -21.288 514 HD11 LEU 70 1HD1 LEU 70 -4.295 43.714 -23.561 515 HD12 LEU 70 2HD1 LEU 70 -4.907 45.332 -23.187 516 HD13 LEU 70 3HD1 LEU 70 -3.156 45.022 -23.166 517 HD21 LEU 70 3HD2 LEU 70 -2.172 43.563 -21.333 518 HD22 LEU 70 1HD2 LEU 70 -3.263 42.809 -20.147 519 HD23 LEU 70 2HD2 LEU 70 -3.321 42.303 -21.838 520 HA PRO 71 HA PRO 71 -2.866 48.096 -16.321 521 HB2 PRO 71 2HB PRO 71 -0.204 47.861 -15.900 522 HB3 PRO 71 3HB PRO 71 -1.340 46.596 -15.365 523 HG2 PRO 71 2HG PRO 71 0.254 46.654 -17.959 524 HG3 PRO 71 3HG PRO 71 0.201 45.345 -16.733 525 HD2 PRO 71 2HD PRO 71 -1.402 45.338 -18.954 526 HD3 PRO 71 3HD PRO 71 -1.959 44.691 -17.383 527 H GLU 72 H GLU 72 -3.417 48.863 -18.913 528 HA GLU 72 HA GLU 72 -2.848 49.967 -20.874 529 HB2 GLU 72 2HB GLU 72 -2.134 51.810 -18.602 530 HB3 GLU 72 3HB GLU 72 -2.414 52.361 -20.272 531 HG2 GLU 72 2HG GLU 72 -4.740 51.524 -20.125 532 HG3 GLU 72 3HG GLU 72 -4.468 51.072 -18.435 533 HA PRO 73 HA PRO 73 1.362 48.246 -19.956 534 HB2 PRO 73 2HB PRO 73 1.372 48.057 -22.982 535 HB3 PRO 73 3HB PRO 73 2.234 47.008 -21.798 536 HG2 PRO 73 2HG PRO 73 -0.207 46.284 -22.652 537 HG3 PRO 73 3HG PRO 73 0.164 46.186 -20.905 538 HD2 PRO 73 2HD PRO 73 -1.509 48.207 -22.367 539 HD3 PRO 73 3HD PRO 73 -1.677 47.569 -20.706 540 H LYS 74 H LYS 74 2.531 49.597 -19.112 541 HA LYS 74 HA LYS 74 4.248 51.609 -20.444 542 HB2 LYS 74 2HB LYS 74 3.344 53.445 -19.070 543 HB3 LYS 74 3HB LYS 74 2.097 52.758 -20.096 544 HG2 LYS 74 2HG LYS 74 1.361 51.364 -18.047 545 HG3 LYS 74 3HG LYS 74 2.458 52.361 -17.093 546 HD2 LYS 74 2HD LYS 74 1.195 54.386 -17.719 547 HD3 LYS 74 3HD LYS 74 0.141 53.422 -18.777 548 HE2 LYS 74 2HE LYS 74 -0.550 52.051 -16.797 549 HE3 LYS 74 3HE LYS 74 0.439 53.088 -15.763 550 HZ1 LYS 74 HZ1 LYS 74 -2.000 53.904 -17.279 551 HZ2 LYS 74 HZ2 LYS 74 -1.804 53.864 -15.673 552 HZ3 LYS 74 HZ3 LYS 74 -0.995 54.979 -16.546 553 H LYS 75 H LYS 75 5.563 52.796 -18.656 554 HA LYS 75 HA LYS 75 6.979 50.904 -17.019 555 HB2 LYS 75 2HB LYS 75 7.917 53.008 -17.952 556 HB3 LYS 75 3HB LYS 75 6.962 53.956 -16.816 557 HG2 LYS 75 2HG LYS 75 8.837 51.782 -15.822 558 HG3 LYS 75 3HG LYS 75 9.494 53.333 -16.339 559 HD2 LYS 75 2HD LYS 75 8.308 54.553 -14.650 560 HD3 LYS 75 3HD LYS 75 7.322 53.156 -14.221 561 HE2 LYS 75 2HE LYS 75 9.496 51.940 -13.627 562 HE3 LYS 75 3HE LYS 75 10.309 53.505 -13.772 563 HZ1 LYS 75 HZ1 LYS 75 8.801 54.343 -12.031 564 HZ2 LYS 75 HZ2 LYS 75 8.052 52.882 -11.933 565 HZ3 LYS 75 HZ3 LYS 75 9.618 53.040 -11.479 566 H VAL 76 H VAL 76 6.724 50.248 -14.958 567 HA VAL 76 HA VAL 76 4.087 50.531 -13.842 568 HB VAL 76 HB VAL 76 6.499 49.069 -12.716 569 HG11 VAL 76 1HG1 VAL 76 4.794 47.725 -11.492 570 HG12 VAL 76 2HG1 VAL 76 4.809 49.402 -10.958 571 HG13 VAL 76 3HG1 VAL 76 3.524 48.833 -12.052 572 HG21 VAL 76 3HG2 VAL 76 5.401 47.059 -13.682 573 HG22 VAL 76 1HG2 VAL 76 4.163 48.094 -14.426 574 HG23 VAL 76 2HG2 VAL 76 5.859 48.203 -14.942 575 H LYS 77 H LYS 77 3.311 51.810 -12.362 576 HA LYS 77 HA LYS 77 4.951 52.864 -10.124 577 HB2 LYS 77 2HB LYS 77 4.978 54.612 -11.873 578 HB3 LYS 77 3HB LYS 77 3.212 54.649 -11.875 579 HG2 LYS 77 2HG LYS 77 3.274 55.266 -9.427 580 HG3 LYS 77 3HG LYS 77 5.037 55.312 -9.510 581 HD2 LYS 77 2HD LYS 77 3.131 57.067 -11.125 582 HD3 LYS 77 3HD LYS 77 3.969 57.551 -9.644 583 HE2 LYS 77 2HE LYS 77 6.164 57.172 -10.771 584 HE3 LYS 77 3HE LYS 77 5.314 56.752 -12.265 585 HZ1 LYS 77 HZ1 LYS 77 4.366 58.999 -12.276 586 HZ2 LYS 77 HZ2 LYS 77 5.154 59.387 -10.898 587 HZ3 LYS 77 HZ3 LYS 77 5.995 59.082 -12.262 588 HA PRO 78 HA PRO 78 1.114 50.849 -8.792 589 HB2 PRO 78 2HB PRO 78 2.472 51.036 -6.104 590 HB3 PRO 78 3HB PRO 78 1.592 49.655 -6.828 591 HG2 PRO 78 2HG PRO 78 4.291 49.675 -6.839 592 HG3 PRO 78 3HG PRO 78 3.408 49.193 -8.327 593 HD2 PRO 78 2HD PRO 78 4.613 51.898 -7.655 594 HD3 PRO 78 3HD PRO 78 4.770 50.932 -9.152 595 HA PRO 79 HA PRO 79 -0.712 50.274 -7.383 596 HB2 PRO 79 2HB PRO 79 -3.365 50.819 -7.318 597 HB3 PRO 79 3HB PRO 79 -2.348 50.852 -5.845 598 HG2 PRO 79 2HG PRO 79 -3.173 53.204 -7.585 599 HG3 PRO 79 3HG PRO 79 -3.308 53.049 -5.803 600 HD2 PRO 79 2HD PRO 79 -1.201 54.317 -6.998 601 HD3 PRO 79 3HD PRO 79 -0.991 53.355 -5.506 602 H ARG 80 H ARG 80 -1.873 49.179 -9.069 603 HA ARG 80 HA ARG 80 -1.393 50.236 -11.714 604 HB2 ARG 80 2HB ARG 80 -2.104 48.128 -12.545 605 HB3 ARG 80 3HB ARG 80 -1.111 47.850 -11.116 606 HG2 ARG 80 2HG ARG 80 -3.245 47.551 -9.776 607 HG3 ARG 80 3HG ARG 80 -4.158 47.685 -11.283 608 HD2 ARG 80 2HD ARG 80 -2.078 45.567 -10.607 609 HD3 ARG 80 3HD ARG 80 -3.821 45.333 -10.595 610 HE ARG 80 HE ARG 80 -2.051 45.258 -12.880 611 HH11 ARG 80 1HH2 ARG 80 -5.439 45.962 -12.107 612 HH12 ARG 80 2HH2 ARG 80 -5.904 45.532 -13.759 613 HH21 ARG 80 1HH1 ARG 80 -2.903 44.678 -14.897 614 HH22 ARG 80 2HH1 ARG 80 -4.641 44.900 -15.141 Start of MODEL 21 1 H1 SER 1 1H SER 1 -30.936 26.854 -27.098 2 H2 SER 1 2H SER 1 -31.449 25.796 -25.951 3 H3 SER 1 3H SER 1 -30.892 25.242 -27.390 4 HA SER 1 HA SER 1 -29.293 26.689 -25.391 5 HB2 SER 1 2HB SER 1 -29.237 23.720 -26.061 6 HB3 SER 1 3HB SER 1 -28.209 24.564 -24.883 7 HG SER 1 HG SER 1 -30.030 23.577 -23.890 8 H MET 2 H MET 2 -27.029 26.819 -25.843 9 HA MET 2 HA MET 2 -26.138 26.188 -28.610 10 HB2 MET 2 2HB MET 2 -25.314 28.431 -28.989 11 HB3 MET 2 3HB MET 2 -27.046 28.456 -28.688 12 HG2 MET 2 2HG MET 2 -26.648 29.186 -26.357 13 HG3 MET 2 3HG MET 2 -24.903 29.158 -26.639 14 HE1 MET 2 3HE MET 2 -25.782 32.964 -26.265 15 HE2 MET 2 1HE MET 2 -26.578 31.606 -25.443 16 HE3 MET 2 2HE MET 2 -24.812 31.607 -25.650 17 H ALA 3 H ALA 3 -25.460 25.051 -25.940 18 HA ALA 3 HA ALA 3 -22.786 25.963 -25.279 19 HB1 ALA 3 3HB ALA 3 -24.415 25.191 -23.590 20 HB2 ALA 3 1HB ALA 3 -24.363 23.555 -24.291 21 HB3 ALA 3 2HB ALA 3 -22.913 24.254 -23.539 22 H ASP 4 H ASP 4 -23.236 24.772 -28.043 23 HA ASP 4 HA ASP 4 -22.034 22.221 -28.311 24 HB2 ASP 4 2HB ASP 4 -22.197 24.561 -30.252 25 HB3 ASP 4 3HB ASP 4 -21.714 22.924 -30.690 26 H ARG 5 H ARG 5 -19.993 21.571 -29.054 27 HA ARG 5 HA ARG 5 -17.743 23.303 -28.112 28 HB2 ARG 5 2HB ARG 5 -17.721 20.323 -27.978 29 HB3 ARG 5 3HB ARG 5 -16.701 21.450 -27.109 30 HG2 ARG 5 2HG ARG 5 -19.717 21.221 -26.525 31 HG3 ARG 5 3HG ARG 5 -18.552 20.073 -25.904 32 HD2 ARG 5 3HD ARG 5 -18.796 21.628 -24.172 33 HD3 ARG 5 2HD ARG 5 -17.223 21.987 -24.911 34 HE ARG 5 HE ARG 5 -19.726 23.424 -25.736 35 HH11 ARG 5 1HH2 ARG 5 -16.656 23.879 -24.065 36 HH12 ARG 5 2HH2 ARG 5 -16.664 25.590 -24.483 37 HH21 ARG 5 2HH1 ARG 5 -19.378 25.460 -26.466 38 HH22 ARG 5 1HH1 ARG 5 -18.176 26.449 -25.632 39 H VAL 6 H VAL 6 -18.524 23.287 -30.771 40 HA VAL 6 HA VAL 6 -17.920 22.994 -32.955 41 HB VAL 6 HB VAL 6 -15.083 22.453 -32.044 42 HG11 VAL 6 1HG1 VAL 6 -16.182 23.733 -34.596 43 HG12 VAL 6 2HG1 VAL 6 -14.470 23.444 -34.203 44 HG13 VAL 6 3HG1 VAL 6 -15.542 22.084 -34.489 45 HG21 VAL 6 3HG2 VAL 6 -16.388 25.153 -32.578 46 HG22 VAL 6 1HG2 VAL 6 -15.820 24.568 -30.996 47 HG23 VAL 6 2HG2 VAL 6 -14.663 24.867 -32.291 48 H LEU 7 H LEU 7 -19.325 21.040 -32.122 49 HA LEU 7 HA LEU 7 -17.983 18.438 -32.328 50 HB2 LEU 7 2HB LEU 7 -20.860 19.168 -31.725 51 HB3 LEU 7 3HB LEU 7 -20.216 17.529 -31.721 52 HG LEU 7 HG LEU 7 -19.298 19.774 -29.871 53 HD11 LEU 7 1HD1 LEU 7 -20.999 17.318 -29.305 54 HD12 LEU 7 2HD1 LEU 7 -20.455 18.522 -28.116 55 HD13 LEU 7 3HD1 LEU 7 -21.588 18.991 -29.394 56 HD21 LEU 7 3HD2 LEU 7 -17.462 18.199 -30.196 57 HD22 LEU 7 1HD2 LEU 7 -18.180 17.923 -28.611 58 HD23 LEU 7 2HD2 LEU 7 -18.560 16.816 -29.945 59 H ARG 8 H ARG 8 -19.257 17.359 -35.514 60 HA ARG 8 HA ARG 8 -18.275 16.201 -33.054 61 HB2 ARG 8 2HB ARG 8 -19.060 14.975 -35.095 62 HB3 ARG 8 3HB ARG 8 -17.626 15.540 -35.960 63 HG2 ARG 8 2HG ARG 8 -16.190 14.319 -34.299 64 HG3 ARG 8 3HG ARG 8 -17.666 13.743 -33.491 65 HD2 ARG 8 2HD ARG 8 -18.362 12.679 -35.661 66 HD3 ARG 8 3HD ARG 8 -16.823 13.209 -36.369 67 HE ARG 8 HE ARG 8 -16.581 11.602 -33.916 68 HH11 ARG 8 2HH2 ARG 8 -16.744 11.371 -37.410 69 HH12 ARG 8 1HH2 ARG 8 -16.028 9.783 -37.429 70 HH21 ARG 8 1HH1 ARG 8 -15.711 9.556 -34.016 71 HH22 ARG 8 2HH1 ARG 8 -15.465 8.790 -35.557 72 H GLY 9 H GLY 9 -16.227 16.187 -32.175 73 HA2 GLY 9 HA2 GLY 9 -14.631 18.472 -32.498 74 HA3 GLY 9 HA3 GLY 9 -14.152 17.037 -31.604 75 H SER 10 H SER 10 -12.637 18.939 -33.341 76 HA SER 10 HA SER 10 -11.864 17.952 -35.830 77 HB2 SER 10 2HB SER 10 -10.047 19.335 -33.823 78 HB3 SER 10 3HB SER 10 -9.908 19.363 -35.589 79 HG SER 10 HG SER 10 -11.710 20.638 -35.720 80 H ARG 11 H ARG 11 -10.348 16.537 -36.613 81 HA ARG 11 HA ARG 11 -8.540 15.006 -34.869 82 HB2 ARG 11 2HB ARG 11 -9.589 12.831 -35.328 83 HB3 ARG 11 3HB ARG 11 -10.653 13.910 -34.450 84 HG2 ARG 11 2HG ARG 11 -11.741 14.460 -36.765 85 HG3 ARG 11 3HG ARG 11 -10.818 13.086 -37.382 86 HD2 ARG 11 2HD ARG 11 -13.066 12.366 -36.801 87 HD3 ARG 11 3HD ARG 11 -11.911 11.626 -35.682 88 HE ARG 11 HE ARG 11 -13.284 14.186 -34.939 89 HH11 ARG 11 1HH2 ARG 11 -12.866 10.791 -34.125 90 HH12 ARG 11 2HH2 ARG 11 -13.432 11.050 -32.496 91 HH21 ARG 11 1HH1 ARG 11 -13.933 14.426 -32.952 92 HH22 ARG 11 2HH1 ARG 11 -14.103 13.072 -31.853 93 H LEU 12 H LEU 12 -7.391 13.333 -35.982 94 HA LEU 12 HA LEU 12 -5.828 12.651 -37.368 95 HB2 LEU 12 2HB LEU 12 -7.808 13.344 -39.538 96 HB3 LEU 12 3HB LEU 12 -6.398 12.306 -39.722 97 HG LEU 12 HG LEU 12 -8.799 11.717 -37.935 98 HD11 LEU 12 1HD1 LEU 12 -7.917 10.478 -40.574 99 HD12 LEU 12 2HD1 LEU 12 -9.307 9.975 -39.584 100 HD13 LEU 12 3HD1 LEU 12 -9.299 11.573 -40.346 101 HD21 LEU 12 3HD2 LEU 12 -6.361 10.011 -38.611 102 HD22 LEU 12 1HD2 LEU 12 -6.786 10.658 -37.008 103 HD23 LEU 12 2HD2 LEU 12 -7.815 9.441 -37.762 104 H GLY 13 H GLY 13 -4.142 13.039 -38.778 105 HA2 GLY 13 HA2 GLY 13 -3.352 15.913 -39.028 106 HA3 GLY 13 HA3 GLY 13 -2.274 14.529 -38.931 107 H ALA 14 H ALA 14 -1.309 15.682 -40.763 108 HA ALA 14 HA ALA 14 -0.760 15.942 -42.921 109 HB1 ALA 14 3HB ALA 14 -0.753 13.886 -44.215 110 HB2 ALA 14 1HB ALA 14 -0.407 13.540 -42.512 111 HB3 ALA 14 2HB ALA 14 -2.019 13.192 -43.181 112 H VAL 15 H VAL 15 -3.250 17.237 -42.385 113 HA VAL 15 HA VAL 15 -5.015 16.913 -44.661 114 HB VAL 15 HB VAL 15 -5.823 17.679 -42.502 115 HG11 VAL 15 1HG1 VAL 15 -4.358 20.292 -43.035 116 HG12 VAL 15 2HG1 VAL 15 -5.519 19.986 -41.730 117 HG13 VAL 15 3HG1 VAL 15 -3.972 19.128 -41.751 118 HG21 VAL 15 3HG2 VAL 15 -7.058 18.207 -44.586 119 HG22 VAL 15 1HG2 VAL 15 -7.335 19.374 -43.290 120 HG23 VAL 15 2HG2 VAL 15 -6.264 19.802 -44.632 121 H SER 16 H SER 16 -5.185 18.077 -46.545 122 HA SER 16 HA SER 16 -2.617 18.871 -47.521 123 HB2 SER 16 2HB SER 16 -4.346 17.414 -48.655 124 HB3 SER 16 3HB SER 16 -5.189 18.900 -49.106 125 HG SER 16 HG SER 16 -3.199 19.566 -50.132 126 H TYR 17 H TYR 17 -4.922 20.826 -46.151 127 HA TYR 17 HA TYR 17 -4.021 23.331 -47.508 128 HB2 TYR 17 2HB TYR 17 -6.478 23.930 -47.611 129 HB3 TYR 17 3HB TYR 17 -5.921 22.652 -48.682 130 HD1 TYR 17 HD1 TYR 17 -7.784 23.293 -45.519 131 HD2 TYR 17 HD2 TYR 17 -6.754 20.415 -48.551 132 HE1 TYR 17 HE1 TYR 17 -9.397 21.689 -44.530 133 HE2 TYR 17 HE2 TYR 17 -8.294 18.767 -47.523 134 HH TYR 17 HH TYR 17 -10.314 19.577 -44.658 135 H GLU 18 H GLU 18 -3.880 21.974 -44.772 136 HA GLU 18 HA GLU 18 -3.835 22.474 -42.558 137 HB2 GLU 18 2HB GLU 18 -2.445 24.324 -42.021 138 HB3 GLU 18 3HB GLU 18 -1.887 23.500 -43.465 139 HG2 GLU 18 2HG GLU 18 -2.724 25.298 -44.895 140 HG3 GLU 18 3HG GLU 18 -3.468 26.108 -43.512 141 H THR 19 H THR 19 -6.548 22.885 -43.387 142 HA THR 19 HA THR 19 -7.330 24.374 -40.943 143 HB THR 19 HB THR 19 -9.327 25.272 -41.893 144 HG1 THR 19 HG1 THR 19 -9.492 25.258 -44.240 145 HG21 THR 19 1HG2 THR 19 -7.032 26.068 -43.721 146 HG22 THR 19 2HG2 THR 19 -8.461 27.033 -43.297 147 HG23 THR 19 3HG2 THR 19 -7.249 26.655 -42.060 148 H ASP 20 H ASP 20 -9.480 23.750 -40.108 149 HA ASP 20 HA ASP 20 -10.119 20.881 -40.660 150 HB2 ASP 20 2HB ASP 20 -9.451 21.337 -38.334 151 HB3 ASP 20 3HB ASP 20 -10.704 22.576 -38.207 152 H ARG 21 H ARG 21 -12.201 20.350 -41.179 153 HA ARG 21 HA ARG 21 -14.039 20.582 -42.513 154 HB2 ARG 21 2HB ARG 21 -15.959 21.254 -41.271 155 HB3 ARG 21 3HB ARG 21 -14.804 20.447 -40.230 156 HG2 ARG 21 2HG ARG 21 -14.075 22.863 -39.489 157 HG3 ARG 21 3HG ARG 21 -15.558 23.383 -40.290 158 HD2 ARG 21 2HD ARG 21 -16.079 23.096 -37.987 159 HD3 ARG 21 3HD ARG 21 -16.783 21.695 -38.818 160 HE ARG 21 HE ARG 21 -14.024 21.392 -37.732 161 HH11 ARG 21 1HH1 ARG 21 -17.410 20.609 -37.018 162 HH12 ARG 21 2HH1 ARG 21 -16.862 19.310 -35.961 163 HH21 ARG 21 1HH2 ARG 21 -13.556 19.827 -36.493 164 HH22 ARG 21 2HH2 ARG 21 -14.820 18.876 -35.665 165 H ASN 22 H ASN 22 -12.118 22.529 -43.334 166 HA ASN 22 HA ASN 22 -11.767 24.330 -44.580 167 HB2 ASN 22 2HB ASN 22 -13.323 22.990 -46.069 168 HB3 ASN 22 3HB ASN 22 -14.614 24.090 -45.585 169 HD21 ASN 22 2HD2 ASN 22 -14.805 24.656 -47.870 170 HD22 ASN 22 1HD2 ASN 22 -13.631 25.750 -48.588 171 H HIS 23 H HIS 23 -12.728 24.810 -41.860 172 HA HIS 23 HA HIS 23 -13.508 27.684 -42.084 173 HB2 HIS 23 2HB HIS 23 -14.682 25.652 -40.149 174 HB3 HIS 23 3HB HIS 23 -14.951 27.390 -40.089 175 HD2 HIS 23 HD2 HIS 23 -15.647 27.987 -43.150 176 HE1 HIS 23 HE1 HIS 23 -18.872 25.262 -42.549 177 HE2 HIS 23 HE2 HIS 23 -17.981 27.138 -44.025 178 H ASP 24 H ASP 24 -10.983 27.353 -41.987 179 HA ASP 24 HA ASP 24 -9.031 27.782 -40.886 180 HB2 ASP 24 2HB ASP 24 -10.808 29.054 -38.783 181 HB3 ASP 24 3HB ASP 24 -9.089 29.335 -39.010 182 H LEU 25 H LEU 25 -8.134 27.823 -38.293 183 HA LEU 25 HA LEU 25 -8.665 25.084 -37.245 184 HB2 LEU 25 2HB LEU 25 -6.154 26.782 -36.988 185 HB3 LEU 25 3HB LEU 25 -6.443 25.284 -36.109 186 HG LEU 25 HG LEU 25 -6.254 25.504 -39.143 187 HD11 LEU 25 1HD1 LEU 25 -4.075 24.397 -38.865 188 HD12 LEU 25 2HD1 LEU 25 -4.106 25.950 -38.019 189 HD13 LEU 25 3HD1 LEU 25 -4.262 24.437 -37.095 190 HD21 LEU 25 3HD2 LEU 25 -6.363 23.056 -37.317 191 HD22 LEU 25 1HD2 LEU 25 -7.632 23.566 -38.451 192 HD23 LEU 25 2HD2 LEU 25 -6.067 23.029 -39.069 193 H ALA 26 H ALA 26 -9.087 24.908 -35.063 194 HA ALA 26 HA ALA 26 -10.173 25.482 -33.152 195 HB1 ALA 26 3HB ALA 26 -8.874 27.019 -31.729 196 HB2 ALA 26 1HB ALA 26 -7.825 25.900 -32.626 197 HB3 ALA 26 2HB ALA 26 -7.983 27.588 -33.156 198 HA PRO 27 HA PRO 27 -12.626 29.097 -34.875 199 HB2 PRO 27 2HB PRO 27 -14.870 27.903 -35.809 200 HB3 PRO 27 3HB PRO 27 -13.335 27.885 -36.720 201 HG2 PRO 27 2HG PRO 27 -14.408 25.727 -34.874 202 HG3 PRO 27 3HG PRO 27 -13.838 25.539 -36.565 203 HD2 PRO 27 2HD PRO 27 -12.203 25.057 -34.429 204 HD3 PRO 27 3HD PRO 27 -11.594 25.794 -35.942 205 H ARG 28 H ARG 28 -12.323 29.230 -32.448 206 HA ARG 28 HA ARG 28 -14.966 29.256 -31.115 207 HB2 ARG 28 2HB ARG 28 -14.131 28.215 -29.122 208 HB3 ARG 28 3HB ARG 28 -13.865 27.169 -30.519 209 HG2 ARG 28 2HG ARG 28 -11.469 27.798 -30.568 210 HG3 ARG 28 3HG ARG 28 -11.744 28.923 -29.229 211 HD2 ARG 28 2HD ARG 28 -10.811 26.961 -28.271 212 HD3 ARG 28 3HD ARG 28 -12.504 26.991 -27.814 213 HE ARG 28 HE ARG 28 -12.966 25.162 -29.243 214 HH11 ARG 28 1HH2 ARG 28 -9.546 25.912 -29.411 215 HH12 ARG 28 2HH2 ARG 28 -9.163 24.391 -30.167 216 HH21 ARG 28 1HH1 ARG 28 -12.403 23.254 -30.218 217 HH22 ARG 28 2HH1 ARG 28 -10.744 22.943 -30.626 218 H GLN 29 H GLN 29 -14.949 30.409 -29.063 219 HA GLN 29 HA GLN 29 -13.383 32.963 -29.121 220 HB2 GLN 29 2HB GLN 29 -16.384 32.694 -28.727 221 HB3 GLN 29 3HB GLN 29 -15.460 34.188 -28.745 222 HG2 GLN 29 2HG GLN 29 -15.672 34.387 -30.978 223 HG3 GLN 29 3HG GLN 29 -15.059 32.756 -31.259 224 HE21 GLN 29 1HE2 GLN 29 -16.800 31.071 -30.178 225 HE22 GLN 29 2HE2 GLN 29 -18.389 31.249 -30.928 226 H ILE 30 H ILE 30 -12.246 32.574 -27.247 227 HA ILE 30 HA ILE 30 -13.510 31.738 -24.764 228 HB ILE 30 HB ILE 30 -10.753 32.870 -25.343 229 HG12 ILE 30 2HG1 ILE 30 -9.932 30.641 -24.925 230 HG13 ILE 30 3HG1 ILE 30 -11.548 30.050 -24.543 231 HG21 ILE 30 1HG2 ILE 30 -11.967 31.716 -22.786 232 HG22 ILE 30 2HG2 ILE 30 -10.231 32.020 -23.018 233 HG23 ILE 30 3HG2 ILE 30 -11.356 33.371 -23.003 234 HD11 ILE 30 3HD1 ILE 30 -10.705 30.954 -27.315 235 HD12 ILE 30 1HD1 ILE 30 -10.597 29.284 -26.726 236 HD13 ILE 30 2HD1 ILE 30 -12.181 30.049 -26.855 237 H ALA 31 H ALA 31 -14.979 32.996 -23.938 238 HA ALA 31 HA ALA 31 -14.379 35.876 -23.403 239 HB1 ALA 31 3HB ALA 31 -16.587 35.595 -24.259 240 HB2 ALA 31 1HB ALA 31 -16.918 34.218 -23.176 241 HB3 ALA 31 2HB ALA 31 -16.738 35.857 -22.516 242 H ARG 32 H ARG 32 -14.651 36.614 -21.226 243 HA ARG 32 HA ARG 32 -14.162 34.578 -19.082 244 HB2 ARG 32 2HB ARG 32 -12.755 37.149 -19.618 245 HB3 ARG 32 3HB ARG 32 -13.336 36.968 -17.957 246 HG2 ARG 32 2HG ARG 32 -12.255 34.821 -17.720 247 HG3 ARG 32 3HG ARG 32 -11.649 34.900 -19.391 248 HD2 ARG 32 2HD ARG 32 -10.188 36.706 -18.863 249 HD3 ARG 32 3HD ARG 32 -10.993 37.013 -17.313 250 HE ARG 32 HE ARG 32 -9.458 34.495 -17.889 251 HH11 ARG 32 1HH2 ARG 32 -10.133 37.074 -15.515 252 HH12 ARG 32 2HH2 ARG 32 -9.009 36.347 -14.405 253 HH21 ARG 32 1HH1 ARG 32 -8.417 33.537 -16.260 254 HH22 ARG 32 2HH1 ARG 32 -8.071 34.423 -14.794 255 H TYR 33 H TYR 33 -15.242 34.850 -17.135 256 HA TYR 33 HA TYR 33 -17.316 36.948 -16.983 257 HB2 TYR 33 2HB TYR 33 -17.917 34.008 -16.558 258 HB3 TYR 33 3HB TYR 33 -18.984 35.334 -16.188 259 HD1 TYR 33 HD1 TYR 33 -17.225 33.627 -19.013 260 HD2 TYR 33 HD2 TYR 33 -20.440 36.209 -17.793 261 HE1 TYR 33 HE1 TYR 33 -18.235 33.447 -21.273 262 HE2 TYR 33 HE2 TYR 33 -21.438 36.053 -20.080 263 HH TYR 33 HH TYR 33 -20.088 33.879 -22.559 264 H ARG 34 H ARG 34 -17.647 37.709 -14.991 265 HA ARG 34 HA ARG 34 -15.985 36.657 -12.748 266 HB2 ARG 34 2HB ARG 34 -15.519 38.946 -13.599 267 HB3 ARG 34 3HB ARG 34 -17.158 39.442 -13.195 268 HG2 ARG 34 2HG ARG 34 -16.765 39.330 -10.871 269 HG3 ARG 34 3HG ARG 34 -15.436 38.179 -11.054 270 HD2 ARG 34 2HD ARG 34 -14.547 40.325 -10.378 271 HD3 ARG 34 3HD ARG 34 -13.992 39.880 -11.982 272 HE ARG 34 HE ARG 34 -16.264 41.789 -11.567 273 HH11 ARG 34 2HH2 ARG 34 -13.134 41.180 -13.160 274 HH12 ARG 34 1HH2 ARG 34 -13.130 42.785 -13.831 275 HH21 ARG 34 1HH1 ARG 34 -16.148 43.760 -12.541 276 HH22 ARG 34 2HH1 ARG 34 -14.783 44.170 -13.536 277 H THR 35 H THR 35 -16.868 35.783 -11.070 278 HA THR 35 HA THR 35 -19.762 35.495 -10.786 279 HB THR 35 HB THR 35 -19.283 34.102 -8.845 280 HG1 THR 35 HG1 THR 35 -16.580 34.576 -9.386 281 HG21 THR 35 1HG2 THR 35 -19.188 33.024 -11.001 282 HG22 THR 35 2HG2 THR 35 -17.473 33.447 -11.191 283 HG23 THR 35 3HG2 THR 35 -17.975 32.352 -9.887 284 H ASP 36 H ASP 36 -20.528 35.636 -8.316 285 HA ASP 36 HA ASP 36 -20.440 38.448 -7.730 286 HB2 ASP 36 2HB ASP 36 -22.474 36.997 -7.551 287 HB3 ASP 36 3HB ASP 36 -21.737 36.173 -6.173 288 H ASN 37 H ASN 37 -18.436 35.833 -6.598 289 HA ASN 37 HA ASN 37 -17.594 37.434 -4.234 290 HB2 ASN 37 2HB ASN 37 -16.176 34.977 -5.089 291 HB3 ASN 37 3HB ASN 37 -16.300 35.698 -3.523 292 HD21 ASN 37 1HD2 ASN 37 -16.800 32.983 -4.568 293 HD22 ASN 37 2HD2 ASN 37 -18.400 32.576 -3.901 294 H GLY 38 H GLY 38 -17.081 37.824 -7.444 295 HA2 GLY 38 HA2 GLY 38 -15.476 39.056 -8.605 296 HA3 GLY 38 HA3 GLY 38 -14.356 38.960 -7.244 297 H GLU 39 H GLU 39 -15.543 35.849 -7.882 298 HA GLU 39 HA GLU 39 -12.891 35.013 -8.762 299 HB2 GLU 39 2HB GLU 39 -15.278 33.170 -8.859 300 HB3 GLU 39 3HB GLU 39 -13.605 32.816 -8.536 301 HG2 GLU 39 2HG GLU 39 -14.139 34.420 -6.395 302 HG3 GLU 39 3HG GLU 39 -15.784 33.885 -6.801 303 H GLU 40 H GLU 40 -12.224 35.202 -10.830 304 HA GLU 40 HA GLU 40 -14.221 35.255 -13.033 305 HB2 GLU 40 2HB GLU 40 -11.334 36.129 -12.825 306 HB3 GLU 40 3HB GLU 40 -12.124 35.858 -14.388 307 HG2 GLU 40 2HG GLU 40 -13.908 37.424 -13.798 308 HG3 GLU 40 3HG GLU 40 -13.135 37.750 -12.247 309 H PHE 41 H PHE 41 -14.498 33.784 -14.481 310 HA PHE 41 HA PHE 41 -12.515 31.573 -14.880 311 HB2 PHE 41 2HB PHE 41 -15.536 31.396 -14.784 312 HB3 PHE 41 3HB PHE 41 -14.484 30.106 -15.282 313 HD1 PHE 41 HD2 PHE 41 -15.521 32.152 -12.277 314 HD2 PHE 41 HD1 PHE 41 -13.270 28.746 -13.732 315 HE1 PHE 41 HE2 PHE 41 -15.153 31.389 -9.993 316 HE2 PHE 41 HE1 PHE 41 -12.880 28.019 -11.398 317 HZ PHE 41 HZ PHE 41 -13.798 29.353 -9.512 318 H GLU 42 H GLU 42 -12.706 30.498 -16.948 319 HA GLU 42 HA GLU 42 -13.379 32.401 -19.130 320 HB2 GLU 42 2HB GLU 42 -11.368 30.134 -19.328 321 HB3 GLU 42 3HB GLU 42 -11.674 31.475 -20.421 322 HG2 GLU 42 2HG GLU 42 -9.853 32.361 -19.450 323 HG3 GLU 42 3HG GLU 42 -11.056 32.940 -18.301 324 H VAL 43 H VAL 43 -14.772 31.845 -20.631 325 HA VAL 43 HA VAL 43 -15.715 29.001 -20.814 326 HB VAL 43 HB VAL 43 -17.392 31.440 -21.335 327 HG11 VAL 43 1HG1 VAL 43 -19.229 29.862 -21.413 328 HG12 VAL 43 2HG1 VAL 43 -18.028 29.386 -22.603 329 HG13 VAL 43 3HG1 VAL 43 -18.135 28.500 -21.066 330 HG21 VAL 43 3HG2 VAL 43 -16.846 31.229 -18.889 331 HG22 VAL 43 1HG2 VAL 43 -18.536 31.025 -19.286 332 HG23 VAL 43 2HG2 VAL 43 -17.540 29.591 -18.930 333 HA PRO 44 HA PRO 44 -14.377 29.793 -25.111 334 HB2 PRO 44 2HB PRO 44 -13.907 27.189 -25.819 335 HB3 PRO 44 3HB PRO 44 -12.745 28.188 -24.908 336 HG2 PRO 44 2HG PRO 44 -14.630 26.094 -23.855 337 HG3 PRO 44 3HG PRO 44 -12.943 26.426 -23.372 338 HD2 PRO 44 2HD PRO 44 -15.193 27.305 -22.001 339 HD3 PRO 44 3HD PRO 44 -13.615 28.141 -21.915 340 H PHE 45 H PHE 45 -16.044 30.306 -26.382 341 HA PHE 45 HA PHE 45 -18.426 28.554 -26.754 342 HB2 PHE 45 2HB PHE 45 -17.770 31.438 -27.399 343 HB3 PHE 45 3HB PHE 45 -19.140 30.648 -28.119 344 HD1 PHE 45 HD2 PHE 45 -17.620 31.744 -24.898 345 HD2 PHE 45 HD1 PHE 45 -21.172 30.242 -26.841 346 HE1 PHE 45 HE2 PHE 45 -18.937 32.183 -22.857 347 HE2 PHE 45 HE1 PHE 45 -22.494 30.731 -24.792 348 HZ PHE 45 HZ PHE 45 -21.369 31.704 -22.793 349 H ALA 46 H ALA 46 -19.019 27.788 -28.798 350 HA ALA 46 HA ALA 46 -16.855 27.507 -30.792 351 HB1 ALA 46 3HB ALA 46 -18.195 25.539 -30.179 352 HB2 ALA 46 1HB ALA 46 -19.693 26.377 -30.643 353 HB3 ALA 46 2HB ALA 46 -18.488 25.965 -31.880 354 H ASP 47 H ASP 47 -17.165 28.127 -33.030 355 HA ASP 47 HA ASP 47 -18.143 30.728 -33.482 356 HB2 ASP 47 2HB ASP 47 -16.396 29.590 -34.786 357 HB3 ASP 47 3HB ASP 47 -17.595 28.484 -35.462 358 H ASP 48 H ASP 48 -19.974 27.784 -33.478 359 HA ASP 48 HA ASP 48 -22.240 28.754 -35.054 360 HB2 ASP 48 2HB ASP 48 -21.539 26.346 -34.768 361 HB3 ASP 48 3HB ASP 48 -22.089 26.442 -33.096 362 H ALA 49 H ALA 49 -21.108 29.461 -31.944 363 HA ALA 49 HA ALA 49 -23.778 30.365 -30.937 364 HB1 ALA 49 3HB ALA 49 -21.339 29.479 -29.344 365 HB2 ALA 49 1HB ALA 49 -22.917 29.970 -28.691 366 HB3 ALA 49 2HB ALA 49 -22.780 28.484 -29.651 367 H GLU 50 H GLU 50 -23.708 32.270 -29.526 368 HA GLU 50 HA GLU 50 -21.406 34.121 -29.921 369 HB2 GLU 50 2HB GLU 50 -24.330 34.745 -30.450 370 HB3 GLU 50 3HB GLU 50 -23.139 35.996 -30.066 371 HG2 GLU 50 2HG GLU 50 -21.762 35.367 -31.985 372 HG3 GLU 50 3HG GLU 50 -22.859 34.048 -32.377 373 H ILE 51 H ILE 51 -20.869 35.273 -28.242 374 HA ILE 51 HA ILE 51 -21.293 34.404 -25.679 375 HB ILE 51 HB ILE 51 -20.374 37.217 -26.242 376 HG12 ILE 51 2HG1 ILE 51 -19.189 35.801 -27.879 377 HG13 ILE 51 3HG1 ILE 51 -18.112 36.452 -26.649 378 HG21 ILE 51 1HG2 ILE 51 -18.916 36.812 -24.335 379 HG22 ILE 51 2HG2 ILE 51 -20.593 36.523 -23.846 380 HG23 ILE 51 3HG2 ILE 51 -19.507 35.164 -24.166 381 HD11 ILE 51 3HD1 ILE 51 -19.181 33.609 -26.729 382 HD12 ILE 51 1HD1 ILE 51 -17.568 34.136 -27.244 383 HD13 ILE 51 2HD1 ILE 51 -18.011 34.252 -25.543 384 HA PRO 52 HA PRO 52 -25.085 36.730 -24.601 385 HB2 PRO 52 2HB PRO 52 -25.663 35.267 -22.367 386 HB3 PRO 52 3HB PRO 52 -26.057 34.713 -24.024 387 HG2 PRO 52 2HG PRO 52 -23.739 33.919 -22.259 388 HG3 PRO 52 3HG PRO 52 -24.758 32.885 -23.320 389 HD2 PRO 52 2HD PRO 52 -22.244 33.915 -23.979 390 HD3 PRO 52 3HD PRO 52 -23.443 33.431 -25.183 391 H GLY 53 H GLY 53 -25.388 38.285 -22.991 392 HA2 GLY 53 HA2 GLY 53 -23.323 39.670 -21.803 393 HA3 GLY 53 HA3 GLY 53 -24.983 39.692 -21.203 394 H THR 54 H THR 54 -24.931 36.828 -20.335 395 HA THR 54 HA THR 54 -22.731 36.713 -18.405 396 HB THR 54 HB THR 54 -24.327 36.104 -16.543 397 HG1 THR 54 HG1 THR 54 -26.557 36.438 -16.886 398 HG21 THR 54 1HG2 THR 54 -23.785 38.542 -16.860 399 HG22 THR 54 2HG2 THR 54 -25.314 38.730 -17.719 400 HG23 THR 54 3HG2 THR 54 -25.298 38.224 -16.011 401 H TRP 55 H TRP 55 -22.526 34.609 -17.287 402 HA TRP 55 HA TRP 55 -23.820 32.260 -18.451 403 HB2 TRP 55 2HB TRP 55 -22.037 32.994 -20.114 404 HB3 TRP 55 3HB TRP 55 -20.842 32.642 -18.874 405 HD1 TRP 55 HD1 TRP 55 -20.291 30.124 -18.388 406 HE1 TRP 55 HE1 TRP 55 -20.600 27.990 -19.745 407 HE3 TRP 55 HE3 TRP 55 -23.935 31.747 -21.551 408 HZ2 TRP 55 HZ2 TRP 55 -22.355 27.033 -21.860 409 HZ3 TRP 55 HZ3 TRP 55 -24.951 30.197 -23.225 410 HH2 TRP 55 HH2 TRP 55 -24.155 27.848 -23.393 411 H LEU 56 H LEU 56 -23.386 30.319 -17.246 412 HA LEU 56 HA LEU 56 -22.733 30.776 -14.471 413 HB2 LEU 56 2HB LEU 56 -24.259 28.939 -15.904 414 HB3 LEU 56 3HB LEU 56 -22.882 27.975 -15.372 415 HG LEU 56 HG LEU 56 -24.594 29.677 -13.516 416 HD11 LEU 56 1HD1 LEU 56 -25.656 27.555 -12.836 417 HD12 LEU 56 2HD1 LEU 56 -25.945 27.890 -14.549 418 HD13 LEU 56 3HD1 LEU 56 -24.728 26.683 -14.077 419 HD21 LEU 56 3HD2 LEU 56 -22.364 29.151 -12.598 420 HD22 LEU 56 1HD2 LEU 56 -23.613 28.240 -11.746 421 HD23 LEU 56 2HD2 LEU 56 -22.596 27.434 -12.965 422 H CYS 57 H CYS 57 -20.860 30.561 -13.422 423 HA CYS 57 HA CYS 57 -18.437 29.702 -14.899 424 HB2 CYS 57 2HB CYS 57 -18.902 31.233 -12.309 425 HB3 CYS 57 3HB CYS 57 -17.308 30.729 -12.872 426 HG CYS 57 HG CYS 57 -17.482 31.881 -15.247 427 H ARG 58 H ARG 58 -16.769 28.451 -13.767 428 HA ARG 58 HA ARG 58 -17.835 25.957 -12.858 429 HB2 ARG 58 2HB ARG 58 -14.940 26.889 -12.712 430 HB3 ARG 58 3HB ARG 58 -15.521 25.230 -12.631 431 HG2 ARG 58 2HG ARG 58 -16.413 25.455 -14.969 432 HG3 ARG 58 3HG ARG 58 -15.723 27.085 -15.042 433 HD2 ARG 58 2HD ARG 58 -14.190 25.596 -16.143 434 HD3 ARG 58 3HD ARG 58 -13.460 26.167 -14.649 435 HE ARG 58 HE ARG 58 -13.480 24.015 -13.780 436 HH11 ARG 58 1HH2 ARG 58 -15.402 23.931 -16.714 437 HH12 ARG 58 2HH2 ARG 58 -15.478 22.190 -16.715 438 HH21 ARG 58 1HH1 ARG 58 -13.629 21.807 -13.844 439 HH22 ARG 58 2HH1 ARG 58 -14.499 21.027 -15.130 440 H ASN 59 H ASN 59 -17.039 28.734 -10.992 441 HA ASN 59 HA ASN 59 -16.702 27.482 -8.440 442 HB2 ASN 59 2HB ASN 59 -16.090 29.766 -8.872 443 HB3 ASN 59 3HB ASN 59 -17.754 30.197 -9.292 444 HD21 ASN 59 1HD2 ASN 59 -17.729 31.908 -7.753 445 HD22 ASN 59 2HD2 ASN 59 -17.682 31.570 -6.034 446 H GLY 60 H GLY 60 -19.473 27.803 -10.480 447 HA2 GLY 60 HA2 GLY 60 -21.559 26.748 -10.205 448 HA3 GLY 60 HA3 GLY 60 -21.337 26.686 -8.454 449 H MET 61 H MET 61 -20.541 29.755 -9.830 450 HA MET 61 HA MET 61 -23.195 30.878 -9.087 451 HB2 MET 61 2HB MET 61 -21.214 31.470 -7.614 452 HB3 MET 61 3HB MET 61 -20.501 32.295 -8.978 453 HG2 MET 61 2HG MET 61 -21.691 33.839 -7.464 454 HG3 MET 61 3HG MET 61 -22.336 33.874 -9.103 455 HE1 MET 61 3HE MET 61 -24.425 35.185 -8.380 456 HE2 MET 61 1HE MET 61 -25.567 34.680 -7.114 457 HE3 MET 61 2HE MET 61 -23.937 35.218 -6.666 458 H GLU 62 H GLU 62 -24.100 32.464 -10.386 459 HA GLU 62 HA GLU 62 -23.514 32.395 -13.212 460 HB2 GLU 62 2HB GLU 62 -25.244 34.134 -13.400 461 HB3 GLU 62 3HB GLU 62 -25.756 32.653 -12.603 462 HG2 GLU 62 2HG GLU 62 -25.563 33.781 -10.382 463 HG3 GLU 62 3HG GLU 62 -25.125 35.283 -11.196 464 H GLY 63 H GLY 63 -21.799 33.244 -14.104 465 HA2 GLY 63 HA2 GLY 63 -20.415 35.560 -12.958 466 HA3 GLY 63 HA3 GLY 63 -19.846 34.557 -14.274 467 H THR 64 H THR 64 -20.123 37.529 -14.051 468 HA THR 64 HA THR 64 -21.823 37.975 -16.472 469 HB THR 64 HB THR 64 -20.713 40.021 -14.518 470 HG1 THR 64 HG1 THR 64 -22.396 38.802 -13.642 471 HG21 THR 64 1HG2 THR 64 -22.547 40.333 -16.940 472 HG22 THR 64 2HG2 THR 64 -22.411 41.548 -15.649 473 HG23 THR 64 3HG2 THR 64 -20.999 41.141 -16.629 474 H LEU 65 H LEU 65 -21.026 38.825 -18.313 475 HA LEU 65 HA LEU 65 -18.417 38.158 -19.059 476 HB2 LEU 65 2HB LEU 65 -20.488 38.313 -20.456 477 HB3 LEU 65 3HB LEU 65 -20.425 40.063 -20.342 478 HG LEU 65 HG LEU 65 -18.126 39.891 -21.532 479 HD11 LEU 65 1HD1 LEU 65 -17.638 37.567 -21.069 480 HD12 LEU 65 2HD1 LEU 65 -19.055 37.059 -21.989 481 HD13 LEU 65 3HD1 LEU 65 -17.690 37.892 -22.796 482 HD21 LEU 65 3HD2 LEU 65 -20.597 38.830 -22.966 483 HD22 LEU 65 1HD2 LEU 65 -20.200 40.543 -22.709 484 HD23 LEU 65 2HD2 LEU 65 -19.166 39.545 -23.746 485 H ILE 66 H ILE 66 -16.512 39.086 -18.747 486 HA ILE 66 HA ILE 66 -16.199 42.035 -18.786 487 HB ILE 66 HB ILE 66 -14.670 42.076 -16.973 488 HG12 ILE 66 2HG1 ILE 66 -13.505 40.005 -16.981 489 HG13 ILE 66 3HG1 ILE 66 -14.288 40.147 -15.415 490 HG21 ILE 66 1HG2 ILE 66 -17.185 40.670 -16.034 491 HG22 ILE 66 2HG2 ILE 66 -16.123 41.701 -15.074 492 HG23 ILE 66 3HG2 ILE 66 -17.028 42.390 -16.431 493 HD11 ILE 66 3HD1 ILE 66 -16.095 38.670 -16.229 494 HD12 ILE 66 1HD1 ILE 66 -15.071 38.381 -17.646 495 HD13 ILE 66 2HD1 ILE 66 -14.488 37.924 -16.043 496 H GLU 67 H GLU 67 -14.109 42.791 -19.353 497 HA GLU 67 HA GLU 67 -12.268 40.838 -20.671 498 HB2 GLU 67 2HB GLU 67 -12.263 43.878 -20.659 499 HB3 GLU 67 3HB GLU 67 -11.009 42.850 -21.373 500 HG2 GLU 67 2HG GLU 67 -12.708 41.827 -22.878 501 HG3 GLU 67 3HG GLU 67 -13.942 42.898 -22.213 502 H GLY 68 H GLY 68 -10.421 40.212 -19.646 503 HA2 GLY 68 HA2 GLY 68 -10.283 40.608 -16.800 504 HA3 GLY 68 HA3 GLY 68 -9.159 39.682 -17.793 505 H ASP 69 H ASP 69 -8.025 41.555 -19.419 506 HA ASP 69 HA ASP 69 -6.113 42.760 -19.475 507 HB2 ASP 69 2HB ASP 69 -7.950 44.597 -17.935 508 HB3 ASP 69 3HB ASP 69 -6.439 45.119 -18.689 509 H LEU 70 H LEU 70 -5.938 40.836 -17.379 510 HA LEU 70 HA LEU 70 -4.738 42.067 -15.049 511 HB2 LEU 70 2HB LEU 70 -4.850 39.177 -15.976 512 HB3 LEU 70 3HB LEU 70 -4.221 39.685 -14.415 513 HG LEU 70 HG LEU 70 -7.088 40.188 -15.304 514 HD11 LEU 70 1HD1 LEU 70 -6.646 37.787 -15.147 515 HD12 LEU 70 2HD1 LEU 70 -5.959 38.003 -13.520 516 HD13 LEU 70 3HD1 LEU 70 -7.681 38.335 -13.816 517 HD21 LEU 70 3HD2 LEU 70 -6.340 41.738 -13.537 518 HD22 LEU 70 1HD2 LEU 70 -7.475 40.557 -12.882 519 HD23 LEU 70 2HD2 LEU 70 -5.735 40.370 -12.572 520 HA PRO 71 HA PRO 71 -0.511 42.173 -16.477 521 HB2 PRO 71 2HB PRO 71 0.845 42.655 -14.188 522 HB3 PRO 71 3HB PRO 71 -0.399 43.785 -14.787 523 HG2 PRO 71 2HG PRO 71 -0.770 41.575 -12.725 524 HG3 PRO 71 3HG PRO 71 -1.181 43.315 -12.558 525 HD2 PRO 71 2HD PRO 71 -3.024 41.452 -13.338 526 HD3 PRO 71 3HD PRO 71 -3.029 43.118 -13.989 527 H GLU 72 H GLU 72 -1.363 39.642 -16.704 528 HA GLU 72 HA GLU 72 -1.145 37.377 -16.340 529 HB2 GLU 72 2HB GLU 72 1.578 38.444 -17.058 530 HB3 GLU 72 3HB GLU 72 1.171 36.711 -17.107 531 HG2 GLU 72 2HG GLU 72 -0.670 37.202 -18.698 532 HG3 GLU 72 3HG GLU 72 -0.216 38.907 -18.699 533 HA PRO 73 HA PRO 73 0.518 37.366 -11.961 534 HB2 PRO 73 2HB PRO 73 -1.776 36.883 -10.569 535 HB3 PRO 73 3HB PRO 73 -1.304 38.524 -11.110 536 HG2 PRO 73 2HG PRO 73 -3.192 36.586 -12.500 537 HG3 PRO 73 3HG PRO 73 -3.487 38.306 -12.086 538 HD2 PRO 73 2HD PRO 73 -2.632 37.569 -14.558 539 HD3 PRO 73 3HD PRO 73 -2.030 39.063 -13.774 540 H LYS 74 H LYS 74 0.613 35.576 -10.470 541 HA LYS 74 HA LYS 74 -0.414 32.930 -11.315 542 HB2 LYS 74 2HB LYS 74 1.705 31.856 -11.323 543 HB3 LYS 74 3HB LYS 74 1.850 33.241 -12.396 544 HG2 LYS 74 2HG LYS 74 3.060 34.509 -10.644 545 HG3 LYS 74 3HG LYS 74 2.810 33.193 -9.499 546 HD2 LYS 74 2HD LYS 74 4.079 31.689 -11.215 547 HD3 LYS 74 3HD LYS 74 4.565 33.218 -11.959 548 HE2 LYS 74 2HE LYS 74 6.328 32.695 -10.477 549 HE3 LYS 74 3HE LYS 74 5.396 33.937 -9.636 550 HZ1 LYS 74 HZ1 LYS 74 5.928 32.101 -8.147 551 HZ2 LYS 74 HZ2 LYS 74 4.305 32.088 -8.367 552 HZ3 LYS 74 HZ3 LYS 74 5.250 31.004 -9.140 553 H LYS 75 H LYS 75 0.366 31.238 -9.608 554 HA LYS 75 HA LYS 75 -0.508 31.947 -6.948 555 HB2 LYS 75 2HB LYS 75 -0.648 29.673 -7.973 556 HB3 LYS 75 3HB LYS 75 1.116 29.550 -7.909 557 HG2 LYS 75 2HG LYS 75 1.012 29.758 -5.413 558 HG3 LYS 75 3HG LYS 75 -0.760 29.855 -5.520 559 HD2 LYS 75 2HD LYS 75 -0.827 27.600 -6.542 560 HD3 LYS 75 3HD LYS 75 0.947 27.511 -6.480 561 HE2 LYS 75 2HE LYS 75 0.865 27.726 -4.002 562 HE3 LYS 75 3HE LYS 75 -0.903 27.792 -4.068 563 HZ1 LYS 75 HZ1 LYS 75 -0.116 25.542 -3.583 564 HZ2 LYS 75 HZ2 LYS 75 -0.881 25.545 -5.023 565 HZ3 LYS 75 HZ3 LYS 75 0.750 25.487 -4.963 566 H VAL 76 H VAL 76 0.525 32.905 -5.374 567 HA VAL 76 HA VAL 76 3.480 32.805 -5.059 568 HB VAL 76 HB VAL 76 3.551 35.251 -4.628 569 HG11 VAL 76 1HG1 VAL 76 4.274 34.316 -6.800 570 HG12 VAL 76 2HG1 VAL 76 2.647 34.630 -7.456 571 HG13 VAL 76 3HG1 VAL 76 3.666 35.975 -6.915 572 HG21 VAL 76 3HG2 VAL 76 1.144 35.689 -4.214 573 HG22 VAL 76 1HG2 VAL 76 1.806 36.738 -5.475 574 HG23 VAL 76 2HG2 VAL 76 0.791 35.352 -5.923 575 H LYS 77 H LYS 77 1.296 31.497 -3.653 576 HA LYS 77 HA LYS 77 0.370 32.861 -1.448 577 HB2 LYS 77 2HB LYS 77 0.825 29.862 -1.787 578 HB3 LYS 77 3HB LYS 77 -0.005 30.557 -0.399 579 HG2 LYS 77 2HG LYS 77 -1.568 31.710 -2.079 580 HG3 LYS 77 3HG LYS 77 -0.901 30.600 -3.292 581 HD2 LYS 77 2HD LYS 77 -1.554 28.684 -1.770 582 HD3 LYS 77 3HD LYS 77 -2.309 29.852 -0.684 583 HE2 LYS 77 2HE LYS 77 -3.135 29.201 -3.546 584 HE3 LYS 77 3HE LYS 77 -3.989 28.776 -2.060 585 HZ1 LYS 77 HZ1 LYS 77 -3.678 31.461 -3.263 586 HZ2 LYS 77 HZ2 LYS 77 -5.064 30.678 -2.920 587 HZ3 LYS 77 HZ3 LYS 77 -4.148 31.301 -1.708 588 HA PRO 78 HA PRO 78 -0.343 32.601 0.638 589 HB2 PRO 78 2HB PRO 78 -0.256 33.792 3.062 590 HB3 PRO 78 3HB PRO 78 0.019 32.035 2.853 591 HG2 PRO 78 2HG PRO 78 2.109 34.227 3.103 592 HG3 PRO 78 3HG PRO 78 2.021 32.676 3.997 593 HD2 PRO 78 2HD PRO 78 3.561 33.019 1.739 594 HD3 PRO 78 3HD PRO 78 2.792 31.457 2.149 595 HA PRO 79 HA PRO 79 -2.149 33.589 1.037 596 HB2 PRO 79 2HB PRO 79 -4.167 35.315 0.841 597 HB3 PRO 79 3HB PRO 79 -2.992 35.434 2.184 598 HG2 PRO 79 2HG PRO 79 -3.075 37.058 -0.372 599 HG3 PRO 79 3HG PRO 79 -2.847 37.639 1.305 600 HD2 PRO 79 2HD PRO 79 -0.764 37.094 -0.490 601 HD3 PRO 79 3HD PRO 79 -0.601 37.081 1.287 602 H ARG 80 H ARG 80 -1.379 35.351 -1.877 603 HA ARG 80 HA ARG 80 -3.750 34.593 -3.403 604 HB2 ARG 80 2HB ARG 80 -1.212 36.061 -4.204 605 HB3 ARG 80 3HB ARG 80 -2.601 35.789 -5.257 606 HG2 ARG 80 2HG ARG 80 -4.048 37.062 -3.650 607 HG3 ARG 80 3HG ARG 80 -2.623 37.364 -2.648 608 HD2 ARG 80 2HD ARG 80 -3.000 39.318 -3.968 609 HD3 ARG 80 3HD ARG 80 -1.533 38.524 -4.562 610 HE ARG 80 HE ARG 80 -3.842 37.649 -6.050 611 HH11 ARG 80 1HH2 ARG 80 -1.754 40.447 -5.795 612 HH12 ARG 80 2HH2 ARG 80 -2.085 40.955 -7.429 613 HH21 ARG 80 1HH1 ARG 80 -4.223 38.354 -8.116 614 HH22 ARG 80 2HH1 ARG 80 -3.455 39.803 -8.697 Start of MODEL 22 1 H1 SER 1 1H SER 1 -12.284 33.432 2.793 2 H2 SER 1 2H SER 1 -11.816 34.546 3.906 3 H3 SER 1 3H SER 1 -11.507 32.956 4.156 4 HA SER 1 HA SER 1 -10.370 34.588 1.991 5 HB2 SER 1 2HB SER 1 -9.000 33.584 4.516 6 HB3 SER 1 3HB SER 1 -8.255 34.519 3.204 7 HG SER 1 HG SER 1 -8.912 35.861 4.943 8 H MET 2 H MET 2 -8.706 33.542 0.743 9 HA MET 2 HA MET 2 -9.198 30.733 0.210 10 HB2 MET 2 2HB MET 2 -7.588 30.967 -1.561 11 HB3 MET 2 3HB MET 2 -8.691 32.340 -1.567 12 HG2 MET 2 2HG MET 2 -6.943 33.729 -0.444 13 HG3 MET 2 3HG MET 2 -5.865 32.333 -0.423 14 HE1 MET 2 3HE MET 2 -7.522 35.160 -2.532 15 HE2 MET 2 1HE MET 2 -7.052 34.757 -4.196 16 HE3 MET 2 2HE MET 2 -8.254 33.761 -3.354 17 H ALA 3 H ALA 3 -7.530 29.062 0.112 18 HA ALA 3 HA ALA 3 -6.081 28.771 2.593 19 HB1 ALA 3 3HB ALA 3 -6.076 27.105 0.043 20 HB2 ALA 3 1HB ALA 3 -5.388 26.611 1.605 21 HB3 ALA 3 2HB ALA 3 -7.135 26.874 1.452 22 H ASP 4 H ASP 4 -3.837 28.532 2.915 23 HA ASP 4 HA ASP 4 -2.190 30.397 1.382 24 HB2 ASP 4 2HB ASP 4 -2.247 30.407 3.837 25 HB3 ASP 4 3HB ASP 4 -1.597 28.768 3.875 26 H ARG 5 H ARG 5 -2.493 28.933 -0.537 27 HA ARG 5 HA ARG 5 -0.127 27.165 -0.897 28 HB2 ARG 5 2HB ARG 5 -1.446 25.392 -1.896 29 HB3 ARG 5 3HB ARG 5 -1.992 25.699 -0.250 30 HG2 ARG 5 2HG ARG 5 -3.905 27.060 -1.188 31 HG3 ARG 5 3HG ARG 5 -3.376 26.606 -2.819 32 HD2 ARG 5 2HD ARG 5 -3.670 24.210 -2.232 33 HD3 ARG 5 3HD ARG 5 -4.211 24.687 -0.609 34 HE ARG 5 HE ARG 5 -5.778 25.992 -2.656 35 HH11 ARG 5 1HH1 ARG 5 -5.486 22.869 -1.093 36 HH12 ARG 5 2HH1 ARG 5 -7.149 22.454 -1.409 37 HH21 ARG 5 2HH2 ARG 5 -7.889 25.399 -3.025 38 HH22 ARG 5 1HH2 ARG 5 -8.465 23.852 -2.478 39 H VAL 6 H VAL 6 0.405 26.689 -3.089 40 HA VAL 6 HA VAL 6 -0.737 28.331 -5.242 41 HB VAL 6 HB VAL 6 0.959 29.761 -4.040 42 HG11 VAL 6 1HG1 VAL 6 3.040 27.904 -5.254 43 HG12 VAL 6 2HG1 VAL 6 3.326 29.419 -4.383 44 HG13 VAL 6 3HG1 VAL 6 2.655 28.026 -3.521 45 HG21 VAL 6 3HG2 VAL 6 1.981 30.638 -6.059 46 HG22 VAL 6 1HG2 VAL 6 1.558 29.172 -6.954 47 HG23 VAL 6 2HG2 VAL 6 0.280 30.235 -6.314 48 H LEU 7 H LEU 7 -0.258 27.519 -7.349 49 HA LEU 7 HA LEU 7 0.509 24.670 -7.344 50 HB2 LEU 7 2HB LEU 7 -0.463 26.476 -9.590 51 HB3 LEU 7 3HB LEU 7 -0.274 24.734 -9.684 52 HG LEU 7 HG LEU 7 -2.246 26.171 -7.849 53 HD11 LEU 7 1HD1 LEU 7 -3.949 25.316 -9.400 54 HD12 LEU 7 2HD1 LEU 7 -2.813 26.388 -10.234 55 HD13 LEU 7 3HD1 LEU 7 -2.679 24.625 -10.435 56 HD21 LEU 7 3HD2 LEU 7 -1.887 23.207 -8.470 57 HD22 LEU 7 1HD2 LEU 7 -1.597 23.998 -6.903 58 HD23 LEU 7 2HD2 LEU 7 -3.236 23.915 -7.555 59 H ARG 8 H ARG 8 1.884 27.697 -8.491 60 HA ARG 8 HA ARG 8 4.258 26.298 -9.695 61 HB2 ARG 8 2HB ARG 8 2.915 28.819 -10.738 62 HB3 ARG 8 3HB ARG 8 4.260 27.981 -11.481 63 HG2 ARG 8 2HG ARG 8 1.446 26.821 -11.256 64 HG3 ARG 8 3HG ARG 8 2.050 27.754 -12.605 65 HD2 ARG 8 2HD ARG 8 2.168 25.516 -13.260 66 HD3 ARG 8 3HD ARG 8 3.837 26.030 -12.982 67 HE ARG 8 HE ARG 8 2.981 24.913 -10.565 68 HH11 ARG 8 1HH2 ARG 8 2.971 23.515 -13.778 69 HH12 ARG 8 2HH2 ARG 8 3.469 21.959 -13.171 70 HH21 ARG 8 1HH1 ARG 8 3.380 22.958 -9.870 71 HH22 ARG 8 2HH1 ARG 8 3.632 21.624 -10.975 72 H GLY 9 H GLY 9 6.090 27.869 -10.059 73 HA2 GLY 9 HA2 GLY 9 7.602 29.446 -9.350 74 HA3 GLY 9 HA3 GLY 9 6.255 30.315 -8.609 75 H SER 10 H SER 10 6.935 27.047 -7.482 76 HA SER 10 HA SER 10 7.061 27.766 -4.796 77 HB2 SER 10 2HB SER 10 8.314 25.291 -6.042 78 HB3 SER 10 3HB SER 10 7.746 25.479 -4.371 79 HG SER 10 HG SER 10 6.196 24.414 -5.686 80 H ARG 11 H ARG 11 9.769 27.583 -7.047 81 HA ARG 11 HA ARG 11 11.806 27.952 -4.936 82 HB2 ARG 11 2HB ARG 11 12.073 26.423 -6.948 83 HB3 ARG 11 3HB ARG 11 12.223 27.874 -7.944 84 HG2 ARG 11 2HG ARG 11 14.213 28.560 -6.539 85 HG3 ARG 11 3HG ARG 11 13.996 27.100 -5.572 86 HD2 ARG 11 2HD ARG 11 15.767 26.703 -7.169 87 HD3 ARG 11 3HD ARG 11 14.382 25.702 -7.586 88 HE ARG 11 HE ARG 11 14.110 26.865 -9.579 89 HH11 ARG 11 1HH2 ARG 11 16.417 28.685 -7.664 90 HH12 ARG 11 2HH2 ARG 11 16.828 29.730 -8.997 91 HH21 ARG 11 1HH1 ARG 11 14.677 28.237 -11.222 92 HH22 ARG 11 2HH1 ARG 11 15.866 29.477 -10.952 93 H LEU 12 H LEU 12 10.296 29.910 -4.496 94 HA LEU 12 HA LEU 12 9.929 32.130 -4.349 95 HB2 LEU 12 2HB LEU 12 12.933 32.165 -4.796 96 HB3 LEU 12 3HB LEU 12 11.976 33.553 -4.307 97 HG LEU 12 HG LEU 12 11.245 32.353 -2.250 98 HD11 LEU 12 1HD1 LEU 12 12.753 30.498 -1.439 99 HD12 LEU 12 2HD1 LEU 12 11.653 30.003 -2.713 100 HD13 LEU 12 3HD1 LEU 12 13.363 30.327 -3.099 101 HD21 LEU 12 3HD2 LEU 12 13.081 34.004 -2.282 102 HD22 LEU 12 1HD2 LEU 12 13.380 32.736 -1.087 103 HD23 LEU 12 2HD2 LEU 12 14.247 32.709 -2.641 104 H GLY 13 H GLY 13 9.173 31.174 -6.803 105 HA2 GLY 13 HA2 GLY 13 9.789 33.215 -8.879 106 HA3 GLY 13 HA3 GLY 13 8.858 31.737 -9.072 107 H ALA 14 H ALA 14 7.115 32.762 -10.037 108 HA ALA 14 HA ALA 14 5.272 34.274 -8.271 109 HB1 ALA 14 3HB ALA 14 6.628 35.942 -9.521 110 HB2 ALA 14 1HB ALA 14 6.141 35.184 -11.054 111 HB3 ALA 14 2HB ALA 14 4.931 35.977 -10.022 112 H VAL 15 H VAL 15 3.162 34.627 -9.402 113 HA VAL 15 HA VAL 15 1.198 33.836 -9.966 114 HB VAL 15 HB VAL 15 0.807 33.469 -12.209 115 HG11 VAL 15 1HG1 VAL 15 1.883 35.350 -13.246 116 HG12 VAL 15 2HG1 VAL 15 1.532 35.725 -11.551 117 HG13 VAL 15 3HG1 VAL 15 3.193 35.328 -12.052 118 HG21 VAL 15 3HG2 VAL 15 3.751 33.024 -12.800 119 HG22 VAL 15 1HG2 VAL 15 2.551 31.718 -12.705 120 HG23 VAL 15 2HG2 VAL 15 2.394 32.983 -13.936 121 H SER 16 H SER 16 -0.143 32.016 -11.170 122 HA SER 16 HA SER 16 0.598 29.312 -10.230 123 HB2 SER 16 2HB SER 16 -0.496 30.665 -8.329 124 HB3 SER 16 3HB SER 16 -1.976 30.620 -9.292 125 HG SER 16 HG SER 16 -2.082 28.850 -8.027 126 H TYR 17 H TYR 17 -0.218 27.793 -11.610 127 HA TYR 17 HA TYR 17 -2.731 28.075 -13.006 128 HB2 TYR 17 2HB TYR 17 -1.746 27.850 -15.303 129 HB3 TYR 17 3HB TYR 17 -1.581 29.418 -14.562 130 HD1 TYR 17 HD2 TYR 17 0.300 26.323 -15.472 131 HD2 TYR 17 HD1 TYR 17 0.560 30.440 -14.213 132 HE1 TYR 17 HE2 TYR 17 2.730 26.319 -15.977 133 HE2 TYR 17 HE1 TYR 17 2.998 30.436 -14.731 134 HH TYR 17 HH TYR 17 4.786 29.216 -15.482 135 H GLU 18 H GLU 18 -3.428 26.189 -14.028 136 HA GLU 18 HA GLU 18 -2.573 23.800 -12.701 137 HB2 GLU 18 2HB GLU 18 -4.588 24.037 -14.971 138 HB3 GLU 18 3HB GLU 18 -4.469 22.765 -13.763 139 HG2 GLU 18 2HG GLU 18 -6.118 23.882 -12.769 140 HG3 GLU 18 3HG GLU 18 -4.826 24.841 -12.071 141 H THR 19 H THR 19 -1.438 25.085 -15.494 142 HA THR 19 HA THR 19 -0.102 24.435 -17.226 143 HB THR 19 HB THR 19 0.770 22.020 -15.634 144 HG1 THR 19 HG1 THR 19 0.657 23.956 -14.360 145 HG21 THR 19 1HG2 THR 19 2.271 24.002 -17.418 146 HG22 THR 19 2HG2 THR 19 2.985 22.621 -16.558 147 HG23 THR 19 3HG2 THR 19 1.840 22.341 -17.877 148 H ASP 20 H ASP 20 -2.611 23.894 -17.816 149 HA ASP 20 HA ASP 20 -2.919 21.225 -18.962 150 HB2 ASP 20 2HB ASP 20 -4.773 22.868 -18.258 151 HB3 ASP 20 3HB ASP 20 -4.449 23.711 -19.773 152 H ARG 21 H ARG 21 -2.938 20.778 -21.234 153 HA ARG 21 HA ARG 21 -0.879 22.304 -22.811 154 HB2 ARG 21 2HB ARG 21 -0.955 19.299 -22.315 155 HB3 ARG 21 3HB ARG 21 0.165 20.134 -23.401 156 HG2 ARG 21 2HG ARG 21 1.076 21.431 -21.487 157 HG3 ARG 21 3HG ARG 21 0.008 20.540 -20.386 158 HD2 ARG 21 2HD ARG 21 1.081 18.404 -21.080 159 HD3 ARG 21 3HD ARG 21 2.139 19.300 -22.167 160 HE ARG 21 HE ARG 21 3.430 20.026 -20.386 161 HH11 ARG 21 1HH2 ARG 21 0.559 18.563 -19.002 162 HH12 ARG 21 2HH2 ARG 21 1.245 18.523 -17.402 163 HH21 ARG 21 1HH1 ARG 21 4.234 19.944 -18.324 164 HH22 ARG 21 2HH1 ARG 21 3.277 19.270 -17.040 165 H ASN 22 H ASN 22 -3.954 21.800 -23.005 166 HA ASN 22 HA ASN 22 -4.392 20.409 -25.458 167 HB2 ASN 22 2HB ASN 22 -6.619 21.255 -25.351 168 HB3 ASN 22 3HB ASN 22 -6.124 20.864 -23.713 169 HD21 ASN 22 2HD2 ASN 22 -7.616 23.204 -25.617 170 HD22 ASN 22 1HD2 ASN 22 -7.423 24.563 -24.499 171 H HIS 23 H HIS 23 -4.759 21.072 -27.524 172 HA HIS 23 HA HIS 23 -3.791 23.743 -28.427 173 HB2 HIS 23 2HB HIS 23 -2.163 22.677 -29.866 174 HB3 HIS 23 3HB HIS 23 -1.879 22.184 -28.206 175 HD2 HIS 23 HD2 HIS 23 -2.003 20.747 -31.557 176 HE1 HIS 23 HE1 HIS 23 -3.081 17.440 -29.087 177 HE2 HIS 23 HE2 HIS 23 -2.333 18.135 -31.420 178 H ASP 24 H ASP 24 -6.467 22.764 -28.428 179 HA ASP 24 HA ASP 24 -7.183 21.163 -30.577 180 HB2 ASP 24 2HB ASP 24 -9.141 23.214 -29.571 181 HB3 ASP 24 3HB ASP 24 -9.413 21.539 -30.013 182 H LEU 25 H LEU 25 -7.864 21.370 -32.617 183 HA LEU 25 HA LEU 25 -7.526 23.962 -33.979 184 HB2 LEU 25 2HB LEU 25 -6.968 22.854 -35.892 185 HB3 LEU 25 3HB LEU 25 -6.014 22.227 -34.558 186 HG LEU 25 HG LEU 25 -8.294 20.810 -35.968 187 HD11 LEU 25 1HD1 LEU 25 -6.537 19.325 -36.807 188 HD12 LEU 25 2HD1 LEU 25 -6.209 21.001 -37.268 189 HD13 LEU 25 3HD1 LEU 25 -5.306 20.258 -35.927 190 HD21 LEU 25 3HD2 LEU 25 -6.537 19.812 -33.693 191 HD22 LEU 25 1HD2 LEU 25 -8.322 19.956 -33.709 192 HD23 LEU 25 2HD2 LEU 25 -7.529 18.764 -34.728 193 H ALA 26 H ALA 26 -9.512 24.637 -33.090 194 HA ALA 26 HA ALA 26 -11.762 24.155 -34.952 195 HB1 ALA 26 3HB ALA 26 -13.359 23.938 -33.072 196 HB2 ALA 26 1HB ALA 26 -12.157 22.635 -33.060 197 HB3 ALA 26 2HB ALA 26 -12.011 23.990 -31.917 198 HA PRO 27 HA PRO 27 -12.086 28.612 -34.489 199 HB2 PRO 27 2HB PRO 27 -14.440 29.113 -35.741 200 HB3 PRO 27 3HB PRO 27 -12.987 28.547 -36.616 201 HG2 PRO 27 2HG PRO 27 -15.341 26.884 -35.664 202 HG3 PRO 27 3HG PRO 27 -14.547 26.872 -37.267 203 HD2 PRO 27 2HD PRO 27 -13.950 25.078 -35.266 204 HD3 PRO 27 3HD PRO 27 -12.733 25.633 -36.460 205 H ARG 28 H ARG 28 -12.281 29.222 -32.453 206 HA ARG 28 HA ARG 28 -14.947 29.301 -31.153 207 HB2 ARG 28 2HB ARG 28 -14.079 28.390 -29.084 208 HB3 ARG 28 3HB ARG 28 -13.854 27.269 -30.430 209 HG2 ARG 28 2HG ARG 28 -11.473 27.880 -30.597 210 HG3 ARG 28 3HG ARG 28 -11.672 29.041 -29.274 211 HD2 ARG 28 2HD ARG 28 -12.228 27.238 -27.717 212 HD3 ARG 28 3HD ARG 28 -12.247 26.061 -29.048 213 HE ARG 28 HE ARG 28 -9.694 27.423 -28.850 214 HH11 ARG 28 1HH1 ARG 28 -11.462 24.736 -27.385 215 HH12 ARG 28 2HH1 ARG 28 -9.956 23.869 -27.090 216 HH21 ARG 28 1HH2 ARG 28 -7.873 26.170 -28.371 217 HH22 ARG 28 2HH2 ARG 28 -8.128 24.599 -27.621 218 H GLN 29 H GLN 29 -15.001 30.490 -29.153 219 HA GLN 29 HA GLN 29 -13.545 33.103 -29.241 220 HB2 GLN 29 2HB GLN 29 -16.523 32.698 -28.809 221 HB3 GLN 29 3HB GLN 29 -15.665 34.234 -28.879 222 HG2 GLN 29 2HG GLN 29 -15.906 34.360 -31.118 223 HG3 GLN 29 3HG GLN 29 -15.243 32.744 -31.363 224 HE21 GLN 29 1HE2 GLN 29 -16.920 31.032 -30.205 225 HE22 GLN 29 2HE2 GLN 29 -18.532 31.158 -30.915 226 H ILE 30 H ILE 30 -12.371 32.754 -27.376 227 HA ILE 30 HA ILE 30 -13.574 31.857 -24.885 228 HB ILE 30 HB ILE 30 -10.821 32.997 -25.475 229 HG12 ILE 30 2HG1 ILE 30 -10.013 30.737 -25.120 230 HG13 ILE 30 3HG1 ILE 30 -11.645 30.150 -24.802 231 HG21 ILE 30 1HG2 ILE 30 -11.426 33.399 -23.108 232 HG22 ILE 30 2HG2 ILE 30 -11.966 31.717 -22.937 233 HG23 ILE 30 3HG2 ILE 30 -10.251 32.099 -23.205 234 HD11 ILE 30 3HD1 ILE 30 -12.231 30.251 -27.107 235 HD12 ILE 30 1HD1 ILE 30 -10.764 31.200 -27.507 236 HD13 ILE 30 2HD1 ILE 30 -10.637 29.501 -27.006 237 H ALA 31 H ALA 31 -14.999 33.092 -23.966 238 HA ALA 31 HA ALA 31 -14.383 35.960 -23.392 239 HB1 ALA 31 3HB ALA 31 -16.722 35.880 -22.406 240 HB2 ALA 31 1HB ALA 31 -16.612 35.726 -24.166 241 HB3 ALA 31 2HB ALA 31 -16.906 34.285 -23.161 242 H ARG 32 H ARG 32 -14.554 36.666 -21.199 243 HA ARG 32 HA ARG 32 -14.108 34.590 -19.091 244 HB2 ARG 32 2HB ARG 32 -12.622 37.125 -19.593 245 HB3 ARG 32 3HB ARG 32 -13.204 36.942 -17.932 246 HG2 ARG 32 2HG ARG 32 -12.206 34.739 -17.754 247 HG3 ARG 32 3HG ARG 32 -11.615 34.831 -19.425 248 HD2 ARG 32 2HD ARG 32 -10.030 36.500 -18.862 249 HD3 ARG 32 3HD ARG 32 -10.799 36.837 -17.295 250 HE ARG 32 HE ARG 32 -10.103 34.155 -17.138 251 HH11 ARG 32 1HH2 ARG 32 -8.122 36.998 -17.781 252 HH12 ARG 32 2HH2 ARG 32 -6.745 36.274 -16.990 253 HH21 ARG 32 1HH1 ARG 32 -8.390 33.311 -16.289 254 HH22 ARG 32 2HH1 ARG 32 -6.876 34.203 -16.161 255 H TYR 33 H TYR 33 -15.189 34.867 -17.128 256 HA TYR 33 HA TYR 33 -17.234 36.999 -16.969 257 HB2 TYR 33 2HB TYR 33 -17.887 34.063 -16.587 258 HB3 TYR 33 3HB TYR 33 -18.930 35.400 -16.206 259 HD1 TYR 33 HD2 TYR 33 -17.179 33.739 -19.073 260 HD2 TYR 33 HD1 TYR 33 -20.396 36.278 -17.779 261 HE1 TYR 33 HE2 TYR 33 -18.218 33.599 -21.335 262 HE2 TYR 33 HE1 TYR 33 -21.399 36.175 -20.057 263 HH TYR 33 HH TYR 33 -21.309 35.267 -22.081 264 H ARG 34 H ARG 34 -17.619 37.714 -14.948 265 HA ARG 34 HA ARG 34 -15.982 36.592 -12.719 266 HB2 ARG 34 2HB ARG 34 -15.526 38.920 -13.573 267 HB3 ARG 34 3HB ARG 34 -17.114 39.413 -12.981 268 HG2 ARG 34 2HG ARG 34 -16.501 38.946 -10.685 269 HG3 ARG 34 3HG ARG 34 -15.088 38.024 -11.188 270 HD2 ARG 34 2HD ARG 34 -14.285 40.297 -12.252 271 HD3 ARG 34 3HD ARG 34 -15.488 41.017 -11.161 272 HE ARG 34 HE ARG 34 -13.626 39.077 -9.933 273 HH11 ARG 34 1HH2 ARG 34 -13.980 42.503 -10.612 274 HH12 ARG 34 2HH2 ARG 34 -12.802 42.935 -9.403 275 HH21 ARG 34 1HH1 ARG 34 -12.177 39.671 -8.472 276 HH22 ARG 34 2HH1 ARG 34 -11.797 41.353 -8.204 277 H THR 35 H THR 35 -16.851 35.798 -10.984 278 HA THR 35 HA THR 35 -19.763 35.518 -10.746 279 HB THR 35 HB THR 35 -19.298 34.086 -8.788 280 HG1 THR 35 HG1 THR 35 -16.608 34.476 -9.376 281 HG21 THR 35 1HG2 THR 35 -18.097 32.310 -9.917 282 HG22 THR 35 2HG2 THR 35 -19.273 33.066 -11.011 283 HG23 THR 35 3HG2 THR 35 -17.544 33.419 -11.185 284 H ASP 36 H ASP 36 -20.511 35.627 -8.256 285 HA ASP 36 HA ASP 36 -20.401 38.499 -7.662 286 HB2 ASP 36 2HB ASP 36 -22.538 37.200 -7.720 287 HB3 ASP 36 3HB ASP 36 -21.980 36.256 -6.336 288 H ASN 37 H ASN 37 -18.664 35.773 -6.695 289 HA ASN 37 HA ASN 37 -17.833 36.861 -4.066 290 HB2 ASN 37 2HB ASN 37 -18.668 34.546 -4.286 291 HB3 ASN 37 3HB ASN 37 -17.423 34.188 -5.454 292 HD21 ASN 37 1HD2 ASN 37 -16.068 32.755 -4.421 293 HD22 ASN 37 2HD2 ASN 37 -15.527 32.946 -2.788 294 H GLY 38 H GLY 38 -17.127 37.699 -7.039 295 HA2 GLY 38 HA2 GLY 38 -15.364 39.000 -7.838 296 HA3 GLY 38 HA3 GLY 38 -14.305 38.406 -6.549 297 H GLU 39 H GLU 39 -15.654 35.698 -7.846 298 HA GLU 39 HA GLU 39 -12.985 34.990 -8.722 299 HB2 GLU 39 2HB GLU 39 -15.315 33.085 -8.768 300 HB3 GLU 39 3HB GLU 39 -13.611 32.770 -8.532 301 HG2 GLU 39 2HG GLU 39 -14.136 34.369 -6.355 302 HG3 GLU 39 3HG GLU 39 -15.767 33.749 -6.698 303 H GLU 40 H GLU 40 -12.278 35.174 -10.701 304 HA GLU 40 HA GLU 40 -14.158 35.326 -12.991 305 HB2 GLU 40 2HB GLU 40 -11.206 35.990 -12.701 306 HB3 GLU 40 3HB GLU 40 -12.126 36.147 -14.206 307 HG2 GLU 40 2HG GLU 40 -13.621 37.763 -13.206 308 HG3 GLU 40 3HG GLU 40 -12.886 37.558 -11.621 309 H PHE 41 H PHE 41 -14.452 33.822 -14.436 310 HA PHE 41 HA PHE 41 -12.466 31.617 -14.854 311 HB2 PHE 41 2HB PHE 41 -15.489 31.443 -14.739 312 HB3 PHE 41 3HB PHE 41 -14.437 30.148 -15.229 313 HD1 PHE 41 HD1 PHE 41 -15.556 32.164 -12.267 314 HD2 PHE 41 HD2 PHE 41 -13.156 28.837 -13.650 315 HE1 PHE 41 HE1 PHE 41 -15.259 31.395 -9.975 316 HE2 PHE 41 HE2 PHE 41 -12.815 28.117 -11.306 317 HZ PHE 41 HZ PHE 41 -13.861 29.397 -9.450 318 H GLU 42 H GLU 42 -12.715 30.511 -16.925 319 HA GLU 42 HA GLU 42 -13.362 32.427 -19.103 320 HB2 GLU 42 2HB GLU 42 -11.477 30.044 -19.281 321 HB3 GLU 42 3HB GLU 42 -11.729 31.374 -20.413 322 HG2 GLU 42 2HG GLU 42 -9.804 32.121 -19.449 323 HG3 GLU 42 3HG GLU 42 -11.021 32.883 -18.419 324 H VAL 43 H VAL 43 -14.729 31.894 -20.657 325 HA VAL 43 HA VAL 43 -15.783 29.088 -20.812 326 HB VAL 43 HB VAL 43 -17.388 31.576 -21.346 327 HG11 VAL 43 1HG1 VAL 43 -18.215 28.662 -21.071 328 HG12 VAL 43 2HG1 VAL 43 -19.263 30.057 -21.432 329 HG13 VAL 43 3HG1 VAL 43 -18.071 29.537 -22.610 330 HG21 VAL 43 3HG2 VAL 43 -18.527 31.215 -19.289 331 HG22 VAL 43 1HG2 VAL 43 -17.591 29.736 -18.936 332 HG23 VAL 43 2HG2 VAL 43 -16.830 31.337 -18.891 333 HA PRO 44 HA PRO 44 -14.392 29.810 -25.111 334 HB2 PRO 44 2HB PRO 44 -13.909 27.212 -25.776 335 HB3 PRO 44 3HB PRO 44 -12.764 28.196 -24.825 336 HG2 PRO 44 2HG PRO 44 -14.738 26.149 -23.820 337 HG3 PRO 44 3HG PRO 44 -13.043 26.409 -23.314 338 HD2 PRO 44 2HD PRO 44 -15.255 27.379 -21.960 339 HD3 PRO 44 3HD PRO 44 -13.654 28.177 -21.888 340 H PHE 45 H PHE 45 -16.042 30.328 -26.377 341 HA PHE 45 HA PHE 45 -18.401 28.532 -26.742 342 HB2 PHE 45 2HB PHE 45 -17.817 31.419 -27.435 343 HB3 PHE 45 3HB PHE 45 -19.189 30.581 -28.094 344 HD1 PHE 45 HD2 PHE 45 -17.639 31.876 -24.960 345 HD2 PHE 45 HD1 PHE 45 -21.132 30.046 -26.720 346 HE1 PHE 45 HE2 PHE 45 -18.969 32.446 -22.954 347 HE2 PHE 45 HE1 PHE 45 -22.446 30.605 -24.683 348 HZ PHE 45 HZ PHE 45 -21.351 31.813 -22.796 349 H ALA 46 H ALA 46 -18.915 27.664 -28.704 350 HA ALA 46 HA ALA 46 -16.768 27.455 -30.744 351 HB1 ALA 46 3HB ALA 46 -19.438 26.035 -30.445 352 HB2 ALA 46 1HB ALA 46 -18.201 25.679 -31.673 353 HB3 ALA 46 2HB ALA 46 -17.851 25.404 -29.957 354 H ASP 47 H ASP 47 -17.240 27.740 -33.014 355 HA ASP 47 HA ASP 47 -18.149 30.287 -33.670 356 HB2 ASP 47 2HB ASP 47 -16.579 28.886 -34.950 357 HB3 ASP 47 3HB ASP 47 -17.894 27.813 -35.431 358 H ASP 48 H ASP 48 -20.113 27.449 -33.294 359 HA ASP 48 HA ASP 48 -22.402 28.484 -34.848 360 HB2 ASP 48 2HB ASP 48 -23.550 26.509 -34.194 361 HB3 ASP 48 3HB ASP 48 -21.928 26.088 -34.738 362 H ALA 49 H ALA 49 -21.154 29.091 -31.816 363 HA ALA 49 HA ALA 49 -23.724 30.191 -30.737 364 HB1 ALA 49 3HB ALA 49 -22.851 28.272 -29.429 365 HB2 ALA 49 1HB ALA 49 -21.314 29.143 -29.197 366 HB3 ALA 49 2HB ALA 49 -22.819 29.784 -28.500 367 H GLU 50 H GLU 50 -23.566 32.145 -29.466 368 HA GLU 50 HA GLU 50 -21.085 33.744 -29.732 369 HB2 GLU 50 2HB GLU 50 -23.829 34.707 -30.626 370 HB3 GLU 50 3HB GLU 50 -22.465 35.785 -30.261 371 HG2 GLU 50 2HG GLU 50 -21.069 34.533 -31.902 372 HG3 GLU 50 3HG GLU 50 -22.490 33.604 -32.371 373 H ILE 51 H ILE 51 -20.727 35.187 -28.239 374 HA ILE 51 HA ILE 51 -21.169 34.446 -25.646 375 HB ILE 51 HB ILE 51 -20.310 37.246 -26.369 376 HG12 ILE 51 2HG1 ILE 51 -19.074 35.784 -27.891 377 HG13 ILE 51 3HG1 ILE 51 -18.026 36.503 -26.673 378 HG21 ILE 51 1HG2 ILE 51 -20.570 36.702 -23.921 379 HG22 ILE 51 2HG2 ILE 51 -19.421 35.377 -24.131 380 HG23 ILE 51 3HG2 ILE 51 -18.903 37.039 -24.396 381 HD11 ILE 51 3HD1 ILE 51 -19.056 33.642 -26.720 382 HD12 ILE 51 1HD1 ILE 51 -17.421 34.185 -27.125 383 HD13 ILE 51 2HD1 ILE 51 -17.988 34.319 -25.463 384 HA PRO 52 HA PRO 52 -24.964 36.777 -24.617 385 HB2 PRO 52 2HB PRO 52 -25.624 35.290 -22.438 386 HB3 PRO 52 3HB PRO 52 -25.974 34.753 -24.112 387 HG2 PRO 52 2HG PRO 52 -23.710 33.926 -22.291 388 HG3 PRO 52 3HG PRO 52 -24.715 32.903 -23.379 389 HD2 PRO 52 2HD PRO 52 -22.175 33.917 -23.979 390 HD3 PRO 52 3HD PRO 52 -23.355 33.433 -25.205 391 H GLY 53 H GLY 53 -25.221 38.318 -23.024 392 HA2 GLY 53 HA2 GLY 53 -23.124 39.655 -21.850 393 HA3 GLY 53 HA3 GLY 53 -24.793 39.751 -21.279 394 H THR 54 H THR 54 -24.850 36.916 -20.342 395 HA THR 54 HA THR 54 -22.667 36.787 -18.400 396 HB THR 54 HB THR 54 -24.292 36.181 -16.549 397 HG1 THR 54 HG1 THR 54 -26.513 36.511 -16.921 398 HG21 THR 54 1HG2 THR 54 -23.753 38.619 -16.800 399 HG22 THR 54 2HG2 THR 54 -25.233 38.820 -17.743 400 HG23 THR 54 3HG2 THR 54 -25.310 38.301 -16.042 401 H TRP 55 H TRP 55 -22.475 34.669 -17.293 402 HA TRP 55 HA TRP 55 -23.770 32.338 -18.492 403 HB2 TRP 55 2HB TRP 55 -21.974 33.081 -20.142 404 HB3 TRP 55 3HB TRP 55 -20.789 32.726 -18.897 405 HD1 TRP 55 HD1 TRP 55 -20.230 30.223 -18.404 406 HE1 TRP 55 HE1 TRP 55 -20.546 28.069 -19.729 407 HE3 TRP 55 HE3 TRP 55 -23.895 31.793 -21.580 408 HZ2 TRP 55 HZ2 TRP 55 -22.345 27.064 -21.777 409 HZ3 TRP 55 HZ3 TRP 55 -24.949 30.201 -23.185 410 HH2 TRP 55 HH2 TRP 55 -24.169 27.844 -23.299 411 H LEU 56 H LEU 56 -23.349 30.373 -17.297 412 HA LEU 56 HA LEU 56 -22.701 30.794 -14.523 413 HB2 LEU 56 2HB LEU 56 -24.235 28.993 -15.982 414 HB3 LEU 56 3HB LEU 56 -22.861 28.009 -15.475 415 HG LEU 56 HG LEU 56 -24.538 29.688 -13.567 416 HD11 LEU 56 1HD1 LEU 56 -25.941 27.972 -14.643 417 HD12 LEU 56 2HD1 LEU 56 -24.755 26.717 -14.221 418 HD13 LEU 56 3HD1 LEU 56 -25.650 27.575 -12.943 419 HD21 LEU 56 3HD2 LEU 56 -23.586 28.170 -11.849 420 HD22 LEU 56 1HD2 LEU 56 -22.595 27.379 -13.099 421 HD23 LEU 56 2HD2 LEU 56 -22.317 29.076 -12.678 422 H CYS 57 H CYS 57 -20.855 30.573 -13.474 423 HA CYS 57 HA CYS 57 -18.410 29.732 -14.927 424 HB2 CYS 57 2HB CYS 57 -18.921 31.310 -12.379 425 HB3 CYS 57 3HB CYS 57 -17.312 30.787 -12.889 426 HG CYS 57 HG CYS 57 -17.510 33.271 -13.544 427 H ARG 58 H ARG 58 -16.722 28.550 -13.727 428 HA ARG 58 HA ARG 58 -17.760 26.038 -12.824 429 HB2 ARG 58 2HB ARG 58 -14.884 27.006 -12.647 430 HB3 ARG 58 3HB ARG 58 -15.446 25.343 -12.582 431 HG2 ARG 58 2HG ARG 58 -16.314 25.582 -14.941 432 HG3 ARG 58 3HG ARG 58 -15.625 27.213 -14.984 433 HD2 ARG 58 2HD ARG 58 -14.076 25.759 -16.067 434 HD3 ARG 58 3HD ARG 58 -13.372 26.268 -14.523 435 HE ARG 58 HE ARG 58 -14.804 23.752 -14.287 436 HH11 ARG 58 1HH2 ARG 58 -11.726 25.007 -15.396 437 HH12 ARG 58 2HH2 ARG 58 -10.911 23.489 -15.135 438 HH21 ARG 58 1HH1 ARG 58 -13.703 21.849 -13.976 439 HH22 ARG 58 2HH1 ARG 58 -12.010 21.750 -14.362 440 H ASN 59 H ASN 59 -17.055 28.842 -10.934 441 HA ASN 59 HA ASN 59 -16.757 27.526 -8.401 442 HB2 ASN 59 2HB ASN 59 -16.146 29.831 -8.715 443 HB3 ASN 59 3HB ASN 59 -17.798 30.259 -9.181 444 HD21 ASN 59 1HD2 ASN 59 -17.699 31.933 -7.534 445 HD22 ASN 59 2HD2 ASN 59 -17.852 31.490 -5.865 446 H GLY 60 H GLY 60 -19.463 27.933 -10.503 447 HA2 GLY 60 HA2 GLY 60 -21.535 26.795 -10.349 448 HA3 GLY 60 HA3 GLY 60 -21.382 26.687 -8.594 449 H MET 61 H MET 61 -20.627 29.790 -9.911 450 HA MET 61 HA MET 61 -23.306 30.881 -9.221 451 HB2 MET 61 2HB MET 61 -21.396 31.528 -7.714 452 HB3 MET 61 3HB MET 61 -20.618 32.277 -9.092 453 HG2 MET 61 2HG MET 61 -21.839 33.894 -7.649 454 HG3 MET 61 3HG MET 61 -22.396 33.902 -9.318 455 HE1 MET 61 3HE MET 61 -24.101 35.375 -7.100 456 HE2 MET 61 1HE MET 61 -24.518 35.232 -8.825 457 HE3 MET 61 2HE MET 61 -25.719 34.828 -7.579 458 H GLU 62 H GLU 62 -24.192 32.468 -10.565 459 HA GLU 62 HA GLU 62 -23.541 32.403 -13.394 460 HB2 GLU 62 2HB GLU 62 -25.372 34.195 -11.762 461 HB3 GLU 62 3HB GLU 62 -25.203 34.264 -13.524 462 HG2 GLU 62 2HG GLU 62 -25.910 31.893 -13.697 463 HG3 GLU 62 3HG GLU 62 -26.110 31.816 -11.945 464 H GLY 63 H GLY 63 -21.733 33.247 -14.168 465 HA2 GLY 63 HA2 GLY 63 -20.409 35.559 -12.960 466 HA3 GLY 63 HA3 GLY 63 -19.806 34.591 -14.289 467 H THR 64 H THR 64 -20.098 37.547 -14.025 468 HA THR 64 HA THR 64 -21.781 38.035 -16.453 469 HB THR 64 HB THR 64 -20.647 40.052 -14.484 470 HG1 THR 64 HG1 THR 64 -22.341 38.842 -13.610 471 HG21 THR 64 1HG2 THR 64 -22.484 40.392 -16.902 472 HG22 THR 64 2HG2 THR 64 -22.345 41.600 -15.603 473 HG23 THR 64 3HG2 THR 64 -20.934 41.191 -16.583 474 H LEU 65 H LEU 65 -20.949 38.894 -18.287 475 HA LEU 65 HA LEU 65 -18.309 38.251 -18.986 476 HB2 LEU 65 2HB LEU 65 -20.359 38.402 -20.421 477 HB3 LEU 65 3HB LEU 65 -20.310 40.153 -20.279 478 HG LEU 65 HG LEU 65 -17.953 39.970 -21.407 479 HD11 LEU 65 1HD1 LEU 65 -17.573 37.993 -22.741 480 HD12 LEU 65 2HD1 LEU 65 -17.604 37.586 -21.024 481 HD13 LEU 65 3HD1 LEU 65 -19.007 37.205 -22.021 482 HD21 LEU 65 3HD2 LEU 65 -19.980 40.748 -22.598 483 HD22 LEU 65 1HD2 LEU 65 -18.962 39.756 -23.653 484 HD23 LEU 65 2HD2 LEU 65 -20.435 39.063 -22.933 485 H ILE 66 H ILE 66 -16.421 39.225 -18.632 486 HA ILE 66 HA ILE 66 -16.231 42.191 -18.429 487 HB ILE 66 HB ILE 66 -14.602 42.111 -16.704 488 HG12 ILE 66 2HG1 ILE 66 -13.408 40.064 -16.942 489 HG13 ILE 66 3HG1 ILE 66 -14.108 40.088 -15.330 490 HG21 ILE 66 1HG2 ILE 66 -15.963 41.550 -14.792 491 HG22 ILE 66 2HG2 ILE 66 -16.951 42.309 -16.054 492 HG23 ILE 66 3HG2 ILE 66 -17.034 40.558 -15.791 493 HD11 ILE 66 3HD1 ILE 66 -15.957 38.634 -16.229 494 HD12 ILE 66 1HD1 ILE 66 -14.915 38.448 -17.654 495 HD13 ILE 66 2HD1 ILE 66 -14.341 37.909 -16.067 496 H GLU 67 H GLU 67 -14.227 43.128 -18.996 497 HA GLU 67 HA GLU 67 -12.722 41.663 -21.081 498 HB2 GLU 67 2HB GLU 67 -12.566 44.534 -20.089 499 HB3 GLU 67 3HB GLU 67 -11.554 43.843 -21.365 500 HG2 GLU 67 2HG GLU 67 -13.576 43.327 -22.706 501 HG3 GLU 67 3HG GLU 67 -14.597 44.035 -21.452 502 H GLY 68 H GLY 68 -10.903 40.580 -20.676 503 HA2 GLY 68 HA2 GLY 68 -8.703 41.356 -19.110 504 HA3 GLY 68 HA3 GLY 68 -9.746 40.406 -18.046 505 H ASP 69 H ASP 69 -9.181 39.865 -21.559 506 HA ASP 69 HA ASP 69 -7.736 37.358 -21.078 507 HB2 ASP 69 2HB ASP 69 -10.359 37.079 -20.980 508 HB3 ASP 69 3HB ASP 69 -10.289 37.324 -22.717 509 H LEU 70 H LEU 70 -8.177 36.469 -23.767 510 HA LEU 70 HA LEU 70 -6.251 37.911 -25.338 511 HB2 LEU 70 2HB LEU 70 -8.264 35.721 -25.853 512 HB3 LEU 70 3HB LEU 70 -7.434 36.476 -27.195 513 HG LEU 70 HG LEU 70 -6.436 34.349 -26.509 514 HD11 LEU 70 1HD1 LEU 70 -5.105 36.030 -27.707 515 HD12 LEU 70 2HD1 LEU 70 -4.549 36.710 -26.158 516 HD13 LEU 70 3HD1 LEU 70 -4.112 35.055 -26.618 517 HD21 LEU 70 3HD2 LEU 70 -6.700 34.500 -24.051 518 HD22 LEU 70 1HD2 LEU 70 -5.042 34.128 -24.544 519 HD23 LEU 70 2HD2 LEU 70 -5.452 35.769 -24.006 520 HA PRO 71 HA PRO 71 -8.739 41.126 -27.077 521 HB2 PRO 71 2HB PRO 71 -7.436 41.753 -29.378 522 HB3 PRO 71 3HB PRO 71 -6.709 41.989 -27.763 523 HG2 PRO 71 2HG PRO 71 -6.302 39.635 -29.640 524 HG3 PRO 71 3HG PRO 71 -5.052 40.619 -28.813 525 HD2 PRO 71 2HD PRO 71 -5.940 38.247 -27.805 526 HD3 PRO 71 3HD PRO 71 -5.494 39.609 -26.736 527 H GLU 72 H GLU 72 -10.493 39.636 -27.178 528 HA GLU 72 HA GLU 72 -12.155 38.348 -28.030 529 HB2 GLU 72 2HB GLU 72 -11.916 40.712 -29.866 530 HB3 GLU 72 3HB GLU 72 -13.331 39.626 -29.854 531 HG2 GLU 72 2HG GLU 72 -13.701 40.156 -27.463 532 HG3 GLU 72 3HG GLU 72 -12.328 41.267 -27.490 533 HA PRO 73 HA PRO 73 -9.802 35.707 -31.068 534 HB2 PRO 73 2HB PRO 73 -11.379 33.838 -29.279 535 HB3 PRO 73 3HB PRO 73 -9.832 33.533 -30.133 536 HG2 PRO 73 2HG PRO 73 -9.803 34.227 -27.536 537 HG3 PRO 73 3HG PRO 73 -8.653 35.008 -28.668 538 HD2 PRO 73 2HD PRO 73 -11.223 36.118 -27.527 539 HD3 PRO 73 3HD PRO 73 -9.651 36.932 -27.800 540 H LYS 74 H LYS 74 -10.602 35.182 -32.930 541 HA LYS 74 HA LYS 74 -11.924 35.391 -34.736 542 HB2 LYS 74 2HB LYS 74 -12.246 33.019 -33.905 543 HB3 LYS 74 3HB LYS 74 -13.857 33.507 -33.363 544 HG2 LYS 74 2HG LYS 74 -14.467 34.119 -35.683 545 HG3 LYS 74 3HG LYS 74 -12.801 33.849 -36.215 546 HD2 LYS 74 2HD LYS 74 -13.003 31.446 -35.745 547 HD3 LYS 74 3HD LYS 74 -14.612 31.696 -35.052 548 HE2 LYS 74 2HE LYS 74 -14.870 30.822 -37.290 549 HE3 LYS 74 3HE LYS 74 -15.470 32.472 -37.229 550 HZ1 LYS 74 HZ1 LYS 74 -14.121 32.102 -39.206 551 HZ2 LYS 74 HZ2 LYS 74 -13.379 33.199 -38.276 552 HZ3 LYS 74 HZ3 LYS 74 -12.820 31.657 -38.321 553 H LYS 75 H LYS 75 -12.211 37.646 -33.347 554 HA LYS 75 HA LYS 75 -14.963 38.592 -33.413 555 HB2 LYS 75 2HB LYS 75 -13.103 39.723 -32.209 556 HB3 LYS 75 3HB LYS 75 -12.374 40.172 -33.757 557 HG2 LYS 75 2HG LYS 75 -14.378 41.527 -34.303 558 HG3 LYS 75 3HG LYS 75 -15.177 40.956 -32.822 559 HD2 LYS 75 2HD LYS 75 -13.284 41.958 -31.493 560 HD3 LYS 75 3HD LYS 75 -12.659 42.676 -32.988 561 HE2 LYS 75 2HE LYS 75 -14.702 43.990 -33.265 562 HE3 LYS 75 3HE LYS 75 -15.485 43.125 -31.932 563 HZ1 LYS 75 HZ1 LYS 75 -13.120 44.892 -31.630 564 HZ2 LYS 75 HZ2 LYS 75 -14.647 45.253 -31.165 565 HZ3 LYS 75 HZ3 LYS 75 -13.828 44.043 -30.417 566 H VAL 76 H VAL 76 -16.168 38.970 -35.096 567 HA VAL 76 HA VAL 76 -17.027 38.768 -37.149 568 HB VAL 76 HB VAL 76 -14.415 39.544 -38.440 569 HG11 VAL 76 1HG1 VAL 76 -15.945 40.354 -40.248 570 HG12 VAL 76 2HG1 VAL 76 -16.016 38.611 -40.018 571 HG13 VAL 76 3HG1 VAL 76 -17.315 39.650 -39.374 572 HG21 VAL 76 3HG2 VAL 76 -16.695 41.344 -37.497 573 HG22 VAL 76 1HG2 VAL 76 -15.028 41.351 -36.877 574 HG23 VAL 76 2HG2 VAL 76 -15.345 41.856 -38.535 575 H LYS 77 H LYS 77 -17.532 37.040 -38.273 576 HA LYS 77 HA LYS 77 -15.859 34.670 -37.967 577 HB2 LYS 77 2HB LYS 77 -18.755 35.020 -38.795 578 HB3 LYS 77 3HB LYS 77 -17.915 33.456 -38.802 579 HG2 LYS 77 2HG LYS 77 -17.342 33.714 -36.424 580 HG3 LYS 77 3HG LYS 77 -18.134 35.294 -36.376 581 HD2 LYS 77 2HD LYS 77 -20.318 34.317 -36.714 582 HD3 LYS 77 3HD LYS 77 -19.613 32.740 -37.109 583 HE2 LYS 77 2HE LYS 77 -20.477 32.694 -34.828 584 HE3 LYS 77 3HE LYS 77 -18.726 32.496 -34.852 585 HZ1 LYS 77 HZ1 LYS 77 -18.576 34.911 -34.310 586 HZ2 LYS 77 HZ2 LYS 77 -20.209 34.970 -34.121 587 HZ3 LYS 77 HZ3 LYS 77 -19.269 34.025 -33.139 588 HA PRO 78 HA PRO 78 -15.851 34.395 -42.740 589 HB2 PRO 78 2HB PRO 78 -16.532 36.619 -44.223 590 HB3 PRO 78 3HB PRO 78 -17.685 35.326 -43.775 591 HG2 PRO 78 2HG PRO 78 -17.200 37.966 -42.351 592 HG3 PRO 78 3HG PRO 78 -18.768 37.261 -42.868 593 HD2 PRO 78 2HD PRO 78 -17.911 36.979 -40.343 594 HD3 PRO 78 3HD PRO 78 -18.682 35.601 -41.174 595 HA PRO 79 HA PRO 79 -11.861 36.113 -42.598 596 HB2 PRO 79 2HB PRO 79 -10.948 36.142 -45.200 597 HB3 PRO 79 3HB PRO 79 -11.198 34.659 -44.230 598 HG2 PRO 79 2HG PRO 79 -13.105 35.917 -46.230 599 HG3 PRO 79 3HG PRO 79 -12.595 34.200 -46.113 600 HD2 PRO 79 2HD PRO 79 -14.929 35.033 -45.040 601 HD3 PRO 79 3HD PRO 79 -13.909 33.851 -44.167 602 H ARG 80 H ARG 80 -10.845 37.972 -42.411 603 HA ARG 80 HA ARG 80 -11.224 40.347 -44.048 604 HB2 ARG 80 2HB ARG 80 -12.013 41.770 -42.133 605 HB3 ARG 80 3HB ARG 80 -13.191 40.645 -42.777 606 HG2 ARG 80 2HG ARG 80 -13.564 40.521 -40.513 607 HG3 ARG 80 3HG ARG 80 -12.621 39.079 -40.822 608 HD2 ARG 80 2HD ARG 80 -10.597 40.734 -40.084 609 HD3 ARG 80 3HD ARG 80 -11.920 41.589 -39.320 610 HE ARG 80 HE ARG 80 -12.257 39.783 -37.831 611 HH11 ARG 80 2HH1 ARG 80 -9.721 38.855 -40.132 612 HH12 ARG 80 1HH1 ARG 80 -9.333 37.444 -39.178 613 HH21 ARG 80 1HH2 ARG 80 -11.769 38.002 -36.816 614 HH22 ARG 80 2HH2 ARG 80 -10.450 36.959 -37.335 Start of MODEL 23 1 H1 SER 1 1H SER 1 -6.660 38.499 -65.330 2 H2 SER 1 2H SER 1 -7.210 37.614 -64.058 3 H3 SER 1 3H SER 1 -5.698 38.230 -64.027 4 HA SER 1 HA SER 1 -6.508 40.474 -63.952 5 HB2 SER 1 2HB SER 1 -8.876 40.950 -63.835 6 HB3 SER 1 3HB SER 1 -8.586 39.966 -65.273 7 HG SER 1 HG SER 1 -10.361 39.167 -64.122 8 H MET 2 H MET 2 -7.931 41.358 -61.877 9 HA MET 2 HA MET 2 -6.722 40.199 -59.542 10 HB2 MET 2 2HB MET 2 -9.041 42.160 -59.769 11 HB3 MET 2 3HB MET 2 -8.145 41.780 -58.292 12 HG2 MET 2 2HG MET 2 -6.040 42.558 -59.417 13 HG3 MET 2 3HG MET 2 -7.012 43.079 -60.795 14 HE1 MET 2 3HE MET 2 -6.090 45.519 -60.728 15 HE2 MET 2 1HE MET 2 -5.979 46.493 -59.246 16 HE3 MET 2 2HE MET 2 -5.009 45.013 -59.409 17 H ALA 3 H ALA 3 -9.633 39.268 -61.218 18 HA ALA 3 HA ALA 3 -10.968 38.001 -58.991 19 HB1 ALA 3 3HB ALA 3 -12.348 37.000 -60.753 20 HB2 ALA 3 1HB ALA 3 -12.108 38.729 -61.064 21 HB3 ALA 3 2HB ALA 3 -11.187 37.517 -61.992 22 H ASP 4 H ASP 4 -8.128 37.090 -60.764 23 HA ASP 4 HA ASP 4 -8.394 34.204 -60.235 24 HB2 ASP 4 2HB ASP 4 -6.112 35.843 -61.388 25 HB3 ASP 4 3HB ASP 4 -6.143 34.090 -61.270 26 H ARG 5 H ARG 5 -7.638 36.761 -58.240 27 HA ARG 5 HA ARG 5 -5.368 35.728 -56.758 28 HB2 ARG 5 2HB ARG 5 -7.522 37.768 -56.060 29 HB3 ARG 5 3HB ARG 5 -6.138 37.405 -55.026 30 HG2 ARG 5 2HG ARG 5 -4.564 38.139 -56.736 31 HG3 ARG 5 3HG ARG 5 -5.878 38.424 -57.892 32 HD2 ARG 5 2HD ARG 5 -6.841 40.145 -56.435 33 HD3 ARG 5 3HD ARG 5 -5.592 39.838 -55.211 34 HE ARG 5 HE ARG 5 -4.217 40.442 -57.583 35 HH11 ARG 5 1HH2 ARG 5 -6.378 42.173 -55.436 36 HH12 ARG 5 2HH2 ARG 5 -5.653 43.715 -55.798 37 HH21 ARG 5 1HH1 ARG 5 -3.310 42.438 -57.968 38 HH22 ARG 5 2HH1 ARG 5 -3.941 43.846 -57.167 39 H VAL 6 H VAL 6 -5.312 34.875 -54.657 40 HA VAL 6 HA VAL 6 -7.366 32.882 -54.087 41 HB VAL 6 HB VAL 6 -5.833 32.154 -52.286 42 HG11 VAL 6 1HG1 VAL 6 -4.160 31.177 -53.771 43 HG12 VAL 6 2HG1 VAL 6 -5.754 31.164 -54.541 44 HG13 VAL 6 3HG1 VAL 6 -4.540 32.364 -55.036 45 HG21 VAL 6 3HG2 VAL 6 -4.646 34.300 -51.828 46 HG22 VAL 6 1HG2 VAL 6 -3.542 32.965 -52.170 47 HG23 VAL 6 2HG2 VAL 6 -3.853 34.186 -53.417 48 H LEU 7 H LEU 7 -8.479 32.670 -52.264 49 HA LEU 7 HA LEU 7 -9.316 35.177 -50.943 50 HB2 LEU 7 2HB LEU 7 -10.510 32.381 -50.858 51 HB3 LEU 7 3HB LEU 7 -11.243 33.831 -50.179 52 HG LEU 7 HG LEU 7 -10.727 33.326 -53.143 53 HD11 LEU 7 1HD1 LEU 7 -13.311 33.446 -51.534 54 HD12 LEU 7 2HD1 LEU 7 -13.171 33.200 -53.290 55 HD13 LEU 7 3HD1 LEU 7 -12.550 31.972 -52.176 56 HD21 LEU 7 3HD2 LEU 7 -10.585 35.734 -52.702 57 HD22 LEU 7 1HD2 LEU 7 -12.115 35.363 -53.498 58 HD23 LEU 7 2HD2 LEU 7 -12.086 35.675 -51.748 59 H ARG 8 H ARG 8 -7.169 32.716 -50.105 60 HA ARG 8 HA ARG 8 -7.024 33.704 -47.316 61 HB2 ARG 8 2HB ARG 8 -7.181 30.739 -48.052 62 HB3 ARG 8 3HB ARG 8 -6.484 31.338 -46.556 63 HG2 ARG 8 2HG ARG 8 -8.564 30.850 -45.814 64 HG3 ARG 8 3HG ARG 8 -8.767 32.557 -46.193 65 HD2 ARG 8 2HD ARG 8 -9.814 31.837 -48.409 66 HD3 ARG 8 3HD ARG 8 -9.603 30.171 -47.906 67 HE ARG 8 HE ARG 8 -11.420 30.348 -46.498 68 HH11 ARG 8 1HH2 ARG 8 -10.583 33.665 -47.396 69 HH12 ARG 8 2HH2 ARG 8 -12.051 34.284 -46.689 70 HH21 ARG 8 1HH1 ARG 8 -13.239 31.247 -45.633 71 HH22 ARG 8 2HH1 ARG 8 -13.498 32.963 -45.724 72 H GLY 9 H GLY 9 -4.985 33.425 -46.350 73 HA2 GLY 9 HA2 GLY 9 -2.641 32.336 -47.144 74 HA3 GLY 9 HA3 GLY 9 -2.738 33.726 -48.235 75 H SER 10 H SER 10 -4.076 35.475 -46.315 76 HA SER 10 HA SER 10 -1.926 36.308 -44.504 77 HB2 SER 10 2HB SER 10 -3.570 38.075 -43.880 78 HB3 SER 10 3HB SER 10 -3.216 38.010 -45.614 79 HG SER 10 HG SER 10 -5.472 38.195 -45.183 80 H ARG 11 H ARG 11 -2.541 36.791 -42.179 81 HA ARG 11 HA ARG 11 -3.139 34.375 -40.791 82 HB2 ARG 11 2HB ARG 11 -1.682 36.219 -39.946 83 HB3 ARG 11 3HB ARG 11 -3.099 37.245 -39.775 84 HG2 ARG 11 2HG ARG 11 -2.573 36.437 -37.602 85 HG3 ARG 11 3HG ARG 11 -4.045 35.619 -38.093 86 HD2 ARG 11 2HD ARG 11 -2.590 34.048 -36.981 87 HD3 ARG 11 3HD ARG 11 -2.687 33.597 -38.688 88 HE ARG 11 HE ARG 11 -0.425 35.328 -38.222 89 HH11 ARG 11 1HH2 ARG 11 -1.370 32.001 -37.656 90 HH12 ARG 11 2HH2 ARG 11 0.278 31.436 -37.673 91 HH21 ARG 11 1HH1 ARG 11 1.651 34.538 -38.241 92 HH22 ARG 11 2HH1 ARG 11 1.939 32.841 -37.990 93 H LEU 12 H LEU 12 -4.896 33.556 -39.870 94 HA LEU 12 HA LEU 12 -7.451 35.030 -39.717 95 HB2 LEU 12 2HB LEU 12 -8.662 33.177 -40.829 96 HB3 LEU 12 3HB LEU 12 -7.600 34.096 -41.870 97 HG LEU 12 HG LEU 12 -5.921 32.243 -41.817 98 HD11 LEU 12 1HD1 LEU 12 -6.433 31.052 -39.759 99 HD12 LEU 12 2HD1 LEU 12 -8.106 30.754 -40.295 100 HD13 LEU 12 3HD1 LEU 12 -6.736 29.976 -41.114 101 HD21 LEU 12 3HD2 LEU 12 -7.203 30.772 -43.300 102 HD22 LEU 12 1HD2 LEU 12 -8.728 31.461 -42.698 103 HD23 LEU 12 2HD2 LEU 12 -7.587 32.468 -43.618 104 H GLY 13 H GLY 13 -9.164 33.621 -38.602 105 HA2 GLY 13 HA2 GLY 13 -8.199 32.972 -35.973 106 HA3 GLY 13 HA3 GLY 13 -9.838 32.742 -36.575 107 H ALA 14 H ALA 14 -7.017 31.199 -35.580 108 HA ALA 14 HA ALA 14 -8.085 28.508 -36.122 109 HB1 ALA 14 3HB ALA 14 -5.933 27.764 -37.112 110 HB2 ALA 14 1HB ALA 14 -6.707 29.005 -38.114 111 HB3 ALA 14 2HB ALA 14 -5.331 29.436 -37.074 112 H VAL 15 H VAL 15 -7.021 26.860 -34.857 113 HA VAL 15 HA VAL 15 -5.347 27.798 -32.586 114 HB VAL 15 HB VAL 15 -7.587 25.891 -31.946 115 HG11 VAL 15 1HG1 VAL 15 -6.159 28.055 -30.330 116 HG12 VAL 15 2HG1 VAL 15 -7.353 26.896 -29.710 117 HG13 VAL 15 3HG1 VAL 15 -5.780 26.324 -30.263 118 HG21 VAL 15 3HG2 VAL 15 -8.977 27.782 -31.146 119 HG22 VAL 15 1HG2 VAL 15 -7.885 28.920 -31.954 120 HG23 VAL 15 2HG2 VAL 15 -8.844 27.755 -32.901 121 H SER 16 H SER 16 -4.714 26.357 -34.995 122 HA SER 16 HA SER 16 -3.398 24.670 -35.719 123 HB2 SER 16 2HB SER 16 -2.226 25.079 -32.955 124 HB3 SER 16 3HB SER 16 -1.385 24.404 -34.363 125 HG SER 16 HG SER 16 -0.974 26.649 -34.101 126 H TYR 17 H TYR 17 -5.642 23.373 -35.189 127 HA TYR 17 HA TYR 17 -4.859 20.810 -33.863 128 HB2 TYR 17 2HB TYR 17 -7.353 20.406 -33.852 129 HB3 TYR 17 3HB TYR 17 -6.766 21.691 -32.812 130 HD1 TYR 17 HD2 TYR 17 -8.661 20.971 -35.944 131 HD2 TYR 17 HD1 TYR 17 -7.304 23.995 -33.195 132 HE1 TYR 17 HE2 TYR 17 -10.110 22.653 -37.077 133 HE2 TYR 17 HE1 TYR 17 -8.807 25.669 -34.303 134 HH TYR 17 HH TYR 17 -10.834 24.822 -37.120 135 H GLU 18 H GLU 18 -6.174 22.097 -36.755 136 HA GLU 18 HA GLU 18 -4.971 20.184 -38.462 137 HB2 GLU 18 2HB GLU 18 -6.965 18.793 -37.692 138 HB3 GLU 18 3HB GLU 18 -8.017 19.977 -38.470 139 HG2 GLU 18 2HG GLU 18 -7.020 19.473 -40.656 140 HG3 GLU 18 3HG GLU 18 -5.796 18.448 -39.904 141 H THR 19 H THR 19 -7.460 22.470 -38.092 142 HA THR 19 HA THR 19 -8.179 24.370 -39.178 143 HB THR 19 HB THR 19 -5.267 24.657 -39.940 144 HG1 THR 19 HG1 THR 19 -5.004 25.507 -37.918 145 HG21 THR 19 1HG2 THR 19 -5.716 27.061 -39.598 146 HG22 THR 19 2HG2 THR 19 -6.781 26.420 -40.851 147 HG23 THR 19 3HG2 THR 19 -7.419 26.705 -39.217 148 H ASP 20 H ASP 20 -9.075 23.510 -42.429 149 HA ASP 20 HA ASP 20 -9.872 23.096 -39.632 150 HB2 ASP 20 2HB ASP 20 -9.927 25.578 -40.007 151 HB3 ASP 20 3HB ASP 20 -10.968 25.328 -41.409 152 H ARG 21 H ARG 21 -12.057 22.258 -39.438 153 HA ARG 21 HA ARG 21 -13.535 21.456 -41.834 154 HB2 ARG 21 2HB ARG 21 -13.485 19.053 -41.393 155 HB3 ARG 21 3HB ARG 21 -11.892 19.655 -41.804 156 HG2 ARG 21 2HG ARG 21 -11.053 19.412 -39.618 157 HG3 ARG 21 3HG ARG 21 -12.652 19.370 -38.876 158 HD2 ARG 21 2HD ARG 21 -11.622 17.199 -40.740 159 HD3 ARG 21 3HD ARG 21 -11.477 17.147 -38.973 160 HE ARG 21 HE ARG 21 -14.191 17.659 -39.501 161 HH11 ARG 21 1HH2 ARG 21 -12.030 14.959 -40.059 162 HH12 ARG 21 2HH2 ARG 21 -13.333 13.802 -39.961 163 HH21 ARG 21 1HH1 ARG 21 -15.726 16.235 -39.368 164 HH22 ARG 21 2HH1 ARG 21 -15.427 14.518 -39.574 165 H ASN 22 H ASN 22 -15.506 20.255 -41.366 166 HA ASN 22 HA ASN 22 -16.887 21.274 -38.976 167 HB2 ASN 22 2HB ASN 22 -17.789 21.366 -41.356 168 HB3 ASN 22 3HB ASN 22 -17.968 19.612 -41.287 169 HD21 ASN 22 2HD2 ASN 22 -20.271 20.285 -41.792 170 HD22 ASN 22 1HD2 ASN 22 -21.295 20.676 -40.417 171 H HIS 23 H HIS 23 -18.333 19.829 -37.750 172 HA HIS 23 HA HIS 23 -18.565 18.244 -36.153 173 HB2 HIS 23 2HB HIS 23 -19.478 17.224 -38.254 174 HB3 HIS 23 3HB HIS 23 -17.992 16.287 -38.390 175 HD2 HIS 23 HD2 HIS 23 -18.442 13.877 -37.563 176 HE1 HIS 23 HE1 HIS 23 -21.106 14.655 -34.322 177 HE2 HIS 23 HE2 HIS 23 -19.881 12.835 -35.614 178 H ASP 24 H ASP 24 -16.115 19.363 -35.930 179 HA ASP 24 HA ASP 24 -14.522 17.382 -34.480 180 HB2 ASP 24 2HB ASP 24 -13.931 17.571 -37.137 181 HB3 ASP 24 3HB ASP 24 -12.980 18.925 -36.544 182 H LEU 25 H LEU 25 -12.246 18.802 -34.091 183 HA LEU 25 HA LEU 25 -12.854 21.131 -32.505 184 HB2 LEU 25 2HB LEU 25 -10.283 20.127 -33.800 185 HB3 LEU 25 3HB LEU 25 -10.354 21.516 -32.724 186 HG LEU 25 HG LEU 25 -11.099 18.663 -31.931 187 HD11 LEU 25 1HD1 LEU 25 -9.004 18.723 -30.639 188 HD12 LEU 25 2HD1 LEU 25 -8.693 18.929 -32.368 189 HD13 LEU 25 3HD1 LEU 25 -8.637 20.339 -31.284 190 HD21 LEU 25 3HD2 LEU 25 -11.004 19.563 -29.608 191 HD22 LEU 25 1HD2 LEU 25 -10.815 21.204 -30.260 192 HD23 LEU 25 2HD2 LEU 25 -12.313 20.284 -30.543 193 H ALA 26 H ALA 26 -12.770 23.223 -33.018 194 HA ALA 26 HA ALA 26 -12.807 24.093 -35.867 195 HB1 ALA 26 3HB ALA 26 -15.109 24.075 -33.850 196 HB2 ALA 26 1HB ALA 26 -15.200 24.760 -35.482 197 HB3 ALA 26 2HB ALA 26 -14.951 23.017 -35.267 198 HA PRO 27 HA PRO 27 -11.779 28.207 -34.282 199 HB2 PRO 27 2HB PRO 27 -13.661 29.881 -35.470 200 HB3 PRO 27 3HB PRO 27 -12.187 29.254 -36.268 201 HG2 PRO 27 2HG PRO 27 -14.992 28.081 -36.370 202 HG3 PRO 27 3HG PRO 27 -13.881 28.430 -37.740 203 HD2 PRO 27 2HD PRO 27 -13.987 25.950 -36.790 204 HD3 PRO 27 3HD PRO 27 -12.384 26.703 -37.053 205 H ARG 28 H ARG 28 -12.216 29.353 -32.603 206 HA ARG 28 HA ARG 28 -14.829 29.226 -31.185 207 HB2 ARG 28 2HB ARG 28 -13.900 28.244 -29.216 208 HB3 ARG 28 3HB ARG 28 -13.509 27.242 -30.602 209 HG2 ARG 28 2HG ARG 28 -11.222 28.641 -30.585 210 HG3 ARG 28 3HG ARG 28 -11.711 29.004 -28.926 211 HD2 ARG 28 2HD ARG 28 -10.283 27.112 -28.851 212 HD3 ARG 28 3HD ARG 28 -11.917 26.500 -28.536 213 HE ARG 28 HE ARG 28 -11.708 26.183 -31.252 214 HH11 ARG 28 2HH2 ARG 28 -9.584 25.051 -28.698 215 HH12 ARG 28 1HH2 ARG 28 -8.921 23.796 -29.706 216 HH21 ARG 28 1HH1 ARG 28 -10.832 24.679 -32.450 217 HH22 ARG 28 2HH1 ARG 28 -9.601 23.596 -31.829 218 H GLN 29 H GLN 29 -14.825 30.365 -29.125 219 HA GLN 29 HA GLN 29 -13.287 32.915 -29.047 220 HB2 GLN 29 2HB GLN 29 -16.284 32.681 -28.556 221 HB3 GLN 29 3HB GLN 29 -15.315 34.147 -28.501 222 HG2 GLN 29 2HG GLN 29 -15.747 34.545 -30.665 223 HG3 GLN 29 3HG GLN 29 -15.009 33.015 -31.136 224 HE21 GLN 29 1HE2 GLN 29 -16.651 31.087 -30.144 225 HE22 GLN 29 2HE2 GLN 29 -18.243 31.242 -30.877 226 H ILE 30 H ILE 30 -12.243 32.767 -27.195 227 HA ILE 30 HA ILE 30 -13.441 31.496 -24.793 228 HB ILE 30 HB ILE 30 -10.695 32.761 -24.980 229 HG12 ILE 30 2HG1 ILE 30 -10.619 31.108 -26.698 230 HG13 ILE 30 3HG1 ILE 30 -9.746 30.521 -25.295 231 HG21 ILE 30 1HG2 ILE 30 -11.580 32.422 -22.728 232 HG22 ILE 30 2HG2 ILE 30 -11.991 30.740 -23.093 233 HG23 ILE 30 3HG2 ILE 30 -10.287 31.251 -23.032 234 HD11 ILE 30 3HD1 ILE 30 -11.669 29.070 -24.709 235 HD12 ILE 30 1HD1 ILE 30 -12.529 29.640 -26.171 236 HD13 ILE 30 2HD1 ILE 30 -11.023 28.722 -26.320 237 H ALA 31 H ALA 31 -14.973 32.797 -23.920 238 HA ALA 31 HA ALA 31 -14.333 35.673 -23.479 239 HB1 ALA 31 3HB ALA 31 -16.740 35.952 -23.096 240 HB2 ALA 31 1HB ALA 31 -16.379 35.312 -24.710 241 HB3 ALA 31 2HB ALA 31 -16.991 34.225 -23.428 242 H ARG 32 H ARG 32 -14.436 36.569 -21.456 243 HA ARG 32 HA ARG 32 -14.288 34.641 -19.160 244 HB2 ARG 32 2HB ARG 32 -13.061 37.323 -19.725 245 HB3 ARG 32 3HB ARG 32 -13.214 36.784 -18.050 246 HG2 ARG 32 2HG ARG 32 -11.746 34.978 -18.354 247 HG3 ARG 32 3HG ARG 32 -12.120 34.817 -20.061 248 HD2 ARG 32 2HD ARG 32 -10.923 37.282 -20.116 249 HD3 ARG 32 3HD ARG 32 -10.086 36.560 -18.745 250 HE ARG 32 HE ARG 32 -9.013 35.085 -20.210 251 HH11 ARG 32 1HH2 ARG 32 -11.437 36.824 -22.124 252 HH12 ARG 32 2HH2 ARG 32 -11.339 35.655 -23.419 253 HH21 ARG 32 2HH1 ARG 32 -8.648 33.965 -22.112 254 HH22 ARG 32 1HH1 ARG 32 -9.588 34.346 -23.527 255 H TYR 33 H TYR 33 -15.238 34.990 -17.190 256 HA TYR 33 HA TYR 33 -17.311 37.082 -17.003 257 HB2 TYR 33 2HB TYR 33 -17.906 34.143 -16.589 258 HB3 TYR 33 3HB TYR 33 -18.970 35.460 -16.193 259 HD1 TYR 33 HD2 TYR 33 -17.271 33.767 -19.075 260 HD2 TYR 33 HD1 TYR 33 -20.444 36.346 -17.758 261 HE1 TYR 33 HE2 TYR 33 -18.383 33.550 -21.298 262 HE2 TYR 33 HE1 TYR 33 -21.528 36.161 -19.989 263 HH TYR 33 HH TYR 33 -21.527 35.154 -21.970 264 H ARG 34 H ARG 34 -17.666 37.790 -14.935 265 HA ARG 34 HA ARG 34 -16.007 36.659 -12.727 266 HB2 ARG 34 2HB ARG 34 -15.477 38.946 -13.466 267 HB3 ARG 34 3HB ARG 34 -17.135 39.461 -13.159 268 HG2 ARG 34 2HG ARG 34 -16.913 39.240 -10.802 269 HG3 ARG 34 3HG ARG 34 -15.506 38.174 -10.942 270 HD2 ARG 34 2HD ARG 34 -14.793 40.336 -10.155 271 HD3 ARG 34 3HD ARG 34 -14.140 40.001 -11.750 272 HE ARG 34 HE ARG 34 -16.519 41.772 -11.294 273 HH11 ARG 34 2HH2 ARG 34 -13.448 41.292 -13.027 274 HH12 ARG 34 1HH2 ARG 34 -13.526 42.906 -13.677 275 HH21 ARG 34 1HH1 ARG 34 -16.530 43.746 -12.266 276 HH22 ARG 34 2HH1 ARG 34 -15.229 44.216 -13.316 277 H THR 35 H THR 35 -16.891 35.805 -11.029 278 HA THR 35 HA THR 35 -19.797 35.534 -10.763 279 HB THR 35 HB THR 35 -19.308 34.096 -8.815 280 HG1 THR 35 HG1 THR 35 -16.623 34.503 -9.415 281 HG21 THR 35 1HG2 THR 35 -17.567 33.444 -11.226 282 HG22 THR 35 2HG2 THR 35 -18.093 32.332 -9.948 283 HG23 THR 35 3HG2 THR 35 -19.290 33.071 -11.031 284 H ASP 36 H ASP 36 -20.529 35.635 -8.272 285 HA ASP 36 HA ASP 36 -20.428 38.505 -7.684 286 HB2 ASP 36 2HB ASP 36 -22.557 37.191 -7.722 287 HB3 ASP 36 3HB ASP 36 -21.983 36.260 -6.337 288 H ASN 37 H ASN 37 -18.661 35.796 -6.724 289 HA ASN 37 HA ASN 37 -17.816 36.905 -4.107 290 HB2 ASN 37 2HB ASN 37 -18.632 34.583 -4.302 291 HB3 ASN 37 3HB ASN 37 -17.397 34.229 -5.484 292 HD21 ASN 37 1HD2 ASN 37 -16.031 32.806 -4.457 293 HD22 ASN 37 2HD2 ASN 37 -15.463 33.013 -2.836 294 H GLY 38 H GLY 38 -17.146 37.729 -7.097 295 HA2 GLY 38 HA2 GLY 38 -15.405 39.015 -7.951 296 HA3 GLY 38 HA3 GLY 38 -14.340 38.498 -6.634 297 H GLU 39 H GLU 39 -15.671 35.727 -7.904 298 HA GLU 39 HA GLU 39 -12.984 35.019 -8.766 299 HB2 GLU 39 2HB GLU 39 -15.319 33.118 -8.829 300 HB3 GLU 39 3HB GLU 39 -13.614 32.798 -8.605 301 HG2 GLU 39 2HG GLU 39 -14.136 34.382 -6.408 302 HG3 GLU 39 3HG GLU 39 -15.766 33.757 -6.750 303 H GLU 40 H GLU 40 -12.290 35.241 -10.746 304 HA GLU 40 HA GLU 40 -14.183 35.419 -13.016 305 HB2 GLU 40 2HB GLU 40 -11.221 36.058 -12.877 306 HB3 GLU 40 3HB GLU 40 -12.310 36.387 -14.237 307 HG2 GLU 40 2HG GLU 40 -13.696 37.813 -12.734 308 HG3 GLU 40 3HG GLU 40 -12.521 37.596 -11.446 309 H PHE 41 H PHE 41 -14.468 33.929 -14.495 310 HA PHE 41 HA PHE 41 -12.470 31.740 -14.911 311 HB2 PHE 41 2HB PHE 41 -15.497 31.564 -14.834 312 HB3 PHE 41 3HB PHE 41 -14.441 30.272 -15.338 313 HD1 PHE 41 HD2 PHE 41 -15.570 32.245 -12.347 314 HD2 PHE 41 HD1 PHE 41 -13.197 28.916 -13.769 315 HE1 PHE 41 HE2 PHE 41 -15.278 31.449 -10.067 316 HE2 PHE 41 HE1 PHE 41 -12.856 28.171 -11.436 317 HZ PHE 41 HZ PHE 41 -13.889 29.439 -9.565 318 H GLU 42 H GLU 42 -12.703 30.644 -16.988 319 HA GLU 42 HA GLU 42 -13.446 32.498 -19.182 320 HB2 GLU 42 2HB GLU 42 -11.469 30.227 -19.480 321 HB3 GLU 42 3HB GLU 42 -11.761 31.611 -20.516 322 HG2 GLU 42 2HG GLU 42 -9.859 32.388 -19.596 323 HG3 GLU 42 3HG GLU 42 -10.919 32.942 -18.312 324 H VAL 43 H VAL 43 -14.942 31.857 -20.555 325 HA VAL 43 HA VAL 43 -15.934 29.047 -20.535 326 HB VAL 43 HB VAL 43 -17.487 31.534 -21.228 327 HG11 VAL 43 1HG1 VAL 43 -18.394 28.651 -20.854 328 HG12 VAL 43 2HG1 VAL 43 -19.397 30.059 -21.286 329 HG13 VAL 43 3HG1 VAL 43 -18.211 29.455 -22.426 330 HG21 VAL 43 3HG2 VAL 43 -16.948 31.330 -18.756 331 HG22 VAL 43 1HG2 VAL 43 -18.649 31.272 -19.172 332 HG23 VAL 43 2HG2 VAL 43 -17.792 29.762 -18.776 333 HA PRO 44 HA PRO 44 -14.447 29.350 -24.861 334 HB2 PRO 44 2HB PRO 44 -14.470 26.662 -25.418 335 HB3 PRO 44 3HB PRO 44 -13.158 27.455 -24.508 336 HG2 PRO 44 2HG PRO 44 -15.489 25.897 -23.405 337 HG3 PRO 44 3HG PRO 44 -13.766 25.824 -22.923 338 HD2 PRO 44 2HD PRO 44 -15.669 27.270 -21.578 339 HD3 PRO 44 3HD PRO 44 -13.960 27.807 -21.632 340 H PHE 45 H PHE 45 -15.797 29.873 -26.432 341 HA PHE 45 HA PHE 45 -18.412 28.425 -26.835 342 HB2 PHE 45 2HB PHE 45 -17.616 31.314 -27.253 343 HB3 PHE 45 3HB PHE 45 -18.983 30.631 -28.073 344 HD1 PHE 45 HD2 PHE 45 -17.616 31.621 -24.774 345 HD2 PHE 45 HD1 PHE 45 -21.081 30.171 -26.892 346 HE1 PHE 45 HE2 PHE 45 -19.049 32.183 -22.839 347 HE2 PHE 45 HE1 PHE 45 -22.503 30.735 -24.941 348 HZ PHE 45 HZ PHE 45 -21.468 31.690 -22.871 349 H ALA 46 H ALA 46 -18.941 27.810 -28.949 350 HA ALA 46 HA ALA 46 -16.681 27.596 -30.855 351 HB1 ALA 46 3HB ALA 46 -19.480 26.388 -30.912 352 HB2 ALA 46 1HB ALA 46 -18.150 26.020 -32.033 353 HB3 ALA 46 2HB ALA 46 -18.007 25.582 -30.322 354 H ASP 47 H ASP 47 -16.951 28.215 -33.120 355 HA ASP 47 HA ASP 47 -18.005 30.800 -33.567 356 HB2 ASP 47 2HB ASP 47 -16.188 29.725 -34.838 357 HB3 ASP 47 3HB ASP 47 -17.343 28.599 -35.557 358 H ASP 48 H ASP 48 -19.711 27.777 -33.649 359 HA ASP 48 HA ASP 48 -22.018 28.655 -35.209 360 HB2 ASP 48 2HB ASP 48 -21.253 26.288 -34.935 361 HB3 ASP 48 3HB ASP 48 -21.695 26.374 -33.231 362 H ALA 49 H ALA 49 -20.924 29.370 -32.066 363 HA ALA 49 HA ALA 49 -23.624 30.123 -31.030 364 HB1 ALA 49 3HB ALA 49 -21.113 29.357 -29.487 365 HB2 ALA 49 1HB ALA 49 -22.714 29.711 -28.807 366 HB3 ALA 49 2HB ALA 49 -22.484 28.270 -29.811 367 H GLU 50 H GLU 50 -23.351 31.848 -29.247 368 HA GLU 50 HA GLU 50 -21.346 33.942 -29.856 369 HB2 GLU 50 2HB GLU 50 -22.991 35.685 -29.864 370 HB3 GLU 50 3HB GLU 50 -23.418 34.493 -31.093 371 HG2 GLU 50 2HG GLU 50 -25.112 33.517 -29.514 372 HG3 GLU 50 3HG GLU 50 -24.711 34.774 -28.341 373 H ILE 51 H ILE 51 -21.315 35.618 -28.089 374 HA ILE 51 HA ILE 51 -21.283 34.342 -25.455 375 HB ILE 51 HB ILE 51 -20.312 37.125 -26.085 376 HG12 ILE 51 2HG1 ILE 51 -19.244 35.693 -27.735 377 HG13 ILE 51 3HG1 ILE 51 -18.087 36.302 -26.549 378 HG21 ILE 51 1HG2 ILE 51 -18.828 36.744 -24.172 379 HG22 ILE 51 2HG2 ILE 51 -20.505 36.482 -23.679 380 HG23 ILE 51 3HG2 ILE 51 -19.436 35.103 -23.981 381 HD11 ILE 51 3HD1 ILE 51 -17.590 34.000 -27.113 382 HD12 ILE 51 1HD1 ILE 51 -18.147 34.043 -25.442 383 HD13 ILE 51 2HD1 ILE 51 -19.246 33.494 -26.728 384 HA PRO 52 HA PRO 52 -25.033 36.804 -24.504 385 HB2 PRO 52 2HB PRO 52 -25.743 35.351 -22.291 386 HB3 PRO 52 3HB PRO 52 -26.143 34.851 -23.966 387 HG2 PRO 52 2HG PRO 52 -23.886 33.913 -22.188 388 HG3 PRO 52 3HG PRO 52 -24.967 32.935 -23.241 389 HD2 PRO 52 2HD PRO 52 -22.422 33.737 -23.950 390 HD3 PRO 52 3HD PRO 52 -23.707 33.492 -25.150 391 H GLY 53 H GLY 53 -25.315 38.345 -22.911 392 HA2 GLY 53 HA2 GLY 53 -23.219 39.682 -21.745 393 HA3 GLY 53 HA3 GLY 53 -24.886 39.789 -21.170 394 H THR 54 H THR 54 -24.952 36.958 -20.209 395 HA THR 54 HA THR 54 -22.740 36.827 -18.294 396 HB THR 54 HB THR 54 -24.328 36.237 -16.418 397 HG1 THR 54 HG1 THR 54 -26.558 36.575 -16.746 398 HG21 THR 54 1HG2 THR 54 -25.303 38.866 -17.604 399 HG22 THR 54 2HG2 THR 54 -25.314 38.361 -15.897 400 HG23 THR 54 3HG2 THR 54 -23.788 38.675 -16.719 401 H TRP 55 H TRP 55 -22.528 34.687 -17.225 402 HA TRP 55 HA TRP 55 -23.912 32.372 -18.366 403 HB2 TRP 55 2HB TRP 55 -22.182 33.057 -20.093 404 HB3 TRP 55 3HB TRP 55 -20.946 32.732 -18.890 405 HD1 TRP 55 HD1 TRP 55 -20.371 30.241 -18.389 406 HE1 TRP 55 HE1 TRP 55 -20.712 28.082 -19.681 407 HE3 TRP 55 HE3 TRP 55 -24.133 31.782 -21.450 408 HZ2 TRP 55 HZ2 TRP 55 -22.522 27.076 -21.733 409 HZ3 TRP 55 HZ3 TRP 55 -25.171 30.202 -23.081 410 HH2 TRP 55 HH2 TRP 55 -24.365 27.856 -23.232 411 H LEU 56 H LEU 56 -23.501 30.418 -17.183 412 HA LEU 56 HA LEU 56 -22.752 30.820 -14.438 413 HB2 LEU 56 2HB LEU 56 -24.368 29.053 -15.842 414 HB3 LEU 56 3HB LEU 56 -22.994 28.043 -15.386 415 HG LEU 56 HG LEU 56 -24.561 29.748 -13.411 416 HD11 LEU 56 1HD1 LEU 56 -26.047 28.074 -14.442 417 HD12 LEU 56 2HD1 LEU 56 -24.875 26.788 -14.070 418 HD13 LEU 56 3HD1 LEU 56 -25.699 27.661 -12.756 419 HD21 LEU 56 3HD2 LEU 56 -23.583 28.196 -11.741 420 HD22 LEU 56 1HD2 LEU 56 -22.660 27.389 -13.031 421 HD23 LEU 56 2HD2 LEU 56 -22.323 29.076 -12.612 422 H CYS 57 H CYS 57 -20.888 30.600 -13.464 423 HA CYS 57 HA CYS 57 -18.496 29.714 -14.985 424 HB2 CYS 57 2HB CYS 57 -18.918 31.360 -12.464 425 HB3 CYS 57 3HB CYS 57 -17.325 30.859 -13.043 426 HG CYS 57 HG CYS 57 -19.617 32.394 -14.865 427 H ARG 58 H ARG 58 -16.756 28.592 -13.785 428 HA ARG 58 HA ARG 58 -17.763 26.084 -12.844 429 HB2 ARG 58 2HB ARG 58 -14.883 27.050 -12.733 430 HB3 ARG 58 3HB ARG 58 -15.451 25.388 -12.660 431 HG2 ARG 58 2HG ARG 58 -16.374 25.639 -14.991 432 HG3 ARG 58 3HG ARG 58 -15.675 27.266 -15.052 433 HD2 ARG 58 2HD ARG 58 -14.158 25.785 -16.181 434 HD3 ARG 58 3HD ARG 58 -13.415 26.322 -14.681 435 HE ARG 58 HE ARG 58 -13.451 24.153 -13.852 436 HH11 ARG 58 1HH2 ARG 58 -15.393 24.147 -16.774 437 HH12 ARG 58 2HH2 ARG 58 -15.493 22.408 -16.805 438 HH21 ARG 58 2HH1 ARG 58 -13.627 21.948 -13.955 439 HH22 ARG 58 1HH1 ARG 58 -14.518 21.204 -15.250 440 H ASN 59 H ASN 59 -17.061 28.900 -10.980 441 HA ASN 59 HA ASN 59 -16.695 27.585 -8.453 442 HB2 ASN 59 2HB ASN 59 -16.115 29.897 -8.764 443 HB3 ASN 59 3HB ASN 59 -17.779 30.305 -9.208 444 HD21 ASN 59 1HD2 ASN 59 -17.686 31.974 -7.558 445 HD22 ASN 59 2HD2 ASN 59 -17.818 31.526 -5.890 446 H GLY 60 H GLY 60 -19.440 27.960 -10.512 447 HA2 GLY 60 HA2 GLY 60 -21.509 26.823 -10.318 448 HA3 GLY 60 HA3 GLY 60 -21.325 26.718 -8.566 449 H MET 61 H MET 61 -20.636 29.813 -9.998 450 HA MET 61 HA MET 61 -23.306 30.889 -9.241 451 HB2 MET 61 2HB MET 61 -21.399 31.535 -7.725 452 HB3 MET 61 3HB MET 61 -20.628 32.302 -9.096 453 HG2 MET 61 2HG MET 61 -21.856 33.892 -7.628 454 HG3 MET 61 3HG MET 61 -22.412 33.922 -9.299 455 HE1 MET 61 3HE MET 61 -24.116 35.351 -7.043 456 HE2 MET 61 1HE MET 61 -24.534 35.246 -8.771 457 HE3 MET 61 2HE MET 61 -25.733 34.813 -7.534 458 H GLU 62 H GLU 62 -24.194 32.511 -10.551 459 HA GLU 62 HA GLU 62 -23.574 32.480 -13.386 460 HB2 GLU 62 2HB GLU 62 -25.369 34.267 -11.709 461 HB3 GLU 62 3HB GLU 62 -25.223 34.352 -13.472 462 HG2 GLU 62 2HG GLU 62 -25.949 31.986 -13.656 463 HG3 GLU 62 3HG GLU 62 -26.131 31.898 -11.902 464 H GLY 63 H GLY 63 -21.782 33.324 -14.180 465 HA2 GLY 63 HA2 GLY 63 -20.424 35.605 -12.948 466 HA3 GLY 63 HA3 GLY 63 -19.823 34.653 -14.283 467 H THR 64 H THR 64 -20.110 37.617 -14.014 468 HA THR 64 HA THR 64 -21.811 38.110 -16.423 469 HB THR 64 HB THR 64 -20.669 40.127 -14.456 470 HG1 THR 64 HG1 THR 64 -22.347 38.908 -13.572 471 HG21 THR 64 1HG2 THR 64 -22.372 41.671 -15.558 472 HG22 THR 64 2HG2 THR 64 -20.976 41.262 -16.559 473 HG23 THR 64 3HG2 THR 64 -22.531 40.463 -16.855 474 H LEU 65 H LEU 65 -21.010 38.953 -18.270 475 HA LEU 65 HA LEU 65 -18.431 38.161 -18.997 476 HB2 LEU 65 2HB LEU 65 -20.516 38.321 -20.345 477 HB3 LEU 65 3HB LEU 65 -20.338 40.056 -20.390 478 HG LEU 65 HG LEU 65 -18.711 37.873 -21.746 479 HD11 LEU 65 1HD1 LEU 65 -20.829 38.677 -22.765 480 HD12 LEU 65 2HD1 LEU 65 -20.186 40.331 -22.791 481 HD13 LEU 65 3HD1 LEU 65 -19.428 39.067 -23.778 482 HD21 LEU 65 3HD2 LEU 65 -16.946 39.381 -21.170 483 HD22 LEU 65 1HD2 LEU 65 -17.347 39.664 -22.851 484 HD23 LEU 65 2HD2 LEU 65 -17.926 40.809 -21.619 485 H ILE 66 H ILE 66 -16.492 39.047 -18.665 486 HA ILE 66 HA ILE 66 -16.081 41.975 -18.852 487 HB ILE 66 HB ILE 66 -14.527 42.056 -17.087 488 HG12 ILE 66 2HG1 ILE 66 -13.357 39.968 -17.133 489 HG13 ILE 66 3HG1 ILE 66 -14.020 40.201 -15.525 490 HG21 ILE 66 1HG2 ILE 66 -16.943 40.593 -15.992 491 HG22 ILE 66 2HG2 ILE 66 -15.873 41.683 -15.111 492 HG23 ILE 66 3HG2 ILE 66 -16.880 42.313 -16.429 493 HD11 ILE 66 3HD1 ILE 66 -14.961 38.297 -17.598 494 HD12 ILE 66 1HD1 ILE 66 -14.250 37.933 -16.024 495 HD13 ILE 66 2HD1 ILE 66 -15.875 38.652 -16.126 496 H GLU 67 H GLU 67 -13.914 42.548 -19.669 497 HA GLU 67 HA GLU 67 -12.130 40.301 -20.310 498 HB2 GLU 67 2HB GLU 67 -13.070 42.341 -22.359 499 HB3 GLU 67 3HB GLU 67 -11.652 41.324 -22.550 500 HG2 GLU 67 2HG GLU 67 -14.535 40.372 -22.338 501 HG3 GLU 67 3HG GLU 67 -13.558 40.445 -23.793 502 H GLY 68 H GLY 68 -9.995 40.774 -20.318 503 HA2 GLY 68 HA2 GLY 68 -9.076 43.060 -18.817 504 HA3 GLY 68 HA3 GLY 68 -8.080 41.816 -19.574 505 H ASP 69 H ASP 69 -9.828 42.935 -22.117 506 HA ASP 69 HA ASP 69 -8.640 45.487 -22.650 507 HB2 ASP 69 2HB ASP 69 -6.830 43.914 -23.404 508 HB3 ASP 69 3HB ASP 69 -7.998 43.111 -24.458 509 H LEU 70 H LEU 70 -9.671 46.355 -24.579 510 HA LEU 70 HA LEU 70 -12.476 46.055 -24.366 511 HB2 LEU 70 2HB LEU 70 -10.840 47.486 -26.479 512 HB3 LEU 70 3HB LEU 70 -12.578 47.669 -26.284 513 HG LEU 70 HG LEU 70 -10.566 48.368 -24.105 514 HD11 LEU 70 1HD1 LEU 70 -10.241 49.788 -26.084 515 HD12 LEU 70 2HD1 LEU 70 -11.976 50.179 -26.101 516 HD13 LEU 70 3HD1 LEU 70 -10.951 50.704 -24.745 517 HD21 LEU 70 3HD2 LEU 70 -12.827 47.930 -23.222 518 HD22 LEU 70 1HD2 LEU 70 -12.458 49.655 -23.154 519 HD23 LEU 70 2HD2 LEU 70 -13.528 49.033 -24.429 520 HA PRO 71 HA PRO 71 -13.019 42.724 -27.335 521 HB2 PRO 71 2HB PRO 71 -15.636 42.160 -26.973 522 HB3 PRO 71 3HB PRO 71 -14.448 41.962 -25.656 523 HG2 PRO 71 2HG PRO 71 -16.262 44.355 -26.148 524 HG3 PRO 71 3HG PRO 71 -16.064 43.414 -24.633 525 HD2 PRO 71 2HD PRO 71 -14.674 45.726 -25.123 526 HD3 PRO 71 3HD PRO 71 -13.969 44.367 -24.198 527 H GLU 72 H GLU 72 -12.471 44.762 -28.775 528 HA GLU 72 HA GLU 72 -12.881 46.312 -30.420 529 HB2 GLU 72 2HB GLU 72 -13.976 43.685 -31.394 530 HB3 GLU 72 3HB GLU 72 -13.729 45.086 -32.470 531 HG2 GLU 72 2HG GLU 72 -11.346 45.103 -31.978 532 HG3 GLU 72 3HG GLU 72 -11.537 43.790 -30.811 533 HA PRO 73 HA PRO 73 -17.393 47.132 -29.470 534 HB2 PRO 73 2HB PRO 73 -17.304 49.165 -27.703 535 HB3 PRO 73 3HB PRO 73 -16.893 47.490 -27.233 536 HG2 PRO 73 2HG PRO 73 -14.950 49.687 -28.065 537 HG3 PRO 73 3HG PRO 73 -14.920 48.698 -26.570 538 HD2 PRO 73 2HD PRO 73 -13.462 48.006 -28.767 539 HD3 PRO 73 3HD PRO 73 -14.237 46.784 -27.717 540 H LYS 74 H LYS 74 -16.532 47.649 -31.763 541 HA LYS 74 HA LYS 74 -17.204 50.487 -32.524 542 HB2 LYS 74 2HB LYS 74 -14.788 49.950 -32.629 543 HB3 LYS 74 3HB LYS 74 -15.120 48.614 -33.737 544 HG2 LYS 74 2HG LYS 74 -15.877 50.166 -35.465 545 HG3 LYS 74 3HG LYS 74 -15.775 51.533 -34.333 546 HD2 LYS 74 2HD LYS 74 -13.322 51.198 -34.160 547 HD3 LYS 74 3HD LYS 74 -13.431 49.819 -35.277 548 HE2 LYS 74 2HE LYS 74 -14.351 51.322 -37.032 549 HE3 LYS 74 3HE LYS 74 -14.246 52.692 -35.920 550 HZ1 LYS 74 HZ1 LYS 74 -11.828 52.374 -35.862 551 HZ2 LYS 74 HZ2 LYS 74 -11.925 51.107 -36.891 552 HZ3 LYS 74 HZ3 LYS 74 -12.323 52.605 -37.398 553 H LYS 75 H LYS 75 -18.053 47.204 -32.967 554 HA LYS 75 HA LYS 75 -18.615 47.115 -35.736 555 HB2 LYS 75 2HB LYS 75 -20.103 45.480 -33.669 556 HB3 LYS 75 3HB LYS 75 -19.759 45.043 -35.338 557 HG2 LYS 75 2HG LYS 75 -17.665 45.337 -33.123 558 HG3 LYS 75 3HG LYS 75 -18.410 43.830 -33.617 559 HD2 LYS 75 2HD LYS 75 -17.432 43.954 -35.841 560 HD3 LYS 75 3HD LYS 75 -16.779 45.575 -35.501 561 HE2 LYS 75 2HE LYS 75 -15.475 44.631 -33.599 562 HE3 LYS 75 3HE LYS 75 -16.047 43.012 -34.011 563 HZ1 LYS 75 HZ1 LYS 75 -14.891 43.173 -36.118 564 HZ2 LYS 75 HZ2 LYS 75 -14.464 44.731 -35.848 565 HZ3 LYS 75 HZ3 LYS 75 -13.822 43.549 -34.927 566 H VAL 76 H VAL 76 -20.262 47.617 -37.006 567 HA VAL 76 HA VAL 76 -22.334 49.416 -36.098 568 HB VAL 76 HB VAL 76 -23.162 49.362 -38.412 569 HG11 VAL 76 1HG1 VAL 76 -21.225 50.431 -39.430 570 HG12 VAL 76 2HG1 VAL 76 -21.362 50.908 -37.730 571 HG13 VAL 76 3HG1 VAL 76 -20.141 49.714 -38.221 572 HG21 VAL 76 3HG2 VAL 76 -21.955 48.184 -40.177 573 HG22 VAL 76 1HG2 VAL 76 -20.889 47.407 -38.993 574 HG23 VAL 76 2HG2 VAL 76 -22.623 47.016 -39.032 575 H LYS 77 H LYS 77 -24.593 49.214 -36.285 576 HA LYS 77 HA LYS 77 -25.808 46.516 -36.312 577 HB2 LYS 77 2HB LYS 77 -25.115 47.030 -33.961 578 HB3 LYS 77 3HB LYS 77 -26.114 48.486 -33.998 579 HG2 LYS 77 2HG LYS 77 -28.133 47.046 -34.384 580 HG3 LYS 77 3HG LYS 77 -27.111 45.611 -34.267 581 HD2 LYS 77 2HD LYS 77 -27.570 47.695 -32.089 582 HD3 LYS 77 3HD LYS 77 -28.344 46.119 -32.162 583 HE2 LYS 77 2HE LYS 77 -25.340 46.587 -31.850 584 HE3 LYS 77 3HE LYS 77 -26.461 46.257 -30.531 585 HZ1 LYS 77 HZ1 LYS 77 -26.956 44.102 -31.560 586 HZ2 LYS 77 HZ2 LYS 77 -25.888 44.385 -32.766 587 HZ3 LYS 77 HZ3 LYS 77 -25.366 44.229 -31.229 588 HA PRO 78 HA PRO 78 -28.712 48.910 -38.690 589 HB2 PRO 78 2HB PRO 78 -30.997 47.346 -38.556 590 HB3 PRO 78 3HB PRO 78 -29.581 47.009 -39.595 591 HG2 PRO 78 2HG PRO 78 -30.180 45.882 -36.841 592 HG3 PRO 78 3HG PRO 78 -29.691 44.992 -38.320 593 HD2 PRO 78 2HD PRO 78 -27.871 45.636 -36.453 594 HD3 PRO 78 3HD PRO 78 -27.462 45.817 -38.183 595 HA PRO 79 HA PRO 79 -30.866 49.796 -39.438 596 HB2 PRO 79 2HB PRO 79 -31.952 52.268 -39.617 597 HB3 PRO 79 3HB PRO 79 -32.836 50.896 -38.884 598 HG2 PRO 79 2HG PRO 79 -31.213 53.030 -37.445 599 HG3 PRO 79 3HG PRO 79 -32.909 52.537 -37.125 600 HD2 PRO 79 2HD PRO 79 -30.810 51.493 -35.720 601 HD3 PRO 79 3HD PRO 79 -32.233 50.502 -36.150 602 H ARG 80 H ARG 80 -28.447 51.264 -37.620 603 HA ARG 80 HA ARG 80 -27.487 53.279 -39.484 604 HB2 ARG 80 2HB ARG 80 -26.040 51.885 -37.202 605 HB3 ARG 80 3HB ARG 80 -25.477 53.317 -38.048 606 HG2 ARG 80 2HG ARG 80 -28.066 53.204 -36.416 607 HG3 ARG 80 3HG ARG 80 -26.506 53.754 -35.807 608 HD2 ARG 80 2HD ARG 80 -26.446 55.539 -37.553 609 HD3 ARG 80 3HD ARG 80 -28.028 55.011 -38.122 610 HE ARG 80 HE ARG 80 -29.068 55.961 -36.281 611 HH11 ARG 80 1HH2 ARG 80 -25.607 56.212 -35.764 612 HH12 ARG 80 2HH2 ARG 80 -25.804 57.315 -34.428 613 HH21 ARG 80 1HH1 ARG 80 -29.233 57.363 -34.582 614 HH22 ARG 80 2HH1 ARG 80 -27.801 57.945 -33.785 Start of MODEL 24 1 H1 SER 1 1H SER 1 0.713 19.120 -45.770 2 H2 SER 1 2H SER 1 -0.322 19.369 -47.029 3 H3 SER 1 3H SER 1 1.047 18.491 -47.241 4 HA SER 1 HA SER 1 -0.826 17.049 -47.181 5 HB2 SER 1 2HB SER 1 0.903 16.685 -44.717 6 HB3 SER 1 3HB SER 1 0.007 15.438 -45.607 7 HG SER 1 HG SER 1 2.195 15.507 -46.258 8 H MET 2 H MET 2 -0.422 18.367 -43.803 9 HA MET 2 HA MET 2 -3.152 17.504 -43.151 10 HB2 MET 2 2HB MET 2 -0.975 18.883 -41.529 11 HB3 MET 2 3HB MET 2 -2.527 18.335 -40.885 12 HG2 MET 2 2HG MET 2 -1.997 16.007 -41.544 13 HG3 MET 2 3HG MET 2 -0.445 16.543 -42.182 14 HE1 MET 2 3HE MET 2 -2.587 15.726 -39.047 15 HE2 MET 2 1HE MET 2 -1.572 16.269 -37.694 16 HE3 MET 2 2HE MET 2 -2.359 17.464 -38.741 17 H ALA 3 H ALA 3 -1.869 20.392 -44.384 18 HA ALA 3 HA ALA 3 -2.397 22.535 -44.537 19 HB1 ALA 3 3HB ALA 3 -5.211 21.890 -43.617 20 HB2 ALA 3 1HB ALA 3 -4.657 23.351 -44.452 21 HB3 ALA 3 2HB ALA 3 -4.617 21.788 -45.290 22 H ASP 4 H ASP 4 -2.561 24.497 -43.403 23 HA ASP 4 HA ASP 4 -1.663 25.830 -41.841 24 HB2 ASP 4 2HB ASP 4 -3.806 25.232 -40.650 25 HB3 ASP 4 3HB ASP 4 -2.888 24.060 -39.705 26 H ARG 5 H ARG 5 -0.064 25.912 -39.871 27 HA ARG 5 HA ARG 5 2.156 24.074 -40.457 28 HB2 ARG 5 2HB ARG 5 3.452 25.339 -38.793 29 HB3 ARG 5 3HB ARG 5 2.769 26.303 -40.086 30 HG2 ARG 5 2HG ARG 5 2.438 27.689 -38.301 31 HG3 ARG 5 3HG ARG 5 0.878 26.912 -38.426 32 HD2 ARG 5 2HD ARG 5 1.928 25.264 -36.565 33 HD3 ARG 5 3HD ARG 5 3.066 26.579 -36.360 34 HE ARG 5 HE ARG 5 1.405 27.855 -35.344 35 HH11 ARG 5 2HH2 ARG 5 -0.184 25.115 -36.853 36 HH12 ARG 5 1HH2 ARG 5 -1.749 25.873 -36.735 37 HH21 ARG 5 1HH1 ARG 5 -0.684 28.518 -34.830 38 HH22 ARG 5 2HH1 ARG 5 -2.034 27.520 -35.299 39 H VAL 6 H VAL 6 2.765 22.310 -39.463 40 HA VAL 6 HA VAL 6 1.786 21.548 -36.782 41 HB VAL 6 HB VAL 6 1.448 19.625 -39.127 42 HG11 VAL 6 1HG1 VAL 6 0.479 19.560 -36.227 43 HG12 VAL 6 2HG1 VAL 6 0.049 18.372 -37.469 44 HG13 VAL 6 3HG1 VAL 6 1.715 18.503 -36.948 45 HG21 VAL 6 3HG2 VAL 6 -0.252 21.354 -39.461 46 HG22 VAL 6 1HG2 VAL 6 -1.002 19.879 -38.871 47 HG23 VAL 6 2HG2 VAL 6 -0.743 21.236 -37.754 48 H LEU 7 H LEU 7 3.231 20.058 -35.748 49 HA LEU 7 HA LEU 7 5.904 19.951 -36.860 50 HB2 LEU 7 2HB LEU 7 6.599 19.216 -34.748 51 HB3 LEU 7 3HB LEU 7 5.439 20.505 -34.495 52 HG LEU 7 HG LEU 7 4.803 17.537 -34.225 53 HD11 LEU 7 1HD1 LEU 7 6.480 18.272 -32.564 54 HD12 LEU 7 2HD1 LEU 7 5.400 19.591 -32.062 55 HD13 LEU 7 3HD1 LEU 7 4.931 17.896 -31.798 56 HD21 LEU 7 3HD2 LEU 7 2.868 18.337 -32.846 57 HD22 LEU 7 1HD2 LEU 7 3.207 19.987 -33.403 58 HD23 LEU 7 2HD2 LEU 7 2.726 18.705 -34.555 59 H ARG 8 H ARG 8 3.470 18.147 -37.759 60 HA ARG 8 HA ARG 8 4.992 15.660 -38.330 61 HB2 ARG 8 2HB ARG 8 2.088 15.726 -37.379 62 HB3 ARG 8 3HB ARG 8 3.004 14.289 -37.810 63 HG2 ARG 8 2HG ARG 8 3.527 16.073 -35.402 64 HG3 ARG 8 3HG ARG 8 2.683 14.536 -35.392 65 HD2 ARG 8 2HD ARG 8 4.721 13.337 -36.072 66 HD3 ARG 8 3HD ARG 8 5.593 14.857 -36.242 67 HE ARG 8 HE ARG 8 5.897 14.982 -33.962 68 HH11 ARG 8 1HH2 ARG 8 3.476 12.469 -34.486 69 HH12 ARG 8 2HH2 ARG 8 3.407 12.125 -32.764 70 HH21 ARG 8 2HH1 ARG 8 5.711 14.373 -31.782 71 HH22 ARG 8 1HH1 ARG 8 4.554 13.126 -31.372 72 H GLY 9 H GLY 9 3.694 14.371 -40.025 73 HA2 GLY 9 HA2 GLY 9 2.640 14.147 -42.054 74 HA3 GLY 9 HA3 GLY 9 1.570 15.441 -41.536 75 H SER 10 H SER 10 2.028 17.607 -42.166 76 HA SER 10 HA SER 10 3.277 18.105 -44.710 77 HB2 SER 10 2HB SER 10 2.580 20.000 -42.431 78 HB3 SER 10 3HB SER 10 2.998 20.483 -44.085 79 HG SER 10 HG SER 10 0.737 20.378 -43.666 80 H ARG 11 H ARG 11 4.473 18.221 -41.377 81 HA ARG 11 HA ARG 11 7.253 18.764 -42.358 82 HB2 ARG 11 2HB ARG 11 6.481 20.101 -40.413 83 HB3 ARG 11 3HB ARG 11 6.195 18.607 -39.509 84 HG2 ARG 11 2HG ARG 11 8.623 18.039 -39.711 85 HG3 ARG 11 3HG ARG 11 8.884 19.540 -40.620 86 HD2 ARG 11 2HD ARG 11 8.062 20.831 -38.616 87 HD3 ARG 11 3HD ARG 11 7.894 19.303 -37.749 88 HE ARG 11 HE ARG 11 10.197 19.124 -37.504 89 HH11 ARG 11 1HH2 ARG 11 9.593 21.870 -39.607 90 HH12 ARG 11 2HH2 ARG 11 11.238 22.429 -39.485 91 HH21 ARG 11 2HH1 ARG 11 12.267 19.899 -37.400 92 HH22 ARG 11 1HH1 ARG 11 12.705 21.339 -38.271 93 H LEU 12 H LEU 12 8.418 17.035 -42.866 94 HA LEU 12 HA LEU 12 7.484 14.338 -42.314 95 HB2 LEU 12 2HB LEU 12 9.891 15.491 -43.764 96 HB3 LEU 12 3HB LEU 12 9.747 13.773 -43.426 97 HG LEU 12 HG LEU 12 7.621 13.653 -44.680 98 HD11 LEU 12 1HD1 LEU 12 8.221 16.548 -45.437 99 HD12 LEU 12 2HD1 LEU 12 7.063 15.494 -46.277 100 HD13 LEU 12 3HD1 LEU 12 6.770 15.937 -44.601 101 HD21 LEU 12 3HD2 LEU 12 9.790 13.138 -45.739 102 HD22 LEU 12 1HD2 LEU 12 8.655 13.835 -46.904 103 HD23 LEU 12 2HD2 LEU 12 9.961 14.838 -46.232 104 H GLY 13 H GLY 13 8.334 12.768 -41.010 105 HA2 GLY 13 HA2 GLY 13 10.757 12.681 -39.644 106 HA3 GLY 13 HA3 GLY 13 9.668 13.561 -38.571 107 H ALA 14 H ALA 14 10.734 11.301 -37.670 108 HA ALA 14 HA ALA 14 8.429 9.443 -37.397 109 HB1 ALA 14 3HB ALA 14 9.927 7.508 -37.639 110 HB2 ALA 14 1HB ALA 14 9.955 8.501 -39.105 111 HB3 ALA 14 2HB ALA 14 11.304 8.587 -37.950 112 H VAL 15 H VAL 15 9.156 11.529 -35.668 113 HA VAL 15 HA VAL 15 10.972 10.663 -33.592 114 HB VAL 15 HB VAL 15 10.331 12.738 -32.434 115 HG11 VAL 15 1HG1 VAL 15 10.913 13.174 -35.391 116 HG12 VAL 15 2HG1 VAL 15 11.265 14.287 -34.055 117 HG13 VAL 15 3HG1 VAL 15 12.108 12.733 -34.151 118 HG21 VAL 15 3HG2 VAL 15 8.458 13.278 -34.785 119 HG22 VAL 15 1HG2 VAL 15 7.944 12.909 -33.125 120 HG23 VAL 15 2HG2 VAL 15 8.857 14.386 -33.459 121 H SER 16 H SER 16 10.690 10.331 -31.466 122 HA SER 16 HA SER 16 8.025 9.578 -30.393 123 HB2 SER 16 2HB SER 16 10.542 7.869 -30.317 124 HB3 SER 16 3HB SER 16 9.062 7.542 -29.413 125 HG SER 16 HG SER 16 7.956 7.295 -31.391 126 H TYR 17 H TYR 17 9.198 11.267 -27.533 127 HA TYR 17 HA TYR 17 7.066 11.494 -27.324 128 HB2 TYR 17 2HB TYR 17 6.823 11.159 -30.323 129 HB3 TYR 17 3HB TYR 17 5.499 11.493 -29.259 130 HD1 TYR 17 HD2 TYR 17 8.691 12.813 -30.564 131 HD2 TYR 17 HD1 TYR 17 5.098 13.605 -28.331 132 HE1 TYR 17 HE2 TYR 17 9.139 15.246 -30.744 133 HE2 TYR 17 HE1 TYR 17 5.537 16.070 -28.499 134 HH TYR 17 HH TYR 17 6.951 17.704 -29.284 135 H GLU 18 H GLU 18 5.388 10.610 -26.578 136 HA GLU 18 HA GLU 18 4.158 8.557 -28.224 137 HB2 GLU 18 2HB GLU 18 4.756 7.345 -26.129 138 HB3 GLU 18 3HB GLU 18 3.864 8.545 -25.181 139 HG2 GLU 18 2HG GLU 18 1.766 7.909 -26.343 140 HG3 GLU 18 3HG GLU 18 2.658 6.770 -27.354 141 H THR 19 H THR 19 2.564 9.626 -29.235 142 HA THR 19 HA THR 19 2.227 12.410 -28.400 143 HB THR 19 HB THR 19 1.272 11.083 -30.956 144 HG1 THR 19 HG1 THR 19 3.523 10.876 -30.655 145 HG21 THR 19 1HG2 THR 19 1.491 13.375 -31.880 146 HG22 THR 19 2HG2 THR 19 0.291 13.325 -30.586 147 HG23 THR 19 3HG2 THR 19 1.911 13.989 -30.266 148 H ASP 20 H ASP 20 0.426 13.395 -27.723 149 HA ASP 20 HA ASP 20 -2.226 12.210 -28.132 150 HB2 ASP 20 2HB ASP 20 -1.488 11.299 -25.948 151 HB3 ASP 20 3HB ASP 20 -1.148 12.932 -25.373 152 H ARG 21 H ARG 21 -3.939 13.799 -27.953 153 HA ARG 21 HA ARG 21 -3.136 16.658 -27.724 154 HB2 ARG 21 2HB ARG 21 -2.872 15.971 -30.102 155 HB3 ARG 21 3HB ARG 21 -4.570 15.485 -30.144 156 HG2 ARG 21 2HG ARG 21 -5.248 17.855 -29.699 157 HG3 ARG 21 3HG ARG 21 -3.540 18.306 -29.582 158 HD2 ARG 21 2HD ARG 21 -4.303 18.944 -31.744 159 HD3 ARG 21 3HD ARG 21 -3.230 17.550 -31.961 160 HE ARG 21 HE ARG 21 -5.873 16.550 -31.738 161 HH11 ARG 21 1HH2 ARG 21 -4.101 18.511 -34.036 162 HH12 ARG 21 2HH2 ARG 21 -5.129 18.045 -35.364 163 HH21 ARG 21 1HH1 ARG 21 -7.130 15.979 -33.477 164 HH22 ARG 21 2HH1 ARG 21 -6.794 16.645 -35.047 165 H ASN 22 H ASN 22 -4.601 17.976 -26.940 166 HA ASN 22 HA ASN 22 -7.472 17.397 -27.065 167 HB2 ASN 22 2HB ASN 22 -7.884 17.974 -24.742 168 HB3 ASN 22 3HB ASN 22 -6.835 16.572 -24.841 169 HD21 ASN 22 2HD2 ASN 22 -6.801 17.516 -22.455 170 HD22 ASN 22 1HD2 ASN 22 -5.405 18.538 -22.143 171 H HIS 23 H HIS 23 -8.737 19.425 -26.473 172 HA HIS 23 HA HIS 23 -9.347 21.496 -27.197 173 HB2 HIS 23 2HB HIS 23 -6.694 22.320 -25.987 174 HB3 HIS 23 3HB HIS 23 -8.114 23.338 -26.223 175 HD2 HIS 23 HD2 HIS 23 -6.479 21.363 -23.604 176 HE1 HIS 23 HE1 HIS 23 -10.575 21.355 -22.408 177 HE2 HIS 23 HE2 HIS 23 -8.191 20.859 -21.661 178 H ASP 24 H ASP 24 -8.474 20.103 -29.318 179 HA ASP 24 HA ASP 24 -6.331 21.083 -30.822 180 HB2 ASP 24 2HB ASP 24 -7.233 19.787 -32.639 181 HB3 ASP 24 3HB ASP 24 -7.402 18.905 -31.129 182 H LEU 25 H LEU 25 -6.471 21.912 -33.107 183 HA LEU 25 HA LEU 25 -7.274 24.666 -32.895 184 HB2 LEU 25 2HB LEU 25 -6.063 23.104 -35.208 185 HB3 LEU 25 3HB LEU 25 -6.231 24.855 -35.143 186 HG LEU 25 HG LEU 25 -4.520 23.170 -33.258 187 HD11 LEU 25 1HD1 LEU 25 -3.760 25.080 -35.502 188 HD12 LEU 25 2HD1 LEU 25 -2.631 24.230 -34.420 189 HD13 LEU 25 3HD1 LEU 25 -3.633 23.309 -35.553 190 HD21 LEU 25 3HD2 LEU 25 -3.584 25.365 -32.529 191 HD22 LEU 25 1HD2 LEU 25 -4.845 26.197 -33.469 192 HD23 LEU 25 2HD2 LEU 25 -5.278 25.176 -32.076 193 H ALA 26 H ALA 26 -9.370 25.008 -32.849 194 HA ALA 26 HA ALA 26 -10.923 24.771 -35.350 195 HB1 ALA 26 3HB ALA 26 -12.880 23.900 -34.070 196 HB2 ALA 26 1HB ALA 26 -11.506 22.780 -34.011 197 HB3 ALA 26 2HB ALA 26 -11.874 23.807 -32.609 198 HA PRO 27 HA PRO 27 -11.851 28.920 -34.307 199 HB2 PRO 27 2HB PRO 27 -14.168 29.478 -35.627 200 HB3 PRO 27 3HB PRO 27 -12.631 29.104 -36.452 201 HG2 PRO 27 2HG PRO 27 -14.910 27.189 -35.847 202 HG3 PRO 27 3HG PRO 27 -14.069 27.451 -37.409 203 HD2 PRO 27 2HD PRO 27 -13.367 25.426 -35.737 204 HD3 PRO 27 3HD PRO 27 -12.125 26.336 -36.655 205 H ARG 28 H ARG 28 -12.142 29.352 -32.290 206 HA ARG 28 HA ARG 28 -14.851 29.366 -31.081 207 HB2 ARG 28 2HB ARG 28 -14.011 28.381 -29.012 208 HB3 ARG 28 3HB ARG 28 -13.770 27.311 -30.395 209 HG2 ARG 28 2HG ARG 28 -11.389 27.853 -30.472 210 HG3 ARG 28 3HG ARG 28 -11.589 29.047 -29.179 211 HD2 ARG 28 2HD ARG 28 -12.209 27.337 -27.589 212 HD3 ARG 28 3HD ARG 28 -12.321 26.109 -28.842 213 HE ARG 28 HE ARG 28 -9.844 27.258 -27.663 214 HH11 ARG 28 1HH2 ARG 28 -11.134 25.026 -30.035 215 HH12 ARG 28 2HH2 ARG 28 -9.629 24.146 -30.159 216 HH21 ARG 28 1HH1 ARG 28 -7.980 26.055 -27.835 217 HH22 ARG 28 2HH1 ARG 28 -7.958 24.624 -28.833 218 H GLN 29 H GLN 29 -14.910 30.488 -29.003 219 HA GLN 29 HA GLN 29 -13.402 33.074 -28.995 220 HB2 GLN 29 2HB GLN 29 -16.395 32.758 -28.590 221 HB3 GLN 29 3HB GLN 29 -15.483 34.261 -28.617 222 HG2 GLN 29 2HG GLN 29 -15.792 34.473 -30.839 223 HG3 GLN 29 3HG GLN 29 -15.113 32.874 -31.153 224 HE21 GLN 29 1HE2 GLN 29 -16.791 31.101 -30.044 225 HE22 GLN 29 2HE2 GLN 29 -18.397 31.253 -30.757 226 H ILE 30 H ILE 30 -12.255 32.609 -27.139 227 HA ILE 30 HA ILE 30 -13.538 31.731 -24.675 228 HB ILE 30 HB ILE 30 -10.776 32.864 -25.236 229 HG12 ILE 30 2HG1 ILE 30 -9.959 30.633 -24.849 230 HG13 ILE 30 3HG1 ILE 30 -11.572 30.037 -24.458 231 HG21 ILE 30 1HG2 ILE 30 -11.989 31.674 -22.694 232 HG22 ILE 30 2HG2 ILE 30 -10.257 32.008 -22.920 233 HG23 ILE 30 3HG2 ILE 30 -11.403 33.341 -22.891 234 HD11 ILE 30 3HD1 ILE 30 -10.751 30.953 -27.232 235 HD12 ILE 30 1HD1 ILE 30 -10.639 29.283 -26.646 236 HD13 ILE 30 2HD1 ILE 30 -12.225 30.049 -26.763 237 H ALA 31 H ALA 31 -15.009 32.983 -23.859 238 HA ALA 31 HA ALA 31 -14.448 35.879 -23.352 239 HB1 ALA 31 3HB ALA 31 -16.993 34.228 -23.123 240 HB2 ALA 31 1HB ALA 31 -16.832 35.915 -22.578 241 HB3 ALA 31 2HB ALA 31 -16.629 35.520 -24.293 242 H ARG 32 H ARG 32 -14.607 36.634 -21.186 243 HA ARG 32 HA ARG 32 -14.204 34.565 -19.052 244 HB2 ARG 32 2HB ARG 32 -12.850 37.174 -19.549 245 HB3 ARG 32 3HB ARG 32 -13.430 36.946 -17.896 246 HG2 ARG 32 2HG ARG 32 -12.277 34.856 -17.661 247 HG3 ARG 32 3HG ARG 32 -11.724 34.916 -19.351 248 HD2 ARG 32 2HD ARG 32 -10.356 36.848 -18.888 249 HD3 ARG 32 3HD ARG 32 -11.050 37.027 -17.267 250 HE ARG 32 HE ARG 32 -9.376 34.679 -18.126 251 HH11 ARG 32 2HH2 ARG 32 -10.106 37.003 -15.514 252 HH12 ARG 32 1HH2 ARG 32 -8.863 36.285 -14.527 253 HH21 ARG 32 2HH1 ARG 32 -8.068 33.774 -16.738 254 HH22 ARG 32 1HH1 ARG 32 -7.741 34.507 -15.175 255 H TYR 33 H TYR 33 -15.291 34.826 -17.101 256 HA TYR 33 HA TYR 33 -17.373 36.918 -16.928 257 HB2 TYR 33 2HB TYR 33 -17.957 33.978 -16.514 258 HB3 TYR 33 3HB TYR 33 -19.021 35.298 -16.118 259 HD1 TYR 33 HD1 TYR 33 -17.341 33.579 -18.975 260 HD2 TYR 33 HD2 TYR 33 -20.452 36.258 -17.707 261 HE1 TYR 33 HE1 TYR 33 -18.399 33.432 -21.229 262 HE2 TYR 33 HE2 TYR 33 -21.499 36.124 -19.965 263 HH TYR 33 HH TYR 33 -21.462 35.163 -21.962 264 H ARG 34 H ARG 34 -17.634 37.725 -14.945 265 HA ARG 34 HA ARG 34 -15.943 36.699 -12.715 266 HB2 ARG 34 2HB ARG 34 -15.542 39.022 -13.502 267 HB3 ARG 34 3HB ARG 34 -17.230 39.419 -13.159 268 HG2 ARG 34 2HG ARG 34 -16.780 38.824 -10.734 269 HG3 ARG 34 3HG ARG 34 -15.099 38.531 -11.158 270 HD2 ARG 34 2HD ARG 34 -15.355 40.752 -10.170 271 HD3 ARG 34 3HD ARG 34 -14.842 40.864 -11.854 272 HE ARG 34 HE ARG 34 -16.697 42.119 -12.278 273 HH11 ARG 34 1HH2 ARG 34 -17.706 40.098 -9.558 274 HH12 ARG 34 2HH2 ARG 34 -19.155 41.027 -9.338 275 HH21 ARG 34 1HH1 ARG 34 -18.595 43.168 -11.949 276 HH22 ARG 34 2HH1 ARG 34 -19.660 42.675 -10.668 277 H THR 35 H THR 35 -16.831 35.807 -10.999 278 HA THR 35 HA THR 35 -19.734 35.530 -10.716 279 HB THR 35 HB THR 35 -19.254 34.104 -8.804 280 HG1 THR 35 HG1 THR 35 -16.552 34.552 -9.343 281 HG21 THR 35 1HG2 THR 35 -17.947 32.359 -9.872 282 HG22 THR 35 2HG2 THR 35 -19.188 33.039 -10.950 283 HG23 THR 35 3HG2 THR 35 -17.480 33.465 -11.178 284 H ASP 36 H ASP 36 -20.489 35.633 -8.258 285 HA ASP 36 HA ASP 36 -20.403 38.417 -7.612 286 HB2 ASP 36 2HB ASP 36 -22.421 36.920 -7.429 287 HB3 ASP 36 3HB ASP 36 -21.655 36.104 -6.065 288 H ASN 37 H ASN 37 -18.363 35.804 -6.537 289 HA ASN 37 HA ASN 37 -17.512 37.393 -4.165 290 HB2 ASN 37 2HB ASN 37 -16.124 34.920 -5.032 291 HB3 ASN 37 3HB ASN 37 -16.224 35.643 -3.464 292 HD21 ASN 37 1HD2 ASN 37 -16.773 32.934 -4.504 293 HD22 ASN 37 2HD2 ASN 37 -18.371 32.551 -3.822 294 H GLY 38 H GLY 38 -17.003 37.783 -7.376 295 HA2 GLY 38 HA2 GLY 38 -15.375 38.986 -8.549 296 HA3 GLY 38 HA3 GLY 38 -14.264 38.888 -7.181 297 H GLU 39 H GLU 39 -15.511 35.790 -7.828 298 HA GLU 39 HA GLU 39 -12.870 34.907 -8.716 299 HB2 GLU 39 2HB GLU 39 -15.288 33.106 -8.810 300 HB3 GLU 39 3HB GLU 39 -13.618 32.725 -8.499 301 HG2 GLU 39 2HG GLU 39 -14.115 34.319 -6.344 302 HG3 GLU 39 3HG GLU 39 -15.771 33.814 -6.745 303 H GLU 40 H GLU 40 -12.220 35.109 -10.796 304 HA GLU 40 HA GLU 40 -14.245 35.226 -12.974 305 HB2 GLU 40 2HB GLU 40 -11.321 35.983 -12.807 306 HB3 GLU 40 3HB GLU 40 -12.171 35.803 -14.349 307 HG2 GLU 40 2HG GLU 40 -13.836 37.467 -13.678 308 HG3 GLU 40 3HG GLU 40 -13.037 37.673 -12.121 309 H PHE 41 H PHE 41 -14.567 33.752 -14.424 310 HA PHE 41 HA PHE 41 -12.639 31.497 -14.835 311 HB2 PHE 41 2HB PHE 41 -15.666 31.385 -14.751 312 HB3 PHE 41 3HB PHE 41 -14.645 30.077 -15.276 313 HD1 PHE 41 HD1 PHE 41 -15.564 32.124 -12.235 314 HD2 PHE 41 HD2 PHE 41 -13.530 28.618 -13.757 315 HE1 PHE 41 HE1 PHE 41 -15.173 31.328 -9.956 316 HE2 PHE 41 HE2 PHE 41 -13.133 27.846 -11.442 317 HZ PHE 41 HZ PHE 41 -13.922 29.217 -9.526 318 H GLU 42 H GLU 42 -12.857 30.447 -16.913 319 HA GLU 42 HA GLU 42 -13.444 32.414 -19.086 320 HB2 GLU 42 2HB GLU 42 -11.302 30.273 -19.087 321 HB3 GLU 42 3HB GLU 42 -11.642 31.463 -20.339 322 HG2 GLU 42 2HG GLU 42 -10.410 33.038 -19.407 323 HG3 GLU 42 3HG GLU 42 -11.180 32.864 -17.843 324 H VAL 43 H VAL 43 -14.857 31.834 -20.569 325 HA VAL 43 HA VAL 43 -15.739 28.975 -20.745 326 HB VAL 43 HB VAL 43 -17.437 31.420 -21.251 327 HG11 VAL 43 1HG1 VAL 43 -19.267 29.834 -21.314 328 HG12 VAL 43 2HG1 VAL 43 -18.085 29.380 -22.532 329 HG13 VAL 43 3HG1 VAL 43 -18.162 28.473 -21.006 330 HG21 VAL 43 3HG2 VAL 43 -18.542 30.969 -19.188 331 HG22 VAL 43 1HG2 VAL 43 -17.532 29.536 -18.866 332 HG23 VAL 43 2HG2 VAL 43 -16.847 31.176 -18.817 333 HA PRO 44 HA PRO 44 -14.391 29.761 -25.036 334 HB2 PRO 44 2HB PRO 44 -13.920 27.171 -25.765 335 HB3 PRO 44 3HB PRO 44 -12.768 28.142 -24.810 336 HG2 PRO 44 2HG PRO 44 -14.723 26.069 -23.823 337 HG3 PRO 44 3HG PRO 44 -13.025 26.332 -23.324 338 HD2 PRO 44 2HD PRO 44 -15.233 27.262 -21.935 339 HD3 PRO 44 3HD PRO 44 -13.636 28.070 -21.868 340 H PHE 45 H PHE 45 -16.053 30.302 -26.295 341 HA PHE 45 HA PHE 45 -18.406 28.521 -26.732 342 HB2 PHE 45 2HB PHE 45 -17.787 31.427 -27.339 343 HB3 PHE 45 3HB PHE 45 -19.139 30.609 -28.078 344 HD1 PHE 45 HD1 PHE 45 -17.680 31.712 -24.821 345 HD2 PHE 45 HD2 PHE 45 -21.172 30.178 -26.846 346 HE1 PHE 45 HE1 PHE 45 -19.057 32.165 -22.818 347 HE2 PHE 45 HE2 PHE 45 -22.543 30.647 -24.819 348 HZ PHE 45 HZ PHE 45 -21.457 31.610 -22.780 349 H ALA 46 H ALA 46 -18.933 27.788 -28.813 350 HA ALA 46 HA ALA 46 -16.683 27.553 -30.732 351 HB1 ALA 46 3HB ALA 46 -19.492 26.354 -30.748 352 HB2 ALA 46 1HB ALA 46 -18.191 25.987 -31.902 353 HB3 ALA 46 2HB ALA 46 -18.011 25.536 -30.195 354 H ASP 47 H ASP 47 -16.915 28.283 -32.951 355 HA ASP 47 HA ASP 47 -17.961 30.878 -33.205 356 HB2 ASP 47 2HB ASP 47 -16.097 29.914 -34.500 357 HB3 ASP 47 3HB ASP 47 -17.251 28.957 -35.445 358 H ASP 48 H ASP 48 -19.701 27.936 -33.535 359 HA ASP 48 HA ASP 48 -21.912 28.935 -35.177 360 HB2 ASP 48 2HB ASP 48 -21.262 26.542 -34.990 361 HB3 ASP 48 3HB ASP 48 -21.697 26.572 -33.282 362 H ALA 49 H ALA 49 -20.929 29.430 -31.941 363 HA ALA 49 HA ALA 49 -23.612 30.399 -31.048 364 HB1 ALA 49 3HB ALA 49 -21.241 29.441 -29.397 365 HB2 ALA 49 1HB ALA 49 -22.808 29.996 -28.771 366 HB3 ALA 49 2HB ALA 49 -22.719 28.509 -29.729 367 H GLU 50 H GLU 50 -23.412 32.209 -29.426 368 HA GLU 50 HA GLU 50 -21.127 34.037 -29.787 369 HB2 GLU 50 2HB GLU 50 -22.481 35.937 -30.278 370 HB3 GLU 50 3HB GLU 50 -22.872 34.672 -31.444 371 HG2 GLU 50 2HG GLU 50 -24.890 34.097 -29.977 372 HG3 GLU 50 3HG GLU 50 -24.537 35.560 -29.053 373 H ILE 51 H ILE 51 -20.785 35.406 -28.065 374 HA ILE 51 HA ILE 51 -21.211 34.400 -25.510 375 HB ILE 51 HB ILE 51 -20.269 37.210 -26.092 376 HG12 ILE 51 2HG1 ILE 51 -19.065 35.807 -27.671 377 HG13 ILE 51 3HG1 ILE 51 -17.995 36.392 -26.400 378 HG21 ILE 51 1HG2 ILE 51 -20.563 36.571 -23.688 379 HG22 ILE 51 2HG2 ILE 51 -19.458 35.217 -23.942 380 HG23 ILE 51 3HG2 ILE 51 -18.874 36.873 -24.109 381 HD11 ILE 51 3HD1 ILE 51 -19.147 33.589 -26.690 382 HD12 ILE 51 1HD1 ILE 51 -17.472 34.095 -26.969 383 HD13 ILE 51 2HD1 ILE 51 -18.125 34.117 -25.332 384 HA PRO 52 HA PRO 52 -25.015 36.744 -24.510 385 HB2 PRO 52 2HB PRO 52 -25.702 35.242 -22.348 386 HB3 PRO 52 3HB PRO 52 -26.024 34.712 -24.029 387 HG2 PRO 52 2HG PRO 52 -23.777 33.891 -22.182 388 HG3 PRO 52 3HG PRO 52 -24.768 32.865 -23.278 389 HD2 PRO 52 2HD PRO 52 -22.232 33.869 -23.880 390 HD3 PRO 52 3HD PRO 52 -23.416 33.423 -25.106 391 H GLY 53 H GLY 53 -25.303 38.279 -22.919 392 HA2 GLY 53 HA2 GLY 53 -23.232 39.625 -21.723 393 HA3 GLY 53 HA3 GLY 53 -24.905 39.711 -21.164 394 H THR 54 H THR 54 -24.922 36.862 -20.224 395 HA THR 54 HA THR 54 -22.748 36.761 -18.270 396 HB THR 54 HB THR 54 -24.323 36.161 -16.413 397 HG1 THR 54 HG1 THR 54 -26.382 37.008 -18.189 398 HG21 THR 54 1HG2 THR 54 -25.352 38.275 -15.889 399 HG22 THR 54 2HG2 THR 54 -23.779 38.567 -16.628 400 HG23 THR 54 3HG2 THR 54 -25.242 38.815 -17.581 401 H TRP 55 H TRP 55 -22.537 34.636 -17.190 402 HA TRP 55 HA TRP 55 -23.882 32.309 -18.360 403 HB2 TRP 55 2HB TRP 55 -22.097 32.994 -20.029 404 HB3 TRP 55 3HB TRP 55 -20.900 32.662 -18.785 405 HD1 TRP 55 HD1 TRP 55 -20.331 30.168 -18.299 406 HE1 TRP 55 HE1 TRP 55 -20.664 28.007 -19.607 407 HE3 TRP 55 HE3 TRP 55 -23.988 31.745 -21.467 408 HZ2 TRP 55 HZ2 TRP 55 -22.431 27.019 -21.694 409 HZ3 TRP 55 HZ3 TRP 55 -25.014 30.170 -23.110 410 HH2 TRP 55 HH2 TRP 55 -24.234 27.813 -23.235 411 H LEU 56 H LEU 56 -23.513 30.375 -17.144 412 HA LEU 56 HA LEU 56 -22.845 30.824 -14.376 413 HB2 LEU 56 2HB LEU 56 -24.417 29.013 -15.794 414 HB3 LEU 56 3HB LEU 56 -23.060 28.022 -15.256 415 HG LEU 56 HG LEU 56 -24.747 29.766 -13.418 416 HD11 LEU 56 1HD1 LEU 56 -25.822 27.665 -12.708 417 HD12 LEU 56 2HD1 LEU 56 -26.105 27.973 -14.428 418 HD13 LEU 56 3HD1 LEU 56 -24.897 26.765 -13.933 419 HD21 LEU 56 3HD2 LEU 56 -23.775 28.348 -11.626 420 HD22 LEU 56 1HD2 LEU 56 -22.754 27.528 -12.833 421 HD23 LEU 56 2HD2 LEU 56 -22.525 29.251 -12.484 422 H CYS 57 H CYS 57 -20.979 30.590 -13.342 423 HA CYS 57 HA CYS 57 -18.577 29.661 -14.817 424 HB2 CYS 57 2HB CYS 57 -19.008 31.258 -12.269 425 HB3 CYS 57 3HB CYS 57 -17.420 30.721 -12.825 426 HG CYS 57 HG CYS 57 -19.624 32.370 -14.657 427 H ARG 58 H ARG 58 -16.933 28.395 -13.694 428 HA ARG 58 HA ARG 58 -18.076 25.938 -12.734 429 HB2 ARG 58 2HB ARG 58 -15.129 26.689 -12.795 430 HB3 ARG 58 3HB ARG 58 -15.819 25.067 -12.717 431 HG2 ARG 58 2HG ARG 58 -16.915 25.485 -14.957 432 HG3 ARG 58 3HG ARG 58 -16.040 27.026 -15.039 433 HD2 ARG 58 2HD ARG 58 -13.875 25.745 -14.839 434 HD3 ARG 58 3HD ARG 58 -14.806 24.249 -14.899 435 HE ARG 58 HE ARG 58 -15.176 24.533 -17.182 436 HH11 ARG 58 2HH1 ARG 58 -13.695 27.499 -16.007 437 HH12 ARG 58 1HH1 ARG 58 -13.716 28.201 -17.626 438 HH21 ARG 58 1HH2 ARG 58 -15.029 25.545 -19.206 439 HH22 ARG 58 2HH2 ARG 58 -14.363 27.170 -19.276 440 H ASN 59 H ASN 59 -17.189 28.684 -10.940 441 HA ASN 59 HA ASN 59 -16.785 27.434 -8.383 442 HB2 ASN 59 2HB ASN 59 -16.153 29.714 -8.831 443 HB3 ASN 59 3HB ASN 59 -17.817 30.160 -9.229 444 HD21 ASN 59 1HD2 ASN 59 -17.749 31.867 -7.700 445 HD22 ASN 59 2HD2 ASN 59 -17.685 31.538 -5.979 446 H GLY 60 H GLY 60 -19.575 27.768 -10.394 447 HA2 GLY 60 HA2 GLY 60 -21.697 26.800 -10.084 448 HA3 GLY 60 HA3 GLY 60 -21.449 26.728 -8.337 449 H MET 61 H MET 61 -20.585 29.759 -9.762 450 HA MET 61 HA MET 61 -23.150 31.010 -8.912 451 HB2 MET 61 2HB MET 61 -21.118 31.483 -7.508 452 HB3 MET 61 3HB MET 61 -20.357 32.220 -8.895 453 HG2 MET 61 2HG MET 61 -21.346 33.895 -7.400 454 HG3 MET 61 3HG MET 61 -22.052 33.950 -9.010 455 HE1 MET 61 3HE MET 61 -22.563 33.251 -5.223 456 HE2 MET 61 1HE MET 61 -24.182 32.524 -5.147 457 HE3 MET 61 2HE MET 61 -22.832 31.602 -5.839 458 H GLU 62 H GLU 62 -24.036 32.624 -10.191 459 HA GLU 62 HA GLU 62 -23.603 32.476 -13.052 460 HB2 GLU 62 2HB GLU 62 -25.287 34.337 -11.336 461 HB3 GLU 62 3HB GLU 62 -25.263 34.342 -13.107 462 HG2 GLU 62 2HG GLU 62 -26.001 31.977 -13.139 463 HG3 GLU 62 3HG GLU 62 -26.050 31.957 -11.375 464 H GLY 63 H GLY 63 -21.879 33.301 -14.014 465 HA2 GLY 63 HA2 GLY 63 -20.413 35.585 -12.901 466 HA3 GLY 63 HA3 GLY 63 -19.890 34.560 -14.213 467 H THR 64 H THR 64 -20.088 37.551 -14.000 468 HA THR 64 HA THR 64 -21.780 38.024 -16.412 469 HB THR 64 HB THR 64 -20.670 40.048 -14.435 470 HG1 THR 64 HG1 THR 64 -22.799 40.185 -13.745 471 HG21 THR 64 1HG2 THR 64 -22.551 40.377 -16.827 472 HG22 THR 64 2HG2 THR 64 -22.375 41.587 -15.534 473 HG23 THR 64 3HG2 THR 64 -20.992 41.178 -16.552 474 H LEU 65 H LEU 65 -21.009 38.888 -18.247 475 HA LEU 65 HA LEU 65 -18.463 38.073 -19.041 476 HB2 LEU 65 2HB LEU 65 -20.565 38.289 -20.342 477 HB3 LEU 65 3HB LEU 65 -20.395 40.028 -20.327 478 HG LEU 65 HG LEU 65 -18.798 37.922 -21.826 479 HD11 LEU 65 1HD1 LEU 65 -20.977 38.724 -22.725 480 HD12 LEU 65 2HD1 LEU 65 -20.365 40.389 -22.713 481 HD13 LEU 65 3HD1 LEU 65 -19.630 39.177 -23.781 482 HD21 LEU 65 3HD2 LEU 65 -17.040 39.440 -21.288 483 HD22 LEU 65 1HD2 LEU 65 -17.538 39.810 -22.926 484 HD23 LEU 65 2HD2 LEU 65 -18.073 40.868 -21.602 485 H ILE 66 H ILE 66 -16.515 38.911 -18.765 486 HA ILE 66 HA ILE 66 -16.069 41.830 -19.035 487 HB ILE 66 HB ILE 66 -14.206 41.795 -17.530 488 HG12 ILE 66 2HG1 ILE 66 -13.499 39.428 -17.658 489 HG13 ILE 66 3HG1 ILE 66 -13.601 40.045 -16.029 490 HG21 ILE 66 1HG2 ILE 66 -16.763 40.867 -16.165 491 HG22 ILE 66 2HG2 ILE 66 -15.402 41.679 -15.374 492 HG23 ILE 66 3HG2 ILE 66 -16.328 42.519 -16.633 493 HD11 ILE 66 3HD1 ILE 66 -15.763 38.932 -15.686 494 HD12 ILE 66 1HD1 ILE 66 -15.589 38.203 -17.272 495 HD13 ILE 66 2HD1 ILE 66 -14.418 37.824 -16.005 496 H GLU 67 H GLU 67 -14.116 42.405 -20.119 497 HA GLU 67 HA GLU 67 -13.306 40.426 -22.133 498 HB2 GLU 67 2HB GLU 67 -12.502 43.323 -21.698 499 HB3 GLU 67 3HB GLU 67 -11.943 42.304 -23.034 500 HG2 GLU 67 2HG GLU 67 -14.271 41.979 -23.794 501 HG3 GLU 67 3HG GLU 67 -14.867 42.978 -22.467 502 H GLY 68 H GLY 68 -11.708 39.025 -21.871 503 HA2 GLY 68 HA2 GLY 68 -9.826 39.099 -19.670 504 HA3 GLY 68 HA3 GLY 68 -9.923 37.892 -20.956 505 H ASP 69 H ASP 69 -9.212 41.401 -20.897 506 HA ASP 69 HA ASP 69 -7.801 42.683 -22.102 507 HB2 ASP 69 2HB ASP 69 -6.300 41.790 -20.330 508 HB3 ASP 69 3HB ASP 69 -5.723 40.569 -21.464 509 H LEU 70 H LEU 70 -9.415 41.143 -23.671 510 HA LEU 70 HA LEU 70 -8.068 39.683 -25.731 511 HB2 LEU 70 2HB LEU 70 -10.881 40.789 -25.469 512 HB3 LEU 70 3HB LEU 70 -10.372 39.766 -26.808 513 HG LEU 70 HG LEU 70 -10.131 38.846 -23.916 514 HD11 LEU 70 1HD1 LEU 70 -12.435 38.327 -25.829 515 HD12 LEU 70 2HD1 LEU 70 -12.230 37.651 -24.204 516 HD13 LEU 70 3HD1 LEU 70 -12.501 39.392 -24.409 517 HD21 LEU 70 3HD2 LEU 70 -10.238 37.368 -26.584 518 HD22 LEU 70 1HD2 LEU 70 -8.799 37.572 -25.559 519 HD23 LEU 70 2HD2 LEU 70 -10.161 36.604 -24.981 520 HA PRO 71 HA PRO 71 -7.004 43.348 -28.091 521 HB2 PRO 71 2HB PRO 71 -5.592 42.235 -30.145 522 HB3 PRO 71 3HB PRO 71 -4.987 42.318 -28.463 523 HG2 PRO 71 2HG PRO 71 -6.303 39.968 -29.854 524 HG3 PRO 71 3HG PRO 71 -4.828 39.978 -28.844 525 HD2 PRO 71 2HD PRO 71 -7.300 39.284 -27.869 526 HD3 PRO 71 3HD PRO 71 -6.065 40.099 -26.864 527 H GLU 72 H GLU 72 -8.402 40.603 -29.962 528 HA GLU 72 HA GLU 72 -10.144 42.497 -31.441 529 HB2 GLU 72 2HB GLU 72 -9.512 41.432 -33.544 530 HB3 GLU 72 3HB GLU 72 -8.167 42.221 -32.721 531 HG2 GLU 72 2HG GLU 72 -7.255 40.073 -31.992 532 HG3 GLU 72 3HG GLU 72 -8.591 39.208 -32.737 533 HA PRO 73 HA PRO 73 -12.609 38.699 -30.280 534 HB2 PRO 73 2HB PRO 73 -14.188 39.565 -28.286 535 HB3 PRO 73 3HB PRO 73 -12.472 39.145 -28.009 536 HG2 PRO 73 2HG PRO 73 -13.622 41.921 -28.526 537 HG3 PRO 73 3HG PRO 73 -12.579 41.399 -27.169 538 HD2 PRO 73 2HD PRO 73 -11.549 42.551 -29.420 539 HD3 PRO 73 3HD PRO 73 -10.683 41.274 -28.526 540 H LYS 74 H LYS 74 -12.889 39.818 -32.487 541 HA LYS 74 HA LYS 74 -15.733 40.680 -32.876 542 HB2 LYS 74 2HB LYS 74 -14.087 42.582 -33.054 543 HB3 LYS 74 3HB LYS 74 -13.287 41.722 -34.358 544 HG2 LYS 74 2HG LYS 74 -14.648 43.379 -35.374 545 HG3 LYS 74 3HG LYS 74 -15.416 41.838 -35.702 546 HD2 LYS 74 2HD LYS 74 -17.144 43.386 -35.171 547 HD3 LYS 74 3HD LYS 74 -17.018 42.321 -33.768 548 HE2 LYS 74 2HE LYS 74 -15.628 44.048 -32.608 549 HE3 LYS 74 3HE LYS 74 -15.743 45.089 -34.032 550 HZ1 LYS 74 HZ1 LYS 74 -18.155 45.180 -33.689 551 HZ2 LYS 74 HZ2 LYS 74 -18.051 44.212 -32.374 552 HZ3 LYS 74 HZ3 LYS 74 -17.384 45.700 -32.350 553 H LYS 75 H LYS 75 -16.813 39.883 -34.581 554 HA LYS 75 HA LYS 75 -15.573 38.120 -36.598 555 HB2 LYS 75 2HB LYS 75 -17.201 36.304 -36.157 556 HB3 LYS 75 3HB LYS 75 -16.057 36.548 -34.839 557 HG2 LYS 75 2HG LYS 75 -17.783 37.816 -33.564 558 HG3 LYS 75 3HG LYS 75 -18.958 37.531 -34.854 559 HD2 LYS 75 2HD LYS 75 -17.497 35.244 -33.497 560 HD3 LYS 75 3HD LYS 75 -18.908 35.987 -32.740 561 HE2 LYS 75 2HE LYS 75 -20.373 35.345 -34.485 562 HE3 LYS 75 3HE LYS 75 -19.045 34.943 -35.588 563 HZ1 LYS 75 HZ1 LYS 75 -19.356 33.490 -33.028 564 HZ2 LYS 75 HZ2 LYS 75 -20.124 32.973 -34.398 565 HZ3 LYS 75 HZ3 LYS 75 -18.504 33.067 -34.363 566 H VAL 76 H VAL 76 -16.884 37.773 -38.431 567 HA VAL 76 HA VAL 76 -19.245 39.568 -38.765 568 HB VAL 76 HB VAL 76 -18.438 40.188 -41.010 569 HG11 VAL 76 1HG1 VAL 76 -18.211 41.728 -39.092 570 HG12 VAL 76 2HG1 VAL 76 -16.593 41.080 -38.757 571 HG13 VAL 76 3HG1 VAL 76 -16.915 41.945 -40.275 572 HG21 VAL 76 3HG2 VAL 76 -16.054 40.069 -41.570 573 HG22 VAL 76 1HG2 VAL 76 -15.716 39.142 -40.097 574 HG23 VAL 76 2HG2 VAL 76 -16.708 38.439 -41.394 575 H LYS 77 H LYS 77 -20.954 37.180 -40.353 576 HA LYS 77 HA LYS 77 -21.308 39.817 -39.308 577 HB2 LYS 77 2HB LYS 77 -23.119 37.375 -39.462 578 HB3 LYS 77 3HB LYS 77 -23.654 38.967 -38.938 579 HG2 LYS 77 2HG LYS 77 -22.902 39.924 -41.135 580 HG3 LYS 77 3HG LYS 77 -22.511 38.284 -41.677 581 HD2 LYS 77 2HD LYS 77 -24.876 37.604 -41.404 582 HD3 LYS 77 3HD LYS 77 -25.267 39.197 -40.748 583 HE2 LYS 77 2HE LYS 77 -25.992 39.184 -43.016 584 HE3 LYS 77 3HE LYS 77 -24.601 40.260 -42.892 585 HZ1 LYS 77 HZ1 LYS 77 -23.225 38.475 -43.831 586 HZ2 LYS 77 HZ2 LYS 77 -24.509 37.463 -43.908 587 HZ3 LYS 77 HZ3 LYS 77 -24.462 38.799 -44.838 588 HA PRO 78 HA PRO 78 -23.421 40.513 -37.458 589 HB2 PRO 78 2HB PRO 78 -22.174 41.995 -35.167 590 HB3 PRO 78 3HB PRO 78 -23.907 41.711 -35.522 591 HG2 PRO 78 2HG PRO 78 -22.695 40.292 -33.585 592 HG3 PRO 78 3HG PRO 78 -23.792 39.465 -34.745 593 HD2 PRO 78 2HD PRO 78 -20.764 39.654 -34.851 594 HD3 PRO 78 3HD PRO 78 -21.802 38.203 -34.971 595 HA PRO 79 HA PRO 79 -23.989 43.351 -36.976 596 HB2 PRO 79 2HB PRO 79 -24.800 45.003 -38.983 597 HB3 PRO 79 3HB PRO 79 -23.547 45.447 -37.786 598 HG2 PRO 79 2HG PRO 79 -23.123 44.310 -40.572 599 HG3 PRO 79 3HG PRO 79 -22.377 45.776 -39.853 600 HD2 PRO 79 2HD PRO 79 -21.079 43.401 -39.839 601 HD3 PRO 79 3HD PRO 79 -21.003 44.482 -38.419 602 H ARG 80 H ARG 80 -26.237 43.193 -37.587 603 HA ARG 80 HA ARG 80 -26.956 41.247 -39.734 604 HB2 ARG 80 2HB ARG 80 -27.702 41.078 -36.783 605 HB3 ARG 80 3HB ARG 80 -28.534 40.190 -38.063 606 HG2 ARG 80 2HG ARG 80 -26.464 39.038 -38.689 607 HG3 ARG 80 3HG ARG 80 -25.560 39.909 -37.446 608 HD2 ARG 80 2HD ARG 80 -27.915 38.079 -36.854 609 HD3 ARG 80 3HD ARG 80 -26.222 37.565 -36.868 610 HE ARG 80 HE ARG 80 -26.868 39.856 -35.121 611 HH11 ARG 80 1HH2 ARG 80 -26.418 36.377 -35.205 612 HH12 ARG 80 2HH2 ARG 80 -26.074 36.306 -33.483 613 HH21 ARG 80 1HH1 ARG 80 -26.393 39.655 -32.942 614 HH22 ARG 80 2HH1 ARG 80 -25.979 38.081 -32.294 Start of MODEL 25 1 H1 SER 1 1H SER 1 -6.709 14.464 -33.883 2 H2 SER 1 2H SER 1 -8.186 14.753 -34.541 3 H3 SER 1 3H SER 1 -7.776 13.237 -34.064 4 HA SER 1 HA SER 1 -9.304 14.232 -32.515 5 HB2 SER 1 2HB SER 1 -6.522 13.750 -31.385 6 HB3 SER 1 3HB SER 1 -8.060 13.663 -30.496 7 HG SER 1 HG SER 1 -7.412 11.594 -31.205 8 H MET 2 H MET 2 -8.868 17.588 -31.354 9 HA MET 2 HA MET 2 -10.648 15.260 -31.475 10 HB2 MET 2 2HB MET 2 -12.346 16.794 -30.659 11 HB3 MET 2 3HB MET 2 -10.888 16.795 -29.681 12 HG2 MET 2 2HG MET 2 -11.605 19.021 -29.780 13 HG3 MET 2 3HG MET 2 -10.183 18.939 -30.805 14 HE1 MET 2 3HE MET 2 -10.730 21.325 -31.788 15 HE2 MET 2 1HE MET 2 -12.320 21.786 -32.431 16 HE3 MET 2 2HE MET 2 -12.138 21.412 -30.704 17 H ALA 3 H ALA 3 -9.731 17.773 -33.689 18 HA ALA 3 HA ALA 3 -11.917 17.341 -35.588 19 HB1 ALA 3 3HB ALA 3 -10.558 18.826 -37.005 20 HB2 ALA 3 1HB ALA 3 -10.702 19.497 -35.375 21 HB3 ALA 3 2HB ALA 3 -9.194 18.696 -35.873 22 H ASP 4 H ASP 4 -11.033 16.800 -37.968 23 HA ASP 4 HA ASP 4 -10.243 14.047 -38.008 24 HB2 ASP 4 2HB ASP 4 -11.671 15.191 -39.687 25 HB3 ASP 4 3HB ASP 4 -10.276 16.122 -40.232 26 H ARG 5 H ARG 5 -8.343 16.969 -38.106 27 HA ARG 5 HA ARG 5 -5.838 15.805 -39.065 28 HB2 ARG 5 2HB ARG 5 -6.604 18.424 -37.718 29 HB3 ARG 5 3HB ARG 5 -4.919 17.984 -38.009 30 HG2 ARG 5 2HG ARG 5 -5.381 17.707 -40.424 31 HG3 ARG 5 3HG ARG 5 -7.058 18.229 -40.169 32 HD2 ARG 5 2HD ARG 5 -6.344 20.415 -39.417 33 HD3 ARG 5 3HD ARG 5 -4.648 19.920 -39.364 34 HE ARG 5 HE ARG 5 -6.163 20.764 -41.708 35 HH11 ARG 5 1HH1 ARG 5 -3.285 18.938 -40.695 36 HH12 ARG 5 2HH1 ARG 5 -2.580 19.130 -42.290 37 HH21 ARG 5 2HH2 ARG 5 -5.074 20.947 -43.672 38 HH22 ARG 5 1HH2 ARG 5 -3.502 20.206 -43.846 39 H VAL 6 H VAL 6 -3.998 15.494 -37.976 40 HA VAL 6 HA VAL 6 -2.688 14.374 -36.615 41 HB VAL 6 HB VAL 6 -2.335 16.640 -36.018 42 HG11 VAL 6 1HG1 VAL 6 -4.183 16.247 -33.640 43 HG12 VAL 6 2HG1 VAL 6 -3.095 17.620 -33.903 44 HG13 VAL 6 3HG1 VAL 6 -4.432 17.349 -35.014 45 HG21 VAL 6 3HG2 VAL 6 -0.960 14.824 -35.026 46 HG22 VAL 6 1HG2 VAL 6 -1.034 16.282 -34.033 47 HG23 VAL 6 2HG2 VAL 6 -1.992 14.871 -33.574 48 H LEU 7 H LEU 7 -2.532 12.479 -35.733 49 HA LEU 7 HA LEU 7 -4.858 11.273 -34.474 50 HB2 LEU 7 2HB LEU 7 -2.115 10.111 -35.066 51 HB3 LEU 7 3HB LEU 7 -3.548 9.194 -34.614 52 HG LEU 7 HG LEU 7 -3.202 10.780 -37.192 53 HD11 LEU 7 1HD1 LEU 7 -3.203 8.569 -38.251 54 HD12 LEU 7 2HD1 LEU 7 -1.883 8.698 -37.078 55 HD13 LEU 7 3HD1 LEU 7 -3.352 7.784 -36.663 56 HD21 LEU 7 3HD2 LEU 7 -5.321 9.676 -37.891 57 HD22 LEU 7 1HD2 LEU 7 -5.528 9.049 -36.240 58 HD23 LEU 7 2HD2 LEU 7 -5.571 10.801 -36.556 59 H ARG 8 H ARG 8 -3.301 13.345 -32.916 60 HA ARG 8 HA ARG 8 -3.339 12.032 -30.307 61 HB2 ARG 8 2HB ARG 8 -0.952 11.827 -31.513 62 HB3 ARG 8 3HB ARG 8 -0.759 13.490 -30.967 63 HG2 ARG 8 2HG ARG 8 -1.067 12.759 -28.619 64 HG3 ARG 8 3HG ARG 8 -1.525 11.140 -29.166 65 HD2 ARG 8 2HD ARG 8 0.721 10.957 -28.428 66 HD3 ARG 8 3HD ARG 8 0.759 10.880 -30.181 67 HE ARG 8 HE ARG 8 1.893 12.915 -30.294 68 HH11 ARG 8 1HH1 ARG 8 1.031 12.341 -26.923 69 HH12 ARG 8 2HH1 ARG 8 2.091 13.603 -26.359 70 HH21 ARG 8 1HH2 ARG 8 3.102 14.522 -29.523 71 HH22 ARG 8 2HH2 ARG 8 3.282 14.797 -27.792 72 H GLY 9 H GLY 9 -2.847 13.742 -28.543 73 HA2 GLY 9 HA2 GLY 9 -4.595 15.988 -28.909 74 HA3 GLY 9 HA3 GLY 9 -3.568 15.668 -27.513 75 H SER 10 H SER 10 -1.237 15.737 -29.723 76 HA SER 10 HA SER 10 -0.349 18.343 -28.946 77 HB2 SER 10 2HB SER 10 1.643 17.706 -30.376 78 HB3 SER 10 3HB SER 10 1.236 16.601 -29.053 79 HG SER 10 HG SER 10 1.671 15.524 -31.062 80 H ARG 11 H ARG 11 -0.064 20.172 -29.983 81 HA ARG 11 HA ARG 11 0.298 20.419 -32.799 82 HB2 ARG 11 2HB ARG 11 -1.365 22.196 -33.245 83 HB3 ARG 11 3HB ARG 11 -2.060 20.606 -33.086 84 HG2 ARG 11 2HG ARG 11 -2.033 22.465 -30.683 85 HG3 ARG 11 3HG ARG 11 -3.181 22.744 -31.987 86 HD2 ARG 11 2HD ARG 11 -2.958 20.132 -30.448 87 HD3 ARG 11 3HD ARG 11 -4.128 21.409 -30.121 88 HE ARG 11 HE ARG 11 -4.571 20.942 -32.780 89 HH11 ARG 11 1HH1 ARG 11 -4.247 18.489 -30.254 90 HH12 ARG 11 2HH1 ARG 11 -5.361 17.432 -31.117 91 HH21 ARG 11 1HH2 ARG 11 -6.173 19.676 -33.521 92 HH22 ARG 11 2HH2 ARG 11 -6.348 18.035 -32.871 93 H LEU 12 H LEU 12 1.063 22.566 -33.374 94 HA LEU 12 HA LEU 12 2.141 24.153 -31.078 95 HB2 LEU 12 2HB LEU 12 3.674 22.245 -31.651 96 HB3 LEU 12 3HB LEU 12 3.817 22.885 -33.284 97 HG LEU 12 HG LEU 12 4.878 24.950 -32.379 98 HD11 LEU 12 1HD1 LEU 12 4.770 23.454 -29.722 99 HD12 LEU 12 2HD1 LEU 12 5.730 24.916 -30.042 100 HD13 LEU 12 3HD1 LEU 12 3.968 24.999 -30.097 101 HD21 LEU 12 3HD2 LEU 12 7.018 23.887 -31.821 102 HD22 LEU 12 1HD2 LEU 12 6.193 22.339 -31.531 103 HD23 LEU 12 2HD2 LEU 12 6.230 23.046 -33.161 104 H GLY 13 H GLY 13 1.439 24.042 -34.568 105 HA2 GLY 13 HA2 GLY 13 1.081 25.769 -36.064 106 HA3 GLY 13 HA3 GLY 13 1.297 26.947 -34.771 107 H ALA 14 H ALA 14 3.904 24.702 -35.101 108 HA ALA 14 HA ALA 14 5.525 26.389 -36.897 109 HB1 ALA 14 3HB ALA 14 6.340 25.809 -34.013 110 HB2 ALA 14 1HB ALA 14 7.285 26.702 -35.220 111 HB3 ALA 14 2HB ALA 14 5.766 27.381 -34.615 112 H VAL 15 H VAL 15 7.776 25.407 -37.115 113 HA VAL 15 HA VAL 15 7.511 22.671 -38.011 114 HB VAL 15 HB VAL 15 9.823 22.917 -38.796 115 HG11 VAL 15 1HG1 VAL 15 8.130 25.358 -39.459 116 HG12 VAL 15 2HG1 VAL 15 9.429 24.652 -40.439 117 HG13 VAL 15 3HG1 VAL 15 7.937 23.738 -40.165 118 HG21 VAL 15 3HG2 VAL 15 10.751 24.333 -36.979 119 HG22 VAL 15 1HG2 VAL 15 11.044 25.015 -38.584 120 HG23 VAL 15 2HG2 VAL 15 9.776 25.704 -37.555 121 H SER 16 H SER 16 9.381 21.105 -37.654 122 HA SER 16 HA SER 16 10.240 19.489 -36.379 123 HB2 SER 16 2HB SER 16 11.811 21.368 -35.818 124 HB3 SER 16 3HB SER 16 10.949 21.548 -34.280 125 HG SER 16 HG SER 16 12.768 20.123 -34.137 126 H TYR 17 H TYR 17 8.077 18.733 -36.308 127 HA TYR 17 HA TYR 17 7.069 18.123 -33.621 128 HB2 TYR 17 2HB TYR 17 4.898 19.028 -33.933 129 HB3 TYR 17 3HB TYR 17 6.015 20.322 -34.278 130 HD1 TYR 17 HD1 TYR 17 6.653 20.647 -36.847 131 HD2 TYR 17 HD2 TYR 17 3.104 18.656 -35.420 132 HE1 TYR 17 HE1 TYR 17 5.572 21.019 -39.048 133 HE2 TYR 17 HE2 TYR 17 1.988 19.122 -37.588 134 HH TYR 17 HH TYR 17 2.208 19.953 -39.676 135 H GLU 18 H GLU 18 4.693 16.921 -34.279 136 HA GLU 18 HA GLU 18 5.559 14.467 -35.524 137 HB2 GLU 18 2HB GLU 18 2.946 15.394 -34.302 138 HB3 GLU 18 3HB GLU 18 3.158 13.769 -34.968 139 HG2 GLU 18 2HG GLU 18 4.935 13.242 -33.435 140 HG3 GLU 18 3HG GLU 18 5.044 14.904 -32.866 141 H THR 19 H THR 19 4.741 17.140 -37.148 142 HA THR 19 HA THR 19 4.383 17.591 -39.302 143 HB THR 19 HB THR 19 5.239 14.773 -39.950 144 HG1 THR 19 HG1 THR 19 6.566 15.853 -38.341 145 HG21 THR 19 1HG2 THR 19 6.494 15.961 -41.772 146 HG22 THR 19 2HG2 THR 19 4.753 16.137 -41.964 147 HG23 THR 19 3HG2 THR 19 5.703 17.483 -41.303 148 H ASP 20 H ASP 20 2.010 17.093 -38.053 149 HA ASP 20 HA ASP 20 0.239 16.104 -40.208 150 HB2 ASP 20 2HB ASP 20 -0.519 16.043 -37.846 151 HB3 ASP 20 3HB ASP 20 -0.391 17.799 -37.754 152 H ARG 21 H ARG 21 0.654 17.232 -42.098 153 HA ARG 21 HA ARG 21 1.720 19.911 -42.081 154 HB2 ARG 21 2HB ARG 21 2.381 18.140 -43.650 155 HB3 ARG 21 3HB ARG 21 0.789 18.218 -44.419 156 HG2 ARG 21 2HG ARG 21 1.213 20.591 -45.044 157 HG3 ARG 21 3HG ARG 21 2.787 20.524 -44.224 158 HD2 ARG 21 2HD ARG 21 3.516 18.735 -45.774 159 HD3 ARG 21 3HD ARG 21 1.939 18.800 -46.589 160 HE ARG 21 HE ARG 21 3.054 21.420 -46.589 161 HH11 ARG 21 1HH1 ARG 21 3.698 18.343 -48.135 162 HH12 ARG 21 2HH1 ARG 21 4.446 19.091 -49.520 163 HH21 ARG 21 2HH2 ARG 21 4.021 22.310 -48.380 164 HH22 ARG 21 1HH2 ARG 21 4.621 21.281 -49.647 165 H ASN 22 H ASN 22 -1.285 21.877 -42.484 166 HA ASN 22 HA ASN 22 1.299 21.552 -41.028 167 HB2 ASN 22 2HB ASN 22 1.668 22.758 -43.173 168 HB3 ASN 22 3HB ASN 22 0.422 23.921 -42.725 169 HD21 ASN 22 1HD2 ASN 22 2.389 25.360 -43.185 170 HD22 ASN 22 2HD2 ASN 22 3.428 25.688 -41.806 171 H HIS 23 H HIS 23 -0.072 20.990 -39.312 172 HA HIS 23 HA HIS 23 -1.273 21.200 -37.443 173 HB2 HIS 23 2HB HIS 23 -0.603 24.154 -37.569 174 HB3 HIS 23 3HB HIS 23 -1.317 23.325 -36.193 175 HD2 HIS 23 HD2 HIS 23 2.021 23.678 -38.056 176 HE1 HIS 23 HE1 HIS 23 2.813 21.296 -34.620 177 HE2 HIS 23 HE2 HIS 23 3.875 22.541 -36.561 178 H ASP 24 H ASP 24 -3.224 22.243 -36.344 179 HA ASP 24 HA ASP 24 -5.372 22.540 -38.383 180 HB2 ASP 24 2HB ASP 24 -6.826 21.415 -36.909 181 HB3 ASP 24 3HB ASP 24 -5.365 20.437 -37.065 182 H LEU 25 H LEU 25 -7.291 23.676 -37.784 183 HA LEU 25 HA LEU 25 -7.045 25.754 -35.685 184 HB2 LEU 25 2HB LEU 25 -7.983 26.258 -38.547 185 HB3 LEU 25 3HB LEU 25 -8.226 27.337 -37.184 186 HG LEU 25 HG LEU 25 -5.574 27.221 -36.965 187 HD11 LEU 25 1HD1 LEU 25 -6.017 26.714 -39.951 188 HD12 LEU 25 2HD1 LEU 25 -4.481 27.174 -39.184 189 HD13 LEU 25 3HD1 LEU 25 -5.199 25.603 -38.838 190 HD21 LEU 25 3HD2 LEU 25 -7.025 28.837 -39.101 191 HD22 LEU 25 1HD2 LEU 25 -6.886 29.254 -37.378 192 HD23 LEU 25 2HD2 LEU 25 -5.439 29.227 -38.393 193 H ALA 26 H ALA 26 -8.838 26.029 -34.530 194 HA ALA 26 HA ALA 26 -11.391 24.685 -35.330 195 HB1 ALA 26 3HB ALA 26 -11.711 24.162 -32.957 196 HB2 ALA 26 1HB ALA 26 -10.248 23.401 -33.618 197 HB3 ALA 26 2HB ALA 26 -10.112 24.839 -32.581 198 HA PRO 27 HA PRO 27 -12.526 29.069 -34.947 199 HB2 PRO 27 2HB PRO 27 -15.170 27.943 -35.891 200 HB3 PRO 27 3HB PRO 27 -14.319 29.433 -36.406 201 HG2 PRO 27 2HG PRO 27 -14.203 27.216 -37.934 202 HG3 PRO 27 3HG PRO 27 -12.691 28.136 -37.618 203 HD2 PRO 27 2HD PRO 27 -13.705 25.650 -36.192 204 HD3 PRO 27 3HD PRO 27 -12.084 25.980 -36.881 205 H ARG 28 H ARG 28 -12.450 29.402 -32.776 206 HA ARG 28 HA ARG 28 -14.993 29.222 -31.267 207 HB2 ARG 28 2HB ARG 28 -14.007 28.207 -29.357 208 HB3 ARG 28 3HB ARG 28 -13.628 27.214 -30.764 209 HG2 ARG 28 2HG ARG 28 -11.338 28.273 -30.841 210 HG3 ARG 28 3HG ARG 28 -11.739 29.139 -29.343 211 HD2 ARG 28 2HD ARG 28 -12.108 26.986 -28.193 212 HD3 ARG 28 3HD ARG 28 -11.721 26.112 -29.691 213 HE ARG 28 HE ARG 28 -9.526 27.779 -29.207 214 HH11 ARG 28 1HH2 ARG 28 -11.005 25.086 -27.522 215 HH12 ARG 28 2HH2 ARG 28 -9.513 24.636 -26.744 216 HH21 ARG 28 1HH1 ARG 28 -7.658 27.147 -28.183 217 HH22 ARG 28 2HH1 ARG 28 -7.670 25.772 -27.120 218 H GLN 29 H GLN 29 -14.892 30.323 -29.184 219 HA GLN 29 HA GLN 29 -13.354 32.872 -29.135 220 HB2 GLN 29 2HB GLN 29 -16.341 32.624 -28.598 221 HB3 GLN 29 3HB GLN 29 -15.380 34.099 -28.551 222 HG2 GLN 29 2HG GLN 29 -15.815 34.499 -30.718 223 HG3 GLN 29 3HG GLN 29 -15.136 32.943 -31.197 224 HE21 GLN 29 1HE2 GLN 29 -16.784 31.078 -30.146 225 HE22 GLN 29 2HE2 GLN 29 -18.397 31.258 -30.836 226 H ILE 30 H ILE 30 -12.238 32.647 -27.313 227 HA ILE 30 HA ILE 30 -13.402 31.378 -24.896 228 HB ILE 30 HB ILE 30 -10.671 32.678 -25.059 229 HG12 ILE 30 2HG1 ILE 30 -10.590 31.122 -26.875 230 HG13 ILE 30 3HG1 ILE 30 -9.667 30.502 -25.520 231 HG21 ILE 30 1HG2 ILE 30 -11.885 30.507 -23.287 232 HG22 ILE 30 2HG2 ILE 30 -10.207 31.086 -23.211 233 HG23 ILE 30 3HG2 ILE 30 -11.540 32.182 -22.824 234 HD11 ILE 30 3HD1 ILE 30 -11.495 28.929 -24.982 235 HD12 ILE 30 1HD1 ILE 30 -12.437 29.555 -26.365 236 HD13 ILE 30 2HD1 ILE 30 -10.898 28.720 -26.631 237 H ALA 31 H ALA 31 -14.859 32.707 -23.906 238 HA ALA 31 HA ALA 31 -14.198 35.583 -23.461 239 HB1 ALA 31 3HB ALA 31 -16.561 35.711 -22.688 240 HB2 ALA 31 1HB ALA 31 -16.401 35.161 -24.361 241 HB3 ALA 31 2HB ALA 31 -16.760 33.988 -23.071 242 H ARG 32 H ARG 32 -14.669 36.408 -21.265 243 HA ARG 32 HA ARG 32 -14.206 34.445 -19.061 244 HB2 ARG 32 2HB ARG 32 -12.895 37.118 -19.535 245 HB3 ARG 32 3HB ARG 32 -13.238 36.618 -17.874 246 HG2 ARG 32 2HG ARG 32 -11.941 34.617 -18.068 247 HG3 ARG 32 3HG ARG 32 -11.766 34.799 -19.807 248 HD2 ARG 32 2HD ARG 32 -9.744 35.626 -19.268 249 HD3 ARG 32 3HD ARG 32 -10.609 37.133 -19.055 250 HE ARG 32 HE ARG 32 -9.412 35.397 -17.004 251 HH11 ARG 32 1HH1 ARG 32 -11.519 38.190 -17.391 252 HH12 ARG 32 2HH1 ARG 32 -11.328 38.647 -15.708 253 HH21 ARG 32 1HH2 ARG 32 -9.051 36.188 -14.987 254 HH22 ARG 32 2HH2 ARG 32 -9.874 37.629 -14.442 255 H TYR 33 H TYR 33 -15.209 34.843 -17.117 256 HA TYR 33 HA TYR 33 -17.287 36.944 -17.005 257 HB2 TYR 33 2HB TYR 33 -17.896 34.015 -16.529 258 HB3 TYR 33 3HB TYR 33 -18.946 35.349 -16.156 259 HD1 TYR 33 HD2 TYR 33 -17.273 33.584 -19.002 260 HD2 TYR 33 HD1 TYR 33 -20.405 36.239 -17.740 261 HE1 TYR 33 HE2 TYR 33 -18.370 33.377 -21.240 262 HE2 TYR 33 HE1 TYR 33 -21.467 36.068 -19.987 263 HH TYR 33 HH TYR 33 -21.453 35.062 -21.962 264 H ARG 34 H ARG 34 -17.625 37.722 -15.011 265 HA ARG 34 HA ARG 34 -15.954 36.743 -12.733 266 HB2 ARG 34 2HB ARG 34 -15.522 39.026 -13.612 267 HB3 ARG 34 3HB ARG 34 -17.207 39.457 -13.307 268 HG2 ARG 34 2HG ARG 34 -16.855 39.049 -10.865 269 HG3 ARG 34 3HG ARG 34 -15.180 38.601 -11.186 270 HD2 ARG 34 2HD ARG 34 -15.278 40.902 -10.383 271 HD3 ARG 34 3HD ARG 34 -14.717 40.859 -12.050 272 HE ARG 34 HE ARG 34 -16.509 42.149 -12.664 273 HH11 ARG 34 1HH1 ARG 34 -17.499 40.667 -9.630 274 HH12 ARG 34 2HH1 ARG 34 -18.940 41.638 -9.545 275 HH21 ARG 34 2HH2 ARG 34 -18.375 43.309 -12.486 276 HH22 ARG 34 1HH2 ARG 34 -19.421 43.077 -11.119 277 H THR 35 H THR 35 -16.869 35.904 -11.011 278 HA THR 35 HA THR 35 -19.781 35.579 -10.840 279 HB THR 35 HB THR 35 -19.359 34.145 -8.915 280 HG1 THR 35 HG1 THR 35 -16.648 34.616 -9.354 281 HG21 THR 35 1HG2 THR 35 -17.988 32.425 -9.942 282 HG22 THR 35 2HG2 THR 35 -19.217 33.087 -11.046 283 HG23 THR 35 3HG2 THR 35 -17.513 33.542 -11.238 284 H ASP 36 H ASP 36 -20.618 35.638 -8.404 285 HA ASP 36 HA ASP 36 -20.622 38.427 -7.752 286 HB2 ASP 36 2HB ASP 36 -22.614 36.886 -7.657 287 HB3 ASP 36 3HB ASP 36 -21.887 36.080 -6.267 288 H ASN 37 H ASN 37 -18.580 35.847 -6.607 289 HA ASN 37 HA ASN 37 -17.838 37.447 -4.205 290 HB2 ASN 37 2HB ASN 37 -16.396 34.984 -5.007 291 HB3 ASN 37 3HB ASN 37 -16.569 35.710 -3.447 292 HD21 ASN 37 1HD2 ASN 37 -17.057 32.991 -4.520 293 HD22 ASN 37 2HD2 ASN 37 -18.678 32.596 -3.904 294 H GLY 38 H GLY 38 -17.230 37.845 -7.392 295 HA2 GLY 38 HA2 GLY 38 -15.575 39.015 -8.542 296 HA3 GLY 38 HA3 GLY 38 -14.518 38.985 -7.129 297 H GLU 39 H GLU 39 -15.707 35.842 -7.809 298 HA GLU 39 HA GLU 39 -13.006 34.988 -8.573 299 HB2 GLU 39 2HB GLU 39 -15.413 33.176 -8.740 300 HB3 GLU 39 3HB GLU 39 -13.751 32.794 -8.389 301 HG2 GLU 39 2HG GLU 39 -14.321 34.391 -6.244 302 HG3 GLU 39 3HG GLU 39 -15.961 33.874 -6.699 303 H GLU 40 H GLU 40 -12.297 35.199 -10.630 304 HA GLU 40 HA GLU 40 -14.238 35.342 -12.876 305 HB2 GLU 40 2HB GLU 40 -11.267 35.917 -12.782 306 HB3 GLU 40 3HB GLU 40 -12.337 36.150 -14.171 307 HG2 GLU 40 2HG GLU 40 -13.658 37.798 -12.886 308 HG3 GLU 40 3HG GLU 40 -12.555 37.629 -11.517 309 H PHE 41 H PHE 41 -14.490 33.853 -14.376 310 HA PHE 41 HA PHE 41 -12.473 31.672 -14.753 311 HB2 PHE 41 2HB PHE 41 -15.489 31.421 -14.673 312 HB3 PHE 41 3HB PHE 41 -14.396 30.153 -15.151 313 HD1 PHE 41 HD2 PHE 41 -15.567 32.173 -12.209 314 HD2 PHE 41 HD1 PHE 41 -13.062 28.910 -13.558 315 HE1 PHE 41 HE2 PHE 41 -15.226 31.447 -9.901 316 HE2 PHE 41 HE1 PHE 41 -12.703 28.218 -11.207 317 HZ PHE 41 HZ PHE 41 -13.773 29.498 -9.362 318 H GLU 42 H GLU 42 -12.594 30.607 -16.765 319 HA GLU 42 HA GLU 42 -13.333 32.390 -19.013 320 HB2 GLU 42 2HB GLU 42 -11.432 30.057 -19.256 321 HB3 GLU 42 3HB GLU 42 -11.584 31.498 -20.245 322 HG2 GLU 42 2HG GLU 42 -9.723 32.133 -19.148 323 HG3 GLU 42 3HG GLU 42 -10.846 32.690 -17.918 324 H VAL 43 H VAL 43 -14.710 31.780 -20.555 325 HA VAL 43 HA VAL 43 -15.715 28.950 -20.636 326 HB VAL 43 HB VAL 43 -17.391 31.404 -21.146 327 HG11 VAL 43 1HG1 VAL 43 -19.236 29.844 -21.208 328 HG12 VAL 43 2HG1 VAL 43 -18.059 29.353 -22.413 329 HG13 VAL 43 3HG1 VAL 43 -18.154 28.469 -20.877 330 HG21 VAL 43 3HG2 VAL 43 -18.501 30.978 -19.084 331 HG22 VAL 43 1HG2 VAL 43 -17.519 29.528 -18.759 332 HG23 VAL 43 2HG2 VAL 43 -16.802 31.155 -18.707 333 HA PRO 44 HA PRO 44 -14.416 29.461 -24.984 334 HB2 PRO 44 2HB PRO 44 -14.769 26.509 -24.906 335 HB3 PRO 44 3HB PRO 44 -13.408 27.449 -25.549 336 HG2 PRO 44 2HG PRO 44 -13.217 26.094 -23.183 337 HG3 PRO 44 3HG PRO 44 -12.469 27.713 -23.365 338 HD2 PRO 44 2HD PRO 44 -15.119 27.013 -22.081 339 HD3 PRO 44 3HD PRO 44 -13.830 28.141 -21.540 340 H PHE 45 H PHE 45 -15.844 29.923 -26.454 341 HA PHE 45 HA PHE 45 -18.423 28.397 -26.790 342 HB2 PHE 45 2HB PHE 45 -17.710 31.297 -27.276 343 HB3 PHE 45 3HB PHE 45 -19.074 30.569 -28.062 344 HD1 PHE 45 HD1 PHE 45 -17.638 31.548 -24.779 345 HD2 PHE 45 HD2 PHE 45 -21.147 30.103 -26.830 346 HE1 PHE 45 HE1 PHE 45 -19.013 32.030 -22.782 347 HE2 PHE 45 HE2 PHE 45 -22.513 30.570 -24.804 348 HZ PHE 45 HZ PHE 45 -21.428 31.533 -22.768 349 H ALA 46 H ALA 46 -18.984 27.729 -28.866 350 HA ALA 46 HA ALA 46 -16.798 27.544 -30.857 351 HB1 ALA 46 3HB ALA 46 -18.325 26.003 -32.014 352 HB2 ALA 46 1HB ALA 46 -18.115 25.525 -30.320 353 HB3 ALA 46 2HB ALA 46 -19.605 26.353 -30.832 354 H ASP 47 H ASP 47 -17.130 28.248 -33.078 355 HA ASP 47 HA ASP 47 -18.138 30.866 -33.379 356 HB2 ASP 47 2HB ASP 47 -16.365 29.792 -34.720 357 HB3 ASP 47 3HB ASP 47 -17.579 28.785 -35.521 358 H ASP 48 H ASP 48 -19.917 27.907 -33.540 359 HA ASP 48 HA ASP 48 -22.211 28.875 -35.066 360 HB2 ASP 48 2HB ASP 48 -21.516 26.482 -34.828 361 HB3 ASP 48 3HB ASP 48 -21.943 26.559 -33.121 362 H ALA 49 H ALA 49 -21.065 29.510 -31.922 363 HA ALA 49 HA ALA 49 -23.705 30.518 -30.945 364 HB1 ALA 49 3HB ALA 49 -21.345 29.471 -29.331 365 HB2 ALA 49 1HB ALA 49 -22.883 30.077 -28.681 366 HB3 ALA 49 2HB ALA 49 -22.858 28.584 -29.640 367 H GLU 50 H GLU 50 -23.554 32.410 -29.530 368 HA GLU 50 HA GLU 50 -21.112 34.094 -29.795 369 HB2 GLU 50 2HB GLU 50 -23.960 34.961 -30.406 370 HB3 GLU 50 3HB GLU 50 -22.685 36.100 -29.953 371 HG2 GLU 50 2HG GLU 50 -21.305 35.411 -31.849 372 HG3 GLU 50 3HG GLU 50 -22.492 34.192 -32.307 373 H ILE 51 H ILE 51 -20.602 35.226 -28.073 374 HA ILE 51 HA ILE 51 -21.123 34.297 -25.542 375 HB ILE 51 HB ILE 51 -20.108 37.102 -26.015 376 HG12 ILE 51 2HG1 ILE 51 -18.939 35.755 -27.657 377 HG13 ILE 51 3HG1 ILE 51 -17.853 36.242 -26.361 378 HG21 ILE 51 1HG2 ILE 51 -18.694 36.624 -24.061 379 HG22 ILE 51 2HG2 ILE 51 -20.395 36.384 -23.644 380 HG23 ILE 51 3HG2 ILE 51 -19.344 34.992 -23.953 381 HD11 ILE 51 3HD1 ILE 51 -18.045 33.926 -25.405 382 HD12 ILE 51 1HD1 ILE 51 -19.085 33.486 -26.780 383 HD13 ILE 51 2HD1 ILE 51 -17.399 33.961 -27.045 384 HA PRO 52 HA PRO 52 -24.906 36.662 -24.579 385 HB2 PRO 52 2HB PRO 52 -25.640 35.159 -22.426 386 HB3 PRO 52 3HB PRO 52 -25.941 34.647 -24.117 387 HG2 PRO 52 2HG PRO 52 -23.732 33.788 -22.244 388 HG3 PRO 52 3HG PRO 52 -24.712 32.779 -23.363 389 HD2 PRO 52 2HD PRO 52 -22.162 33.752 -23.916 390 HD3 PRO 52 3HD PRO 52 -23.332 33.359 -25.178 391 H GLY 53 H GLY 53 -25.232 38.205 -23.005 392 HA2 GLY 53 HA2 GLY 53 -23.174 39.563 -21.804 393 HA3 GLY 53 HA3 GLY 53 -24.852 39.662 -21.262 394 H THR 54 H THR 54 -24.921 36.843 -20.271 395 HA THR 54 HA THR 54 -22.734 36.730 -18.325 396 HB THR 54 HB THR 54 -24.328 36.156 -16.468 397 HG1 THR 54 HG1 THR 54 -26.560 36.493 -16.812 398 HG21 THR 54 1HG2 THR 54 -25.326 38.283 -15.967 399 HG22 THR 54 2HG2 THR 54 -23.781 38.581 -16.759 400 HG23 THR 54 3HG2 THR 54 -25.277 38.782 -17.674 401 H TRP 55 H TRP 55 -22.547 34.610 -17.234 402 HA TRP 55 HA TRP 55 -23.877 32.274 -18.394 403 HB2 TRP 55 2HB TRP 55 -22.099 32.945 -20.074 404 HB3 TRP 55 3HB TRP 55 -20.897 32.652 -18.825 405 HD1 TRP 55 HD1 TRP 55 -20.311 30.167 -18.281 406 HE1 TRP 55 HE1 TRP 55 -20.621 27.980 -19.544 407 HE3 TRP 55 HE3 TRP 55 -23.946 31.665 -21.504 408 HZ2 TRP 55 HZ2 TRP 55 -22.395 26.933 -21.606 409 HZ3 TRP 55 HZ3 TRP 55 -24.972 30.050 -23.109 410 HH2 TRP 55 HH2 TRP 55 -24.195 27.689 -23.169 411 H LEU 56 H LEU 56 -23.481 30.344 -17.166 412 HA LEU 56 HA LEU 56 -22.792 30.799 -14.402 413 HB2 LEU 56 2HB LEU 56 -24.330 28.959 -15.816 414 HB3 LEU 56 3HB LEU 56 -22.941 27.999 -15.302 415 HG LEU 56 HG LEU 56 -24.629 29.693 -13.419 416 HD11 LEU 56 1HD1 LEU 56 -25.674 27.570 -12.726 417 HD12 LEU 56 2HD1 LEU 56 -25.992 27.907 -14.435 418 HD13 LEU 56 3HD1 LEU 56 -24.765 26.701 -13.985 419 HD21 LEU 56 3HD2 LEU 56 -23.620 28.248 -11.674 420 HD22 LEU 56 1HD2 LEU 56 -22.615 27.455 -12.911 421 HD23 LEU 56 2HD2 LEU 56 -22.386 29.171 -12.536 422 H CYS 57 H CYS 57 -20.903 30.614 -13.389 423 HA CYS 57 HA CYS 57 -18.492 29.802 -14.907 424 HB2 CYS 57 2HB CYS 57 -18.936 31.292 -12.294 425 HB3 CYS 57 3HB CYS 57 -17.342 30.786 -12.854 426 HG CYS 57 HG CYS 57 -17.484 31.959 -15.211 427 H ARG 58 H ARG 58 -16.785 28.638 -13.760 428 HA ARG 58 HA ARG 58 -17.735 26.063 -13.012 429 HB2 ARG 58 2HB ARG 58 -14.886 27.034 -12.599 430 HB3 ARG 58 3HB ARG 58 -15.437 25.395 -12.931 431 HG2 ARG 58 2HG ARG 58 -16.145 26.142 -15.236 432 HG3 ARG 58 3HG ARG 58 -15.480 27.748 -14.877 433 HD2 ARG 58 2HD ARG 58 -13.257 26.599 -14.390 434 HD3 ARG 58 3HD ARG 58 -13.969 25.133 -15.095 435 HE ARG 58 HE ARG 58 -14.282 27.419 -16.858 436 HH11 ARG 58 2HH2 ARG 58 -11.853 25.079 -15.897 437 HH12 ARG 58 1HH2 ARG 58 -10.933 25.314 -17.358 438 HH21 ARG 58 1HH1 ARG 58 -13.045 27.731 -18.621 439 HH22 ARG 58 2HH1 ARG 58 -11.610 26.761 -18.884 440 H ASN 59 H ASN 59 -17.101 28.775 -11.014 441 HA ASN 59 HA ASN 59 -16.783 27.463 -8.487 442 HB2 ASN 59 2HB ASN 59 -16.183 29.760 -8.879 443 HB3 ASN 59 3HB ASN 59 -17.841 30.188 -9.320 444 HD21 ASN 59 1HD2 ASN 59 -17.892 31.869 -7.768 445 HD22 ASN 59 2HD2 ASN 59 -17.870 31.522 -6.053 446 H GLY 60 H GLY 60 -19.540 27.777 -10.558 447 HA2 GLY 60 HA2 GLY 60 -21.656 26.783 -10.282 448 HA3 GLY 60 HA3 GLY 60 -21.422 26.680 -8.536 449 H MET 61 H MET 61 -20.576 29.755 -9.851 450 HA MET 61 HA MET 61 -23.169 30.962 -9.028 451 HB2 MET 61 2HB MET 61 -21.128 31.447 -7.620 452 HB3 MET 61 3HB MET 61 -20.389 32.203 -9.007 453 HG2 MET 61 2HG MET 61 -21.394 33.856 -7.495 454 HG3 MET 61 3HG MET 61 -22.102 33.913 -9.103 455 HE1 MET 61 3HE MET 61 -22.850 31.537 -5.948 456 HE2 MET 61 1HE MET 61 -22.602 33.185 -5.322 457 HE3 MET 61 2HE MET 61 -24.211 32.438 -5.249 458 H GLU 62 H GLU 62 -24.056 32.581 -10.328 459 HA GLU 62 HA GLU 62 -23.540 32.451 -13.182 460 HB2 GLU 62 2HB GLU 62 -25.301 34.278 -11.510 461 HB3 GLU 62 3HB GLU 62 -25.210 34.307 -13.278 462 HG2 GLU 62 2HG GLU 62 -25.916 31.932 -13.367 463 HG3 GLU 62 3HG GLU 62 -26.040 31.894 -11.607 464 H GLY 63 H GLY 63 -21.782 33.281 -14.074 465 HA2 GLY 63 HA2 GLY 63 -20.406 35.611 -12.955 466 HA3 GLY 63 HA3 GLY 63 -19.836 34.605 -14.265 467 H THR 64 H THR 64 -20.073 37.559 -14.079 468 HA THR 64 HA THR 64 -21.785 38.014 -16.485 469 HB THR 64 HB THR 64 -20.644 40.057 -14.541 470 HG1 THR 64 HG1 THR 64 -22.320 38.849 -13.641 471 HG21 THR 64 1HG2 THR 64 -22.337 41.597 -15.651 472 HG22 THR 64 2HG2 THR 64 -20.954 41.167 -16.661 473 HG23 THR 64 3HG2 THR 64 -22.520 40.378 -16.931 474 H LEU 65 H LEU 65 -20.989 38.832 -18.335 475 HA LEU 65 HA LEU 65 -18.371 38.110 -19.071 476 HB2 LEU 65 2HB LEU 65 -20.496 38.216 -20.405 477 HB3 LEU 65 3HB LEU 65 -20.360 39.954 -20.441 478 HG LEU 65 HG LEU 65 -18.691 37.824 -21.826 479 HD11 LEU 65 1HD1 LEU 65 -20.238 40.247 -22.850 480 HD12 LEU 65 2HD1 LEU 65 -19.463 38.998 -23.844 481 HD13 LEU 65 3HD1 LEU 65 -20.845 38.580 -22.821 482 HD21 LEU 65 3HD2 LEU 65 -16.973 39.382 -21.247 483 HD22 LEU 65 1HD2 LEU 65 -17.392 39.669 -22.925 484 HD23 LEU 65 2HD2 LEU 65 -17.999 40.783 -21.678 485 H ILE 66 H ILE 66 -16.492 39.096 -18.771 486 HA ILE 66 HA ILE 66 -16.290 42.070 -18.735 487 HB ILE 66 HB ILE 66 -14.457 42.021 -17.214 488 HG12 ILE 66 2HG1 ILE 66 -13.447 39.839 -17.630 489 HG13 ILE 66 3HG1 ILE 66 -13.719 40.130 -15.920 490 HG21 ILE 66 1HG2 ILE 66 -16.886 40.641 -16.034 491 HG22 ILE 66 2HG2 ILE 66 -15.624 41.495 -15.126 492 HG23 ILE 66 3HG2 ILE 66 -16.648 42.378 -16.278 493 HD11 ILE 66 3HD1 ILE 66 -15.246 38.267 -17.660 494 HD12 ILE 66 1HD1 ILE 66 -14.239 37.883 -16.254 495 HD13 ILE 66 2HD1 ILE 66 -15.782 38.719 -16.037 496 H GLU 67 H GLU 67 -14.309 42.956 -19.537 497 HA GLU 67 HA GLU 67 -13.400 41.783 -21.975 498 HB2 GLU 67 2HB GLU 67 -12.199 44.005 -20.278 499 HB3 GLU 67 3HB GLU 67 -11.660 43.569 -21.905 500 HG2 GLU 67 2HG GLU 67 -13.920 44.065 -22.801 501 HG3 GLU 67 3HG GLU 67 -14.465 44.529 -21.187 502 H GLY 68 H GLY 68 -12.029 40.238 -22.357 503 HA2 GLY 68 HA2 GLY 68 -9.469 39.701 -21.384 504 HA3 GLY 68 HA3 GLY 68 -10.563 38.865 -20.270 505 H ASP 69 H ASP 69 -10.523 39.459 -23.783 506 HA ASP 69 HA ASP 69 -11.079 36.637 -24.464 507 HB2 ASP 69 2HB ASP 69 -13.171 37.339 -25.521 508 HB3 ASP 69 3HB ASP 69 -13.186 37.696 -23.807 509 H LEU 70 H LEU 70 -12.005 37.405 -27.082 510 HA LEU 70 HA LEU 70 -9.538 37.157 -28.457 511 HB2 LEU 70 2HB LEU 70 -12.306 37.894 -29.470 512 HB3 LEU 70 3HB LEU 70 -10.956 37.538 -30.531 513 HG LEU 70 HG LEU 70 -12.071 35.527 -28.538 514 HD11 LEU 70 1HD1 LEU 70 -12.616 35.942 -31.504 515 HD12 LEU 70 2HD1 LEU 70 -13.092 34.507 -30.593 516 HD13 LEU 70 3HD1 LEU 70 -13.782 36.087 -30.170 517 HD21 LEU 70 3HD2 LEU 70 -9.744 35.045 -29.212 518 HD22 LEU 70 1HD2 LEU 70 -10.857 33.893 -29.957 519 HD23 LEU 70 2HD2 LEU 70 -10.191 35.223 -30.925 520 HA PRO 71 HA PRO 71 -8.369 41.404 -29.257 521 HB2 PRO 71 2HB PRO 71 -6.442 41.106 -31.129 522 HB3 PRO 71 3HB PRO 71 -6.287 40.373 -29.510 523 HG2 PRO 71 2HG PRO 71 -7.312 39.028 -32.041 524 HG3 PRO 71 3HG PRO 71 -6.002 38.466 -30.951 525 HD2 PRO 71 2HD PRO 71 -8.582 37.591 -30.705 526 HD3 PRO 71 3HD PRO 71 -7.527 37.837 -29.282 527 H GLU 72 H GLU 72 -10.837 41.096 -30.181 528 HA GLU 72 HA GLU 72 -12.444 41.324 -31.814 529 HB2 GLU 72 2HB GLU 72 -10.720 43.791 -31.892 530 HB3 GLU 72 3HB GLU 72 -12.333 43.705 -32.641 531 HG2 GLU 72 2HG GLU 72 -13.306 43.104 -30.433 532 HG3 GLU 72 3HG GLU 72 -11.716 43.286 -29.688 533 HA PRO 73 HA PRO 73 -10.132 40.086 -35.699 534 HB2 PRO 73 2HB PRO 73 -11.032 37.521 -35.951 535 HB3 PRO 73 3HB PRO 73 -9.622 37.956 -34.938 536 HG2 PRO 73 2HG PRO 73 -12.501 37.565 -34.041 537 HG3 PRO 73 3HG PRO 73 -11.016 36.834 -33.345 538 HD2 PRO 73 2HD PRO 73 -12.132 39.072 -32.281 539 HD3 PRO 73 3HD PRO 73 -10.354 38.877 -32.371 540 H LYS 74 H LYS 74 -11.105 39.625 -37.767 541 HA LYS 74 HA LYS 74 -14.047 40.189 -37.977 542 HB2 LYS 74 2HB LYS 74 -11.782 41.319 -39.656 543 HB3 LYS 74 3HB LYS 74 -13.486 41.541 -40.029 544 HG2 LYS 74 2HG LYS 74 -12.414 42.430 -37.318 545 HG3 LYS 74 3HG LYS 74 -12.108 43.390 -38.762 546 HD2 LYS 74 2HD LYS 74 -14.504 43.593 -39.228 547 HD3 LYS 74 3HD LYS 74 -14.880 42.577 -37.817 548 HE2 LYS 74 2HE LYS 74 -13.771 44.230 -36.332 549 HE3 LYS 74 3HE LYS 74 -13.396 45.243 -37.733 550 HZ1 LYS 74 HZ1 LYS 74 -15.409 46.002 -36.608 551 HZ2 LYS 74 HZ2 LYS 74 -15.794 45.494 -38.109 552 HZ3 LYS 74 HZ3 LYS 74 -16.140 44.559 -36.813 553 H LYS 75 H LYS 75 -15.086 39.463 -39.869 554 HA LYS 75 HA LYS 75 -14.181 36.834 -40.823 555 HB2 LYS 75 2HB LYS 75 -16.746 38.401 -41.291 556 HB3 LYS 75 3HB LYS 75 -16.465 36.763 -41.871 557 HG2 LYS 75 2HG LYS 75 -16.438 37.535 -38.920 558 HG3 LYS 75 3HG LYS 75 -17.834 36.901 -39.794 559 HD2 LYS 75 2HD LYS 75 -16.561 34.834 -40.349 560 HD3 LYS 75 3HD LYS 75 -15.188 35.437 -39.395 561 HE2 LYS 75 2HE LYS 75 -16.601 35.514 -37.373 562 HE3 LYS 75 3HE LYS 75 -17.998 34.963 -38.308 563 HZ1 LYS 75 HZ1 LYS 75 -16.835 32.883 -38.735 564 HZ2 LYS 75 HZ2 LYS 75 -15.506 33.392 -37.925 565 HZ3 LYS 75 HZ3 LYS 75 -16.904 33.120 -37.126 566 H VAL 76 H VAL 76 -12.400 38.644 -41.715 567 HA VAL 76 HA VAL 76 -12.897 39.337 -44.530 568 HB VAL 76 HB VAL 76 -10.527 40.017 -44.570 569 HG11 VAL 76 1HG1 VAL 76 -12.102 41.179 -42.237 570 HG12 VAL 76 2HG1 VAL 76 -10.780 41.966 -43.123 571 HG13 VAL 76 3HG1 VAL 76 -12.305 41.607 -43.950 572 HG21 VAL 76 3HG2 VAL 76 -9.201 40.152 -42.531 573 HG22 VAL 76 1HG2 VAL 76 -10.469 39.343 -41.593 574 HG23 VAL 76 2HG2 VAL 76 -9.594 38.461 -42.865 575 H LYS 77 H LYS 77 -11.657 38.537 -46.311 576 HA LYS 77 HA LYS 77 -10.431 35.857 -46.081 577 HB2 LYS 77 2HB LYS 77 -11.900 34.997 -47.952 578 HB3 LYS 77 3HB LYS 77 -12.690 35.195 -46.392 579 HG2 LYS 77 2HG LYS 77 -13.769 37.277 -47.143 580 HG3 LYS 77 3HG LYS 77 -12.913 37.178 -48.696 581 HD2 LYS 77 2HD LYS 77 -14.056 35.034 -49.190 582 HD3 LYS 77 3HD LYS 77 -14.905 35.128 -47.630 583 HE2 LYS 77 2HE LYS 77 -15.945 37.274 -48.329 584 HE3 LYS 77 3HE LYS 77 -15.096 37.188 -49.877 585 HZ1 LYS 77 HZ1 LYS 77 -17.104 35.212 -48.926 586 HZ2 LYS 77 HZ2 LYS 77 -17.368 36.349 -50.065 587 HZ3 LYS 77 HZ3 LYS 77 -16.321 35.133 -50.358 588 HA PRO 78 HA PRO 78 -7.890 37.480 -49.344 589 HB2 PRO 78 2HB PRO 78 -6.916 35.225 -50.556 590 HB3 PRO 78 3HB PRO 78 -6.449 35.723 -48.902 591 HG2 PRO 78 2HG PRO 78 -8.599 33.729 -49.704 592 HG3 PRO 78 3HG PRO 78 -7.273 33.505 -48.515 593 HD2 PRO 78 2HD PRO 78 -9.768 34.227 -47.737 594 HD3 PRO 78 3HD PRO 78 -8.326 34.920 -46.941 595 HA PRO 79 HA PRO 79 -10.380 37.647 -53.015 596 HB2 PRO 79 2HB PRO 79 -8.666 38.552 -54.927 597 HB3 PRO 79 3HB PRO 79 -9.099 39.526 -53.489 598 HG2 PRO 79 2HG PRO 79 -6.646 37.767 -53.866 599 HG3 PRO 79 3HG PRO 79 -6.703 39.482 -53.338 600 HD2 PRO 79 2HD PRO 79 -6.563 37.436 -51.547 601 HD3 PRO 79 3HD PRO 79 -7.538 38.897 -51.211 602 H ARG 80 H ARG 80 -7.877 35.301 -52.882 603 HA ARG 80 HA ARG 80 -8.962 33.762 -55.202 604 HB2 ARG 80 2HB ARG 80 -6.026 34.228 -54.526 605 HB3 ARG 80 3HB ARG 80 -6.622 33.002 -55.650 606 HG2 ARG 80 2HG ARG 80 -7.612 34.766 -57.087 607 HG3 ARG 80 3HG ARG 80 -7.039 36.008 -55.967 608 HD2 ARG 80 2HD ARG 80 -5.507 35.899 -57.830 609 HD3 ARG 80 3HD ARG 80 -4.701 35.333 -56.373 610 HE ARG 80 HE ARG 80 -4.508 33.201 -57.264 611 HH11 ARG 80 1HH2 ARG 80 -6.599 35.015 -59.418 612 HH12 ARG 80 2HH2 ARG 80 -6.546 33.779 -60.645 613 HH21 ARG 80 1HH1 ARG 80 -4.493 31.679 -58.865 614 HH22 ARG 80 2HH1 ARG 80 -5.385 31.948 -60.336 Start of MODEL 26 1 H1 SER 1 1H SER 1 13.414 -4.780 -20.574 2 H2 SER 1 2H SER 1 12.155 -5.437 -19.755 3 H3 SER 1 3H SER 1 13.088 -4.293 -19.040 4 HA SER 1 HA SER 1 12.368 -2.621 -20.574 5 HB2 SER 1 2HB SER 1 10.653 -4.831 -21.767 6 HB3 SER 1 3HB SER 1 10.640 -3.120 -22.240 7 HG SER 1 HG SER 1 12.003 -4.380 -23.593 8 H MET 2 H MET 2 9.522 -1.921 -18.519 9 HA MET 2 HA MET 2 12.061 -0.919 -19.588 10 HB2 MET 2 2HB MET 2 11.016 0.738 -21.065 11 HB3 MET 2 3HB MET 2 10.683 -0.895 -21.622 12 HG2 MET 2 2HG MET 2 8.414 -0.777 -20.609 13 HG3 MET 2 3HG MET 2 8.751 0.870 -20.063 14 HE1 MET 2 3HE MET 2 6.521 1.710 -21.179 15 HE2 MET 2 1HE MET 2 6.085 1.406 -22.875 16 HE3 MET 2 2HE MET 2 6.177 0.053 -21.725 17 H ALA 3 H ALA 3 12.393 1.363 -19.074 18 HA ALA 3 HA ALA 3 10.680 2.558 -16.988 19 HB1 ALA 3 3HB ALA 3 12.595 2.828 -15.449 20 HB2 ALA 3 1HB ALA 3 12.264 1.113 -15.748 21 HB3 ALA 3 2HB ALA 3 13.632 1.908 -16.560 22 H ASP 4 H ASP 4 11.331 4.779 -16.463 23 HA ASP 4 HA ASP 4 13.092 6.200 -18.338 24 HB2 ASP 4 2HB ASP 4 10.746 6.044 -19.365 25 HB3 ASP 4 3HB ASP 4 10.189 7.056 -18.032 26 H ARG 5 H ARG 5 13.113 8.601 -17.705 27 HA ARG 5 HA ARG 5 14.033 8.687 -14.965 28 HB2 ARG 5 2HB ARG 5 15.076 10.694 -15.604 29 HB3 ARG 5 3HB ARG 5 15.136 9.595 -16.981 30 HG2 ARG 5 2HG ARG 5 12.825 11.028 -17.547 31 HG3 ARG 5 3HG ARG 5 13.762 12.233 -16.666 32 HD2 ARG 5 2HD ARG 5 14.286 12.539 -18.964 33 HD3 ARG 5 3HD ARG 5 15.697 11.723 -18.261 34 HE ARG 5 HE ARG 5 13.664 9.902 -19.369 35 HH11 ARG 5 1HH1 ARG 5 16.503 11.705 -20.391 36 HH12 ARG 5 2HH1 ARG 5 16.780 10.604 -21.717 37 HH21 ARG 5 1HH2 ARG 5 14.048 8.626 -20.887 38 HH22 ARG 5 2HH2 ARG 5 15.378 8.849 -22.028 39 H VAL 6 H VAL 6 11.139 8.686 -15.415 40 HA VAL 6 HA VAL 6 10.252 10.800 -13.520 41 HB VAL 6 HB VAL 6 8.176 11.030 -14.909 42 HG11 VAL 6 1HG1 VAL 6 9.942 12.763 -14.866 43 HG12 VAL 6 2HG1 VAL 6 10.718 11.995 -16.268 44 HG13 VAL 6 3HG1 VAL 6 9.097 12.697 -16.421 45 HG21 VAL 6 3HG2 VAL 6 8.209 10.552 -17.290 46 HG22 VAL 6 1HG2 VAL 6 9.817 9.821 -17.169 47 HG23 VAL 6 2HG2 VAL 6 8.421 9.046 -16.385 48 H LEU 7 H LEU 7 8.379 10.332 -12.341 49 HA LEU 7 HA LEU 7 7.870 7.496 -11.803 50 HB2 LEU 7 2HB LEU 7 6.569 10.018 -10.700 51 HB3 LEU 7 3HB LEU 7 6.297 8.386 -10.099 52 HG LEU 7 HG LEU 7 8.953 9.887 -10.000 53 HD11 LEU 7 1HD1 LEU 7 8.546 9.956 -7.581 54 HD12 LEU 7 2HD1 LEU 7 7.239 10.767 -8.457 55 HD13 LEU 7 3HD1 LEU 7 6.985 9.134 -7.800 56 HD21 LEU 7 3HD2 LEU 7 9.382 7.476 -10.154 57 HD22 LEU 7 1HD2 LEU 7 9.680 8.033 -8.507 58 HD23 LEU 7 2HD2 LEU 7 8.179 7.156 -8.879 59 H ARG 8 H ARG 8 5.821 6.465 -11.914 60 HA ARG 8 HA ARG 8 4.367 6.952 -14.381 61 HB2 ARG 8 2HB ARG 8 4.861 4.699 -13.456 62 HB3 ARG 8 3HB ARG 8 3.774 5.021 -12.099 63 HG2 ARG 8 2HG ARG 8 1.856 5.209 -13.675 64 HG3 ARG 8 3HG ARG 8 2.961 5.012 -15.045 65 HD2 ARG 8 2HD ARG 8 1.859 2.915 -14.652 66 HD3 ARG 8 3HD ARG 8 3.567 2.747 -14.214 67 HE ARG 8 HE ARG 8 1.987 3.466 -11.906 68 HH11 ARG 8 1HH1 ARG 8 2.627 0.668 -13.915 69 HH12 ARG 8 2HH1 ARG 8 2.255 -0.452 -12.632 70 HH21 ARG 8 1HH2 ARG 8 1.538 1.985 -10.312 71 HH22 ARG 8 2HH2 ARG 8 1.650 0.283 -10.649 72 H GLY 9 H GLY 9 2.457 7.904 -14.743 73 HA2 GLY 9 HA2 GLY 9 0.232 8.368 -13.208 74 HA3 GLY 9 HA3 GLY 9 1.318 9.675 -12.725 75 H SER 10 H SER 10 -0.433 11.031 -13.623 76 HA SER 10 HA SER 10 -0.854 11.191 -16.489 77 HB2 SER 10 2HB SER 10 -2.455 12.012 -14.742 78 HB3 SER 10 3HB SER 10 -1.347 13.366 -14.434 79 HG SER 10 HG SER 10 -3.033 13.805 -16.009 80 H ARG 11 H ARG 11 -0.252 13.027 -17.831 81 HA ARG 11 HA ARG 11 2.621 13.847 -17.410 82 HB2 ARG 11 2HB ARG 11 1.244 13.151 -20.020 83 HB3 ARG 11 3HB ARG 11 2.939 13.570 -19.810 84 HG2 ARG 11 2HG ARG 11 1.601 11.051 -18.693 85 HG3 ARG 11 3HG ARG 11 2.491 11.164 -20.197 86 HD2 ARG 11 2HD ARG 11 3.996 10.215 -18.702 87 HD3 ARG 11 3HD ARG 11 4.535 11.892 -18.877 88 HE ARG 11 HE ARG 11 2.930 12.060 -16.680 89 HH11 ARG 11 1HH2 ARG 11 5.479 9.692 -17.250 90 HH12 ARG 11 2HH2 ARG 11 5.687 9.476 -15.515 91 HH21 ARG 11 2HH1 ARG 11 3.333 11.743 -14.597 92 HH22 ARG 11 1HH1 ARG 11 4.569 10.579 -14.104 93 H LEU 12 H LEU 12 1.571 15.644 -16.293 94 HA LEU 12 HA LEU 12 0.139 17.674 -17.725 95 HB2 LEU 12 2HB LEU 12 1.658 17.622 -15.095 96 HB3 LEU 12 3HB LEU 12 1.011 19.117 -15.747 97 HG LEU 12 HG LEU 12 -1.276 18.175 -15.765 98 HD11 LEU 12 1HD1 LEU 12 -1.744 16.160 -14.360 99 HD12 LEU 12 2HD1 LEU 12 -0.895 15.771 -15.852 100 HD13 LEU 12 3HD1 LEU 12 -0.001 15.816 -14.310 101 HD21 LEU 12 3HD2 LEU 12 -1.591 18.307 -13.328 102 HD22 LEU 12 1HD2 LEU 12 0.153 18.057 -13.075 103 HD23 LEU 12 2HD2 LEU 12 -0.436 19.529 -13.879 104 H GLY 13 H GLY 13 2.642 19.936 -19.001 105 HA2 GLY 13 HA2 GLY 13 -0.107 19.278 -19.235 106 HA3 GLY 13 HA3 GLY 13 0.109 20.292 -17.798 107 H ALA 14 H ALA 14 -0.542 22.680 -20.569 108 HA ALA 14 HA ALA 14 -1.992 20.506 -19.153 109 HB1 ALA 14 3HB ALA 14 -1.549 22.292 -17.487 110 HB2 ALA 14 1HB ALA 14 -2.301 23.484 -18.572 111 HB3 ALA 14 2HB ALA 14 -3.275 22.172 -17.874 112 H VAL 15 H VAL 15 -4.368 20.682 -19.497 113 HA VAL 15 HA VAL 15 -4.893 20.791 -22.333 114 HB VAL 15 HB VAL 15 -7.138 20.067 -21.812 115 HG11 VAL 15 1HG1 VAL 15 -6.671 17.966 -20.729 116 HG12 VAL 15 2HG1 VAL 15 -5.267 18.407 -21.715 117 HG13 VAL 15 3HG1 VAL 15 -5.214 18.611 -19.954 118 HG21 VAL 15 3HG2 VAL 15 -7.922 19.696 -19.501 119 HG22 VAL 15 1HG2 VAL 15 -6.486 20.513 -18.867 120 HG23 VAL 15 2HG2 VAL 15 -7.678 21.414 -19.826 121 H SER 16 H SER 16 -6.286 21.951 -23.541 122 HA SER 16 HA SER 16 -7.179 24.595 -22.489 123 HB2 SER 16 2HB SER 16 -6.663 25.531 -24.650 124 HB3 SER 16 3HB SER 16 -5.234 24.757 -23.963 125 HG SER 16 HG SER 16 -5.466 24.183 -26.147 126 H TYR 17 H TYR 17 -8.514 21.896 -22.857 127 HA TYR 17 HA TYR 17 -11.020 22.676 -24.263 128 HB2 TYR 17 2HB TYR 17 -10.816 20.434 -25.454 129 HB3 TYR 17 3HB TYR 17 -9.739 21.730 -25.945 130 HD1 TYR 17 HD2 TYR 17 -9.846 18.576 -23.913 131 HD2 TYR 17 HD1 TYR 17 -7.389 21.513 -25.892 132 HE1 TYR 17 HE2 TYR 17 -7.829 17.131 -23.580 133 HE2 TYR 17 HE1 TYR 17 -5.377 20.121 -25.492 134 HH TYR 17 HH TYR 17 -4.574 18.115 -24.709 135 H GLU 18 H GLU 18 -10.089 22.058 -21.496 136 HA GLU 18 HA GLU 18 -10.695 20.977 -19.581 137 HB2 GLU 18 2HB GLU 18 -12.660 22.438 -20.405 138 HB3 GLU 18 3HB GLU 18 -13.500 20.920 -20.718 139 HG2 GLU 18 2HG GLU 18 -13.195 20.319 -18.286 140 HG3 GLU 18 3HG GLU 18 -12.346 21.843 -18.041 141 H THR 19 H THR 19 -9.591 19.158 -21.307 142 HA THR 19 HA THR 19 -9.240 16.982 -21.707 143 HB THR 19 HB THR 19 -10.791 16.144 -19.275 144 HG1 THR 19 HG1 THR 19 -9.098 16.845 -18.006 145 HG21 THR 19 1HG2 THR 19 -8.010 15.440 -20.347 146 HG22 THR 19 2HG2 THR 19 -8.774 14.745 -18.900 147 HG23 THR 19 3HG2 THR 19 -9.452 14.416 -20.494 148 H ASP 20 H ASP 20 -11.854 18.144 -22.758 149 HA ASP 20 HA ASP 20 -13.596 15.865 -23.158 150 HB2 ASP 20 2HB ASP 20 -14.293 18.262 -23.313 151 HB3 ASP 20 3HB ASP 20 -13.325 18.420 -24.783 152 H ARG 21 H ARG 21 -13.920 14.684 -25.138 153 HA ARG 21 HA ARG 21 -11.500 13.726 -26.389 154 HB2 ARG 21 2HB ARG 21 -14.435 13.270 -27.082 155 HB3 ARG 21 3HB ARG 21 -13.074 12.396 -27.800 156 HG2 ARG 21 2HG ARG 21 -12.404 11.574 -25.546 157 HG3 ARG 21 3HG ARG 21 -13.814 12.383 -24.839 158 HD2 ARG 21 2HD ARG 21 -15.316 11.033 -26.270 159 HD3 ARG 21 3HD ARG 21 -13.927 10.201 -26.969 160 HE ARG 21 HE ARG 21 -15.117 9.817 -24.306 161 HH11 ARG 21 1HH1 ARG 21 -12.266 9.109 -26.227 162 HH12 ARG 21 2HH1 ARG 21 -11.800 7.782 -25.198 163 HH21 ARG 21 1HH2 ARG 21 -14.458 8.122 -23.045 164 HH22 ARG 21 2HH2 ARG 21 -13.011 7.245 -23.447 165 H ASN 22 H ASN 22 -13.631 16.313 -27.268 166 HA ASN 22 HA ASN 22 -13.669 17.789 -28.960 167 HB2 ASN 22 2HB ASN 22 -11.530 18.121 -27.584 168 HB3 ASN 22 3HB ASN 22 -10.652 17.484 -28.972 169 HD21 ASN 22 2HD2 ASN 22 -11.377 18.666 -31.152 170 HD22 ASN 22 1HD2 ASN 22 -11.485 20.420 -30.997 171 H HIS 23 H HIS 23 -14.608 15.703 -30.162 172 HA HIS 23 HA HIS 23 -13.216 14.845 -32.544 173 HB2 HIS 23 2HB HIS 23 -16.197 14.919 -31.934 174 HB3 HIS 23 3HB HIS 23 -15.437 14.051 -33.266 175 HD2 HIS 23 HD2 HIS 23 -13.633 12.019 -32.485 176 HE1 HIS 23 HE1 HIS 23 -15.672 11.259 -28.816 177 HE2 HIS 23 HE2 HIS 23 -13.969 10.344 -30.478 178 H ASP 24 H ASP 24 -13.197 15.632 -34.571 179 HA ASP 24 HA ASP 24 -13.031 17.163 -36.206 180 HB2 ASP 24 2HB ASP 24 -15.797 18.076 -35.355 181 HB3 ASP 24 3HB ASP 24 -14.995 18.476 -36.863 182 H LEU 25 H LEU 25 -13.236 19.629 -36.793 183 HA LEU 25 HA LEU 25 -12.237 21.289 -34.529 184 HB2 LEU 25 2HB LEU 25 -10.957 20.955 -37.268 185 HB3 LEU 25 3HB LEU 25 -10.529 22.226 -36.128 186 HG LEU 25 HG LEU 25 -10.198 19.243 -35.573 187 HD11 LEU 25 1HD1 LEU 25 -8.713 20.033 -37.373 188 HD12 LEU 25 2HD1 LEU 25 -8.142 21.359 -36.333 189 HD13 LEU 25 3HD1 LEU 25 -7.801 19.667 -35.900 190 HD21 LEU 25 3HD2 LEU 25 -9.201 21.704 -34.060 191 HD22 LEU 25 1HD2 LEU 25 -10.421 20.544 -33.486 192 HD23 LEU 25 2HD2 LEU 25 -8.751 20.020 -33.707 193 H ALA 26 H ALA 26 -12.815 23.357 -34.515 194 HA ALA 26 HA ALA 26 -13.892 24.758 -36.828 195 HB1 ALA 26 3HB ALA 26 -15.625 24.235 -34.360 196 HB2 ALA 26 1HB ALA 26 -16.044 25.321 -35.700 197 HB3 ALA 26 2HB ALA 26 -15.908 23.578 -35.988 198 HA PRO 27 HA PRO 27 -12.133 28.155 -34.489 199 HB2 PRO 27 2HB PRO 27 -14.305 29.988 -35.388 200 HB3 PRO 27 3HB PRO 27 -12.543 30.103 -35.656 201 HG2 PRO 27 2HG PRO 27 -14.234 29.398 -37.679 202 HG3 PRO 27 3HG PRO 27 -12.632 28.606 -37.496 203 HD2 PRO 27 2HD PRO 27 -15.318 27.634 -36.463 204 HD3 PRO 27 3HD PRO 27 -14.126 26.749 -37.480 205 H ARG 28 H ARG 28 -12.390 29.326 -32.619 206 HA ARG 28 HA ARG 28 -14.975 29.348 -31.193 207 HB2 ARG 28 2HB ARG 28 -14.128 28.262 -29.233 208 HB3 ARG 28 3HB ARG 28 -13.901 27.239 -30.655 209 HG2 ARG 28 2HG ARG 28 -11.508 27.768 -30.727 210 HG3 ARG 28 3HG ARG 28 -11.700 28.892 -29.364 211 HD2 ARG 28 2HD ARG 28 -12.535 27.012 -27.963 212 HD3 ARG 28 3HD ARG 28 -12.263 25.894 -29.311 213 HE ARG 28 HE ARG 28 -9.796 27.044 -28.997 214 HH11 ARG 28 1HH2 ARG 28 -11.891 25.374 -26.707 215 HH12 ARG 28 2HH2 ARG 28 -10.518 24.954 -25.689 216 HH21 ARG 28 1HH1 ARG 28 -8.134 26.342 -27.632 217 HH22 ARG 28 2HH1 ARG 28 -8.562 25.403 -26.213 218 H GLN 29 H GLN 29 -14.971 30.454 -29.170 219 HA GLN 29 HA GLN 29 -13.386 32.995 -29.134 220 HB2 GLN 29 2HB GLN 29 -16.390 32.720 -28.748 221 HB3 GLN 29 3HB GLN 29 -15.458 34.213 -28.750 222 HG2 GLN 29 2HG GLN 29 -15.694 34.440 -30.981 223 HG3 GLN 29 3HG GLN 29 -15.083 32.813 -31.286 224 HE21 GLN 29 1HE2 GLN 29 -16.826 31.108 -30.218 225 HE22 GLN 29 2HE2 GLN 29 -18.410 31.298 -30.974 226 H ILE 30 H ILE 30 -12.258 32.514 -27.269 227 HA ILE 30 HA ILE 30 -13.578 31.608 -24.825 228 HB ILE 30 HB ILE 30 -10.739 32.545 -25.348 229 HG12 ILE 30 2HG1 ILE 30 -10.156 30.177 -24.986 230 HG13 ILE 30 3HG1 ILE 30 -11.866 29.770 -24.832 231 HG21 ILE 30 1HG2 ILE 30 -10.269 31.539 -23.097 232 HG22 ILE 30 2HG2 ILE 30 -11.328 32.938 -22.983 233 HG23 ILE 30 3HG2 ILE 30 -12.013 31.303 -22.856 234 HD11 ILE 30 3HD1 ILE 30 -10.722 29.133 -26.985 235 HD12 ILE 30 1HD1 ILE 30 -12.241 30.013 -27.156 236 HD13 ILE 30 2HD1 ILE 30 -10.678 30.859 -27.395 237 H ALA 31 H ALA 31 -14.947 32.951 -23.927 238 HA ALA 31 HA ALA 31 -14.197 35.792 -23.391 239 HB1 ALA 31 3HB ALA 31 -16.566 35.897 -22.543 240 HB2 ALA 31 1HB ALA 31 -16.410 35.576 -24.276 241 HB3 ALA 31 2HB ALA 31 -16.810 34.247 -23.158 242 H ARG 32 H ARG 32 -14.519 36.566 -21.199 243 HA ARG 32 HA ARG 32 -14.105 34.532 -19.036 244 HB2 ARG 32 2HB ARG 32 -12.770 37.187 -19.507 245 HB3 ARG 32 3HB ARG 32 -13.124 36.722 -17.841 246 HG2 ARG 32 2HG ARG 32 -11.810 34.761 -17.934 247 HG3 ARG 32 3HG ARG 32 -11.716 34.789 -19.697 248 HD2 ARG 32 2HD ARG 32 -9.610 35.494 -18.926 249 HD3 ARG 32 3HD ARG 32 -10.420 36.944 -19.537 250 HE ARG 32 HE ARG 32 -11.002 37.098 -16.864 251 HH11 ARG 32 2HH2 ARG 32 -7.899 36.657 -18.482 252 HH12 ARG 32 1HH2 ARG 32 -7.056 37.552 -17.232 253 HH21 ARG 32 2HH1 ARG 32 -9.918 38.146 -15.409 254 HH22 ARG 32 1HH1 ARG 32 -8.165 38.387 -15.505 255 H TYR 33 H TYR 33 -15.174 34.816 -17.121 256 HA TYR 33 HA TYR 33 -17.187 36.976 -16.966 257 HB2 TYR 33 2HB TYR 33 -17.823 34.036 -16.562 258 HB3 TYR 33 3HB TYR 33 -18.884 35.360 -16.175 259 HD1 TYR 33 HD2 TYR 33 -17.141 33.680 -19.035 260 HD2 TYR 33 HD1 TYR 33 -20.350 36.235 -17.756 261 HE1 TYR 33 HE2 TYR 33 -18.191 33.509 -21.290 262 HE2 TYR 33 HE1 TYR 33 -21.372 36.102 -20.019 263 HH TYR 33 HH TYR 33 -21.295 35.163 -22.034 264 H ARG 34 H ARG 34 -17.562 37.706 -14.958 265 HA ARG 34 HA ARG 34 -15.940 36.619 -12.700 266 HB2 ARG 34 2HB ARG 34 -15.420 38.903 -13.565 267 HB3 ARG 34 3HB ARG 34 -17.048 39.430 -13.152 268 HG2 ARG 34 2HG ARG 34 -16.644 39.332 -10.836 269 HG3 ARG 34 3HG ARG 34 -15.361 38.130 -11.013 270 HD2 ARG 34 2HD ARG 34 -14.375 40.228 -10.361 271 HD3 ARG 34 3HD ARG 34 -13.855 39.776 -11.967 272 HE ARG 34 HE ARG 34 -16.052 41.762 -11.535 273 HH11 ARG 34 1HH1 ARG 34 -12.940 41.051 -13.119 274 HH12 ARG 34 2HH1 ARG 34 -12.869 42.665 -13.768 275 HH21 ARG 34 1HH2 ARG 34 -15.857 43.738 -12.488 276 HH22 ARG 34 2HH2 ARG 34 -14.471 44.108 -13.468 277 H THR 35 H THR 35 -16.886 35.758 -11.030 278 HA THR 35 HA THR 35 -19.790 35.555 -10.807 279 HB THR 35 HB THR 35 -19.385 34.129 -8.869 280 HG1 THR 35 HG1 THR 35 -16.662 34.531 -9.357 281 HG21 THR 35 1HG2 THR 35 -17.560 33.449 -11.196 282 HG22 THR 35 2HG2 THR 35 -18.114 32.358 -9.914 283 HG23 THR 35 3HG2 THR 35 -19.291 33.074 -11.035 284 H ASP 36 H ASP 36 -20.595 35.697 -8.352 285 HA ASP 36 HA ASP 36 -20.452 38.502 -7.748 286 HB2 ASP 36 2HB ASP 36 -22.521 37.095 -7.620 287 HB3 ASP 36 3HB ASP 36 -21.833 36.249 -6.232 288 H ASN 37 H ASN 37 -18.520 35.845 -6.605 289 HA ASN 37 HA ASN 37 -17.693 37.406 -4.206 290 HB2 ASN 37 2HB ASN 37 -16.301 34.942 -5.086 291 HB3 ASN 37 3HB ASN 37 -16.418 35.644 -3.511 292 HD21 ASN 37 1HD2 ASN 37 -16.909 32.951 -4.500 293 HD22 ASN 37 2HD2 ASN 37 -18.521 32.553 -3.857 294 H GLY 38 H GLY 38 -17.121 37.795 -7.418 295 HA2 GLY 38 HA2 GLY 38 -15.475 39.007 -8.550 296 HA3 GLY 38 HA3 GLY 38 -14.379 38.884 -7.172 297 H GLU 39 H GLU 39 -15.616 35.794 -7.824 298 HA GLU 39 HA GLU 39 -12.971 34.914 -8.669 299 HB2 GLU 39 2HB GLU 39 -15.386 33.118 -8.815 300 HB3 GLU 39 3HB GLU 39 -13.723 32.729 -8.477 301 HG2 GLU 39 2HG GLU 39 -14.269 34.330 -6.330 302 HG3 GLU 39 3HG GLU 39 -15.915 33.815 -6.771 303 H GLU 40 H GLU 40 -12.258 35.087 -10.721 304 HA GLU 40 HA GLU 40 -14.210 35.168 -12.959 305 HB2 GLU 40 2HB GLU 40 -11.350 36.079 -12.648 306 HB3 GLU 40 3HB GLU 40 -12.011 35.723 -14.251 307 HG2 GLU 40 2HG GLU 40 -13.915 37.238 -13.811 308 HG3 GLU 40 3HG GLU 40 -13.195 37.672 -12.254 309 H PHE 41 H PHE 41 -14.454 33.757 -14.452 310 HA PHE 41 HA PHE 41 -12.530 31.500 -14.831 311 HB2 PHE 41 2HB PHE 41 -15.553 31.381 -14.776 312 HB3 PHE 41 3HB PHE 41 -14.519 30.070 -15.246 313 HD1 PHE 41 HD2 PHE 41 -15.600 32.129 -12.264 314 HD2 PHE 41 HD1 PHE 41 -13.320 28.717 -13.660 315 HE1 PHE 41 HE2 PHE 41 -15.274 31.380 -9.979 316 HE2 PHE 41 HE1 PHE 41 -12.979 27.999 -11.316 317 HZ PHE 41 HZ PHE 41 -13.943 29.337 -9.456 318 H GLU 42 H GLU 42 -12.629 30.501 -16.846 319 HA GLU 42 HA GLU 42 -13.249 32.361 -19.082 320 HB2 GLU 42 2HB GLU 42 -11.292 30.076 -19.304 321 HB3 GLU 42 3HB GLU 42 -11.425 31.559 -20.235 322 HG2 GLU 42 2HG GLU 42 -9.628 32.152 -19.023 323 HG3 GLU 42 3HG GLU 42 -10.819 32.678 -17.849 324 H VAL 43 H VAL 43 -14.659 31.815 -20.612 325 HA VAL 43 HA VAL 43 -15.617 28.972 -20.815 326 HB VAL 43 HB VAL 43 -17.278 31.450 -21.251 327 HG11 VAL 43 1HG1 VAL 43 -17.985 29.431 -22.541 328 HG12 VAL 43 2HG1 VAL 43 -18.064 28.519 -21.017 329 HG13 VAL 43 3HG1 VAL 43 -19.138 29.909 -21.308 330 HG21 VAL 43 3HG2 VAL 43 -17.346 29.550 -18.879 331 HG22 VAL 43 1HG2 VAL 43 -16.668 31.194 -18.835 332 HG23 VAL 43 2HG2 VAL 43 -18.371 30.980 -19.175 333 HA PRO 44 HA PRO 44 -14.413 29.666 -25.155 334 HB2 PRO 44 2HB PRO 44 -14.487 26.703 -25.265 335 HB3 PRO 44 3HB PRO 44 -13.188 27.821 -25.752 336 HG2 PRO 44 2HG PRO 44 -13.016 26.274 -23.486 337 HG3 PRO 44 3HG PRO 44 -12.334 27.928 -23.551 338 HD2 PRO 44 2HD PRO 44 -14.983 27.041 -22.384 339 HD3 PRO 44 3HD PRO 44 -13.759 28.183 -21.731 340 H PHE 45 H PHE 45 -15.980 30.214 -26.433 341 HA PHE 45 HA PHE 45 -18.457 28.571 -26.817 342 HB2 PHE 45 2HB PHE 45 -17.749 31.454 -27.407 343 HB3 PHE 45 3HB PHE 45 -19.145 30.702 -28.112 344 HD1 PHE 45 HD2 PHE 45 -17.567 31.794 -24.915 345 HD2 PHE 45 HD1 PHE 45 -21.134 30.217 -26.776 346 HE1 PHE 45 HE2 PHE 45 -18.861 32.262 -22.864 347 HE2 PHE 45 HE1 PHE 45 -22.419 30.693 -24.695 348 HZ PHE 45 HZ PHE 45 -21.262 31.712 -22.728 349 H ALA 46 H ALA 46 -19.012 27.806 -28.835 350 HA ALA 46 HA ALA 46 -16.846 27.560 -30.842 351 HB1 ALA 46 3HB ALA 46 -19.642 26.343 -30.741 352 HB2 ALA 46 1HB ALA 46 -18.360 25.942 -31.905 353 HB3 ALA 46 2HB ALA 46 -18.143 25.559 -30.189 354 H ASP 47 H ASP 47 -17.228 28.090 -33.107 355 HA ASP 47 HA ASP 47 -18.242 30.662 -33.610 356 HB2 ASP 47 2HB ASP 47 -16.546 29.464 -34.946 357 HB3 ASP 47 3HB ASP 47 -17.778 28.352 -35.539 358 H ASP 48 H ASP 48 -20.029 27.693 -33.476 359 HA ASP 48 HA ASP 48 -22.395 28.535 -34.951 360 HB2 ASP 48 2HB ASP 48 -21.667 26.174 -34.550 361 HB3 ASP 48 3HB ASP 48 -22.025 26.385 -32.838 362 H ALA 49 H ALA 49 -21.127 29.430 -31.915 363 HA ALA 49 HA ALA 49 -23.756 30.409 -30.873 364 HB1 ALA 49 3HB ALA 49 -22.857 30.042 -28.629 365 HB2 ALA 49 1HB ALA 49 -22.836 28.528 -29.552 366 HB3 ALA 49 2HB ALA 49 -21.329 29.444 -29.310 367 H GLU 50 H GLU 50 -23.644 32.333 -29.545 368 HA GLU 50 HA GLU 50 -21.263 34.087 -29.896 369 HB2 GLU 50 2HB GLU 50 -24.149 34.840 -30.466 370 HB3 GLU 50 3HB GLU 50 -22.905 36.034 -30.070 371 HG2 GLU 50 2HG GLU 50 -21.539 35.334 -31.975 372 HG3 GLU 50 3HG GLU 50 -22.700 34.071 -32.378 373 H ILE 51 H ILE 51 -20.732 35.240 -28.216 374 HA ILE 51 HA ILE 51 -21.157 34.395 -25.653 375 HB ILE 51 HB ILE 51 -20.275 37.220 -26.260 376 HG12 ILE 51 2HG1 ILE 51 -19.071 35.817 -27.854 377 HG13 ILE 51 3HG1 ILE 51 -18.006 36.484 -26.624 378 HG21 ILE 51 1HG2 ILE 51 -19.409 35.230 -24.117 379 HG22 ILE 51 2HG2 ILE 51 -18.826 36.877 -24.324 380 HG23 ILE 51 3HG2 ILE 51 -20.505 36.592 -23.843 381 HD11 ILE 51 3HD1 ILE 51 -19.047 33.628 -26.742 382 HD12 ILE 51 1HD1 ILE 51 -17.419 34.177 -27.174 383 HD13 ILE 51 2HD1 ILE 51 -17.943 34.266 -25.494 384 HA PRO 52 HA PRO 52 -24.961 36.682 -24.562 385 HB2 PRO 52 2HB PRO 52 -25.580 35.171 -22.383 386 HB3 PRO 52 3HB PRO 52 -25.938 34.644 -24.058 387 HG2 PRO 52 2HG PRO 52 -23.644 33.834 -22.266 388 HG3 PRO 52 3HG PRO 52 -24.646 32.805 -23.349 389 HD2 PRO 52 2HD PRO 52 -22.132 33.843 -23.980 390 HD3 PRO 52 3HD PRO 52 -23.327 33.384 -25.200 391 H GLY 53 H GLY 53 -25.234 38.225 -22.975 392 HA2 GLY 53 HA2 GLY 53 -23.140 39.587 -21.818 393 HA3 GLY 53 HA3 GLY 53 -24.807 39.674 -21.243 394 H THR 54 H THR 54 -24.816 36.826 -20.317 395 HA THR 54 HA THR 54 -22.643 36.729 -18.367 396 HB THR 54 HB THR 54 -24.247 36.117 -16.508 397 HG1 THR 54 HG1 THR 54 -26.286 36.963 -18.304 398 HG21 THR 54 1HG2 THR 54 -23.716 38.535 -16.714 399 HG22 THR 54 2HG2 THR 54 -25.165 38.769 -17.692 400 HG23 THR 54 3HG2 THR 54 -25.298 38.229 -16.001 401 H TRP 55 H TRP 55 -22.449 34.612 -17.249 402 HA TRP 55 HA TRP 55 -23.757 32.282 -18.452 403 HB2 TRP 55 2HB TRP 55 -21.937 33.004 -20.070 404 HB3 TRP 55 3HB TRP 55 -20.768 32.674 -18.802 405 HD1 TRP 55 HD1 TRP 55 -20.181 30.188 -18.287 406 HE1 TRP 55 HE1 TRP 55 -20.473 28.010 -19.580 407 HE3 TRP 55 HE3 TRP 55 -23.796 31.697 -21.546 408 HZ2 TRP 55 HZ2 TRP 55 -22.231 26.970 -21.647 409 HZ3 TRP 55 HZ3 TRP 55 -24.814 30.080 -23.150 410 HH2 TRP 55 HH2 TRP 55 -24.031 27.722 -23.212 411 H LEU 56 H LEU 56 -23.445 30.353 -17.213 412 HA LEU 56 HA LEU 56 -22.781 30.787 -14.445 413 HB2 LEU 56 2HB LEU 56 -24.386 29.020 -15.866 414 HB3 LEU 56 3HB LEU 56 -23.051 27.994 -15.337 415 HG LEU 56 HG LEU 56 -24.672 29.774 -13.475 416 HD11 LEU 56 1HD1 LEU 56 -26.115 28.059 -14.501 417 HD12 LEU 56 2HD1 LEU 56 -24.959 26.791 -14.036 418 HD13 LEU 56 3HD1 LEU 56 -25.835 27.709 -12.788 419 HD21 LEU 56 3HD2 LEU 56 -23.755 28.290 -11.708 420 HD22 LEU 56 1HD2 LEU 56 -22.783 27.438 -12.933 421 HD23 LEU 56 2HD2 LEU 56 -22.468 29.141 -12.565 422 H CYS 57 H CYS 57 -20.940 30.530 -13.399 423 HA CYS 57 HA CYS 57 -18.539 29.554 -14.853 424 HB2 CYS 57 2HB CYS 57 -18.969 31.314 -12.414 425 HB3 CYS 57 3HB CYS 57 -17.378 30.751 -12.944 426 HG CYS 57 HG CYS 57 -19.615 32.265 -14.859 427 H ARG 58 H ARG 58 -16.863 28.409 -13.639 428 HA ARG 58 HA ARG 58 -17.937 25.954 -12.639 429 HB2 ARG 58 2HB ARG 58 -15.029 26.845 -12.548 430 HB3 ARG 58 3HB ARG 58 -15.638 25.194 -12.459 431 HG2 ARG 58 2HG ARG 58 -16.558 25.432 -14.778 432 HG3 ARG 58 3HG ARG 58 -15.834 27.052 -14.864 433 HD2 ARG 58 2HD ARG 58 -13.577 26.044 -14.479 434 HD3 ARG 58 3HD ARG 58 -14.320 24.443 -14.450 435 HE ARG 58 HE ARG 58 -14.460 24.453 -16.774 436 HH11 ARG 58 1HH1 ARG 58 -13.789 27.796 -15.877 437 HH12 ARG 58 2HH1 ARG 58 -13.772 28.264 -17.575 438 HH21 ARG 58 2HH2 ARG 58 -14.286 25.107 -18.739 439 HH22 ARG 58 1HH2 ARG 58 -13.988 26.817 -19.139 440 H ASN 59 H ASN 59 -17.152 28.779 -10.869 441 HA ASN 59 HA ASN 59 -16.803 27.608 -8.281 442 HB2 ASN 59 2HB ASN 59 -16.226 29.885 -8.766 443 HB3 ASN 59 3HB ASN 59 -17.893 30.275 -9.213 444 HD21 ASN 59 1HD2 ASN 59 -17.890 32.031 -7.730 445 HD22 ASN 59 2HD2 ASN 59 -17.896 31.744 -6.000 446 H GLY 60 H GLY 60 -19.560 27.824 -10.353 447 HA2 GLY 60 HA2 GLY 60 -21.648 26.775 -10.068 448 HA3 GLY 60 HA3 GLY 60 -21.445 26.765 -8.314 449 H MET 61 H MET 61 -20.660 29.779 -9.840 450 HA MET 61 HA MET 61 -23.309 30.935 -9.123 451 HB2 MET 61 2HB MET 61 -21.364 31.540 -7.611 452 HB3 MET 61 3HB MET 61 -20.601 32.320 -8.974 453 HG2 MET 61 2HG MET 61 -21.805 33.911 -7.514 454 HG3 MET 61 3HG MET 61 -22.395 33.934 -9.174 455 HE1 MET 61 3HE MET 61 -24.042 35.346 -6.814 456 HE2 MET 61 1HE MET 61 -24.486 35.293 -8.538 457 HE3 MET 61 2HE MET 61 -25.669 34.832 -7.295 458 H GLU 62 H GLU 62 -24.159 32.547 -10.446 459 HA GLU 62 HA GLU 62 -23.560 32.449 -13.279 460 HB2 GLU 62 2HB GLU 62 -25.304 34.311 -11.627 461 HB3 GLU 62 3HB GLU 62 -25.176 34.350 -13.394 462 HG2 GLU 62 2HG GLU 62 -25.950 31.998 -13.515 463 HG3 GLU 62 3HG GLU 62 -26.113 31.951 -11.758 464 H GLY 63 H GLY 63 -21.763 33.244 -14.112 465 HA2 GLY 63 HA2 GLY 63 -20.339 35.529 -12.949 466 HA3 GLY 63 HA3 GLY 63 -19.790 34.530 -14.275 467 H THR 64 H THR 64 -20.065 37.519 -14.011 468 HA THR 64 HA THR 64 -21.742 37.986 -16.440 469 HB THR 64 HB THR 64 -20.607 40.024 -14.493 470 HG1 THR 64 HG1 THR 64 -22.284 38.816 -13.586 471 HG21 THR 64 1HG2 THR 64 -22.316 41.558 -15.603 472 HG22 THR 64 2HG2 THR 64 -20.924 41.137 -16.604 473 HG23 THR 64 3HG2 THR 64 -22.482 40.339 -16.886 474 H LEU 65 H LEU 65 -20.936 38.846 -18.275 475 HA LEU 65 HA LEU 65 -18.306 38.178 -18.989 476 HB2 LEU 65 2HB LEU 65 -20.357 38.323 -20.418 477 HB3 LEU 65 3HB LEU 65 -20.299 40.076 -20.296 478 HG LEU 65 HG LEU 65 -17.952 39.880 -21.429 479 HD11 LEU 65 1HD1 LEU 65 -18.971 37.093 -21.980 480 HD12 LEU 65 2HD1 LEU 65 -17.557 37.893 -22.729 481 HD13 LEU 65 3HD1 LEU 65 -17.565 37.515 -21.007 482 HD21 LEU 65 3HD2 LEU 65 -18.960 39.614 -23.669 483 HD22 LEU 65 1HD2 LEU 65 -20.428 38.928 -22.935 484 HD23 LEU 65 2HD2 LEU 65 -19.982 40.621 -22.632 485 H ILE 66 H ILE 66 -16.411 39.145 -18.682 486 HA ILE 66 HA ILE 66 -16.209 42.108 -18.532 487 HB ILE 66 HB ILE 66 -14.616 42.081 -16.795 488 HG12 ILE 66 2HG1 ILE 66 -13.345 40.094 -17.010 489 HG13 ILE 66 3HG1 ILE 66 -14.083 40.054 -15.408 490 HG21 ILE 66 1HG2 ILE 66 -16.994 42.154 -16.147 491 HG22 ILE 66 2HG2 ILE 66 -16.950 40.404 -15.853 492 HG23 ILE 66 3HG2 ILE 66 -15.949 41.479 -14.883 493 HD11 ILE 66 3HD1 ILE 66 -14.199 37.892 -16.180 494 HD12 ILE 66 1HD1 ILE 66 -15.835 38.533 -16.450 495 HD13 ILE 66 2HD1 ILE 66 -14.663 38.427 -17.801 496 H GLU 67 H GLU 67 -14.150 42.993 -19.124 497 HA GLU 67 HA GLU 67 -12.387 41.222 -20.749 498 HB2 GLU 67 2HB GLU 67 -13.697 43.814 -21.667 499 HB3 GLU 67 3HB GLU 67 -12.354 43.014 -22.485 500 HG2 GLU 67 2HG GLU 67 -13.772 40.980 -22.798 501 HG3 GLU 67 3HG GLU 67 -15.135 41.838 -22.071 502 H GLY 68 H GLY 68 -10.308 41.636 -20.577 503 HA2 GLY 68 HA2 GLY 68 -8.584 43.251 -21.035 504 HA3 GLY 68 HA3 GLY 68 -9.381 44.420 -19.994 505 H ASP 69 H ASP 69 -9.564 41.849 -18.057 506 HA ASP 69 HA ASP 69 -8.554 40.989 -16.347 507 HB2 ASP 69 2HB ASP 69 -6.779 40.471 -18.257 508 HB3 ASP 69 3HB ASP 69 -5.753 41.513 -17.274 509 H LEU 70 H LEU 70 -7.405 41.295 -14.482 510 HA LEU 70 HA LEU 70 -7.455 44.003 -13.364 511 HB2 LEU 70 2HB LEU 70 -6.884 41.244 -12.276 512 HB3 LEU 70 3HB LEU 70 -6.411 42.668 -11.366 513 HG LEU 70 HG LEU 70 -8.701 43.496 -11.288 514 HD11 LEU 70 1HD1 LEU 70 -9.718 42.566 -13.300 515 HD12 LEU 70 2HD1 LEU 70 -9.453 40.908 -12.709 516 HD13 LEU 70 3HD1 LEU 70 -10.595 41.988 -11.884 517 HD21 LEU 70 3HD2 LEU 70 -8.428 40.601 -10.380 518 HD22 LEU 70 1HD2 LEU 70 -7.826 42.027 -9.507 519 HD23 LEU 70 2HD2 LEU 70 -9.566 41.802 -9.731 520 HA PRO 71 HA PRO 71 -3.120 44.979 -13.949 521 HB2 PRO 71 2HB PRO 71 -3.201 46.323 -11.256 522 HB3 PRO 71 3HB PRO 71 -2.700 46.987 -12.842 523 HG2 PRO 71 2HG PRO 71 -5.100 47.632 -11.775 524 HG3 PRO 71 3HG PRO 71 -4.985 47.229 -13.523 525 HD2 PRO 71 2HD PRO 71 -5.775 45.390 -11.230 526 HD3 PRO 71 3HD PRO 71 -6.635 45.725 -12.762 527 H GLU 72 H GLU 72 -3.501 42.360 -12.749 528 HA GLU 72 HA GLU 72 -2.952 40.852 -11.106 529 HB2 GLU 72 2HB GLU 72 -0.373 41.860 -12.282 530 HB3 GLU 72 3HB GLU 72 -0.462 40.407 -11.254 531 HG2 GLU 72 2HG GLU 72 -2.096 39.407 -12.830 532 HG3 GLU 72 3HG GLU 72 -1.957 40.822 -13.876 533 HA PRO 73 HA PRO 73 -2.045 43.887 -7.664 534 HB2 PRO 73 2HB PRO 73 -4.389 43.710 -6.260 535 HB3 PRO 73 3HB PRO 73 -4.153 44.808 -7.656 536 HG2 PRO 73 2HG PRO 73 -5.430 42.053 -7.654 537 HG3 PRO 73 3HG PRO 73 -6.049 43.566 -8.391 538 HD2 PRO 73 2HD PRO 73 -4.708 41.711 -9.854 539 HD3 PRO 73 3HD PRO 73 -4.509 43.464 -10.150 540 H LYS 74 H LYS 74 -1.200 43.325 -5.767 541 HA LYS 74 HA LYS 74 -1.564 40.772 -4.385 542 HB2 LYS 74 2HB LYS 74 0.757 39.965 -4.882 543 HB3 LYS 74 3HB LYS 74 -0.307 39.957 -6.280 544 HG2 LYS 74 2HG LYS 74 0.711 42.110 -7.055 545 HG3 LYS 74 3HG LYS 74 1.828 42.059 -5.686 546 HD2 LYS 74 2HD LYS 74 2.922 40.113 -6.512 547 HD3 LYS 74 3HD LYS 74 1.639 39.754 -7.676 548 HE2 LYS 74 2HE LYS 74 3.267 42.322 -7.801 549 HE3 LYS 74 3HE LYS 74 3.822 40.830 -8.568 550 HZ1 LYS 74 HZ1 LYS 74 2.525 42.298 -10.076 551 HZ2 LYS 74 HZ2 LYS 74 1.882 40.804 -9.948 552 HZ3 LYS 74 HZ3 LYS 74 1.173 42.053 -9.178 553 H LYS 75 H LYS 75 0.040 40.490 -2.642 554 HA LYS 75 HA LYS 75 1.413 42.950 -1.678 555 HB2 LYS 75 2HB LYS 75 -0.896 42.775 -0.629 556 HB3 LYS 75 3HB LYS 75 -0.389 41.240 0.089 557 HG2 LYS 75 2HG LYS 75 1.528 42.520 1.196 558 HG3 LYS 75 3HG LYS 75 0.796 44.011 0.584 559 HD2 LYS 75 2HD LYS 75 -1.281 43.474 1.870 560 HD3 LYS 75 3HD LYS 75 -0.510 41.978 2.449 561 HE2 LYS 75 2HE LYS 75 1.365 43.415 3.386 562 HE3 LYS 75 3HE LYS 75 0.397 44.842 2.985 563 HZ1 LYS 75 HZ1 LYS 75 0.023 44.172 5.277 564 HZ2 LYS 75 HZ2 LYS 75 -1.362 43.898 4.450 565 HZ3 LYS 75 HZ3 LYS 75 -0.370 42.644 4.838 566 H VAL 76 H VAL 76 3.345 42.555 -0.719 567 HA VAL 76 HA VAL 76 4.395 39.803 -0.629 568 HB VAL 76 HB VAL 76 6.519 40.829 0.073 569 HG11 VAL 76 1HG1 VAL 76 5.996 40.410 -2.304 570 HG12 VAL 76 2HG1 VAL 76 5.321 42.049 -2.450 571 HG13 VAL 76 3HG1 VAL 76 7.046 41.820 -2.094 572 HG21 VAL 76 3HG2 VAL 76 5.156 43.522 -0.388 573 HG22 VAL 76 1HG2 VAL 76 5.697 42.893 1.185 574 HG23 VAL 76 2HG2 VAL 76 6.878 43.239 -0.082 575 H LYS 77 H LYS 77 5.013 38.659 1.138 576 HA LYS 77 HA LYS 77 4.342 39.646 3.858 577 HB2 LYS 77 2HB LYS 77 3.393 36.971 2.755 578 HB3 LYS 77 3HB LYS 77 3.135 37.597 4.389 579 HG2 LYS 77 2HG LYS 77 1.851 39.531 3.364 580 HG3 LYS 77 3HG LYS 77 1.980 38.709 1.795 581 HD2 LYS 77 2HD LYS 77 0.813 36.715 2.803 582 HD3 LYS 77 3HD LYS 77 0.609 37.662 4.294 583 HE2 LYS 77 2HE LYS 77 -0.451 39.473 2.749 584 HE3 LYS 77 3HE LYS 77 -0.550 38.197 1.524 585 HZ1 LYS 77 HZ1 LYS 77 -1.780 38.212 4.221 586 HZ2 LYS 77 HZ2 LYS 77 -2.597 38.307 2.806 587 HZ3 LYS 77 HZ3 LYS 77 -1.853 36.904 3.215 588 HA PRO 78 HA PRO 78 4.571 38.214 6.241 589 HB2 PRO 78 2HB PRO 78 6.597 38.872 8.050 590 HB3 PRO 78 3HB PRO 78 6.059 37.208 7.675 591 HG2 PRO 78 2HG PRO 78 8.377 38.774 6.495 592 HG3 PRO 78 3HG PRO 78 8.396 37.115 7.188 593 HD2 PRO 78 2HD PRO 78 8.205 37.484 4.536 594 HD3 PRO 78 3HD PRO 78 7.202 36.238 5.332 595 HA PRO 79 HA PRO 79 4.753 39.569 8.641 596 HB2 PRO 79 2HB PRO 79 2.853 41.787 9.139 597 HB3 PRO 79 3HB PRO 79 4.197 41.175 10.142 598 HG2 PRO 79 2HG PRO 79 4.404 43.535 8.811 599 HG3 PRO 79 3HG PRO 79 5.801 42.405 8.880 600 HD2 PRO 79 2HD PRO 79 3.718 42.659 6.673 601 HD3 PRO 79 3HD PRO 79 5.496 42.739 6.537 602 H ARG 80 H ARG 80 1.951 40.978 6.842 603 HA ARG 80 HA ARG 80 0.252 38.610 7.479 604 HB2 ARG 80 2HB ARG 80 -0.301 41.472 8.382 605 HB3 ARG 80 3HB ARG 80 -1.500 40.179 8.367 606 HG2 ARG 80 2HG ARG 80 -0.066 38.849 9.930 607 HG3 ARG 80 3HG ARG 80 1.025 40.235 10.074 608 HD2 ARG 80 2HD ARG 80 -1.937 40.255 10.770 609 HD3 ARG 80 3HD ARG 80 -0.615 40.056 11.932 610 HE ARG 80 HE ARG 80 -0.075 42.433 10.530 611 HH11 ARG 80 1HH2 ARG 80 -2.559 41.319 12.733 612 HH12 ARG 80 2HH2 ARG 80 -2.885 42.927 13.320 613 HH21 ARG 80 1HH1 ARG 80 -0.547 44.453 11.319 614 HH22 ARG 80 2HH1 ARG 80 -1.773 44.646 12.538 Start of MODEL 27 1 H1 SER 1 1H SER 1 -21.850 1.412 -47.041 2 H2 SER 1 2H SER 1 -21.210 2.720 -47.799 3 H3 SER 1 3H SER 1 -22.739 2.249 -48.131 4 HA SER 1 HA SER 1 -23.475 2.770 -45.922 5 HB2 SER 1 2HB SER 1 -21.225 2.315 -44.876 6 HB3 SER 1 3HB SER 1 -20.690 3.903 -45.463 7 HG SER 1 HG SER 1 -21.525 3.927 -43.299 8 H MET 2 H MET 2 -24.002 5.024 -45.217 9 HA MET 2 HA MET 2 -24.322 6.755 -47.586 10 HB2 MET 2 2HB MET 2 -25.490 6.917 -44.786 11 HB3 MET 2 3HB MET 2 -25.853 8.031 -46.116 12 HG2 MET 2 2HG MET 2 -26.700 6.143 -47.472 13 HG3 MET 2 3HG MET 2 -26.396 5.041 -46.124 14 HE1 MET 2 3HE MET 2 -29.183 5.272 -47.636 15 HE2 MET 2 1HE MET 2 -28.878 4.160 -46.281 16 HE3 MET 2 2HE MET 2 -30.307 5.215 -46.261 17 H ALA 3 H ALA 3 -21.910 7.023 -47.564 18 HA ALA 3 HA ALA 3 -21.207 9.594 -46.264 19 HB1 ALA 3 3HB ALA 3 -19.004 8.706 -45.595 20 HB2 ALA 3 1HB ALA 3 -20.314 7.822 -44.791 21 HB3 ALA 3 2HB ALA 3 -19.467 7.090 -46.172 22 H ASP 4 H ASP 4 -19.414 10.683 -47.275 23 HA ASP 4 HA ASP 4 -18.521 9.871 -49.956 24 HB2 ASP 4 2HB ASP 4 -20.797 10.947 -50.237 25 HB3 ASP 4 3HB ASP 4 -20.149 12.412 -49.500 26 H ARG 5 H ARG 5 -17.045 11.677 -50.855 27 HA ARG 5 HA ARG 5 -15.132 12.519 -48.794 28 HB2 ARG 5 2HB ARG 5 -14.695 11.530 -51.191 29 HB3 ARG 5 3HB ARG 5 -14.968 13.172 -51.750 30 HG2 ARG 5 2HG ARG 5 -12.619 12.849 -51.554 31 HG3 ARG 5 3HG ARG 5 -13.055 13.912 -50.221 32 HD2 ARG 5 2HD ARG 5 -13.028 11.978 -48.664 33 HD3 ARG 5 3HD ARG 5 -12.648 10.890 -49.996 34 HE ARG 5 HE ARG 5 -10.855 12.799 -48.640 35 HH11 ARG 5 2HH1 ARG 5 -11.140 10.704 -51.440 36 HH12 ARG 5 1HH1 ARG 5 -9.416 10.667 -51.694 37 HH21 ARG 5 1HH2 ARG 5 -8.678 12.704 -49.025 38 HH22 ARG 5 2HH2 ARG 5 -8.066 11.772 -50.361 39 H VAL 6 H VAL 6 -17.817 13.781 -48.942 40 HA VAL 6 HA VAL 6 -17.017 16.585 -48.502 41 HB VAL 6 HB VAL 6 -19.451 15.844 -50.194 42 HG11 VAL 6 1HG1 VAL 6 -19.878 17.837 -48.819 43 HG12 VAL 6 2HG1 VAL 6 -18.339 18.560 -49.348 44 HG13 VAL 6 3HG1 VAL 6 -19.665 18.305 -50.501 45 HG21 VAL 6 3HG2 VAL 6 -17.442 15.656 -51.585 46 HG22 VAL 6 1HG2 VAL 6 -18.329 17.115 -52.019 47 HG23 VAL 6 2HG2 VAL 6 -16.866 17.240 -51.015 48 H LEU 7 H LEU 7 -18.145 17.452 -46.746 49 HA LEU 7 HA LEU 7 -19.288 15.561 -44.915 50 HB2 LEU 7 2HB LEU 7 -19.251 18.602 -44.819 51 HB3 LEU 7 3HB LEU 7 -19.676 17.549 -43.474 52 HG LEU 7 HG LEU 7 -16.937 17.685 -44.811 53 HD11 LEU 7 1HD1 LEU 7 -16.222 18.725 -42.716 54 HD12 LEU 7 2HD1 LEU 7 -17.508 19.680 -43.476 55 HD13 LEU 7 3HD1 LEU 7 -17.881 18.644 -42.079 56 HD21 LEU 7 3HD2 LEU 7 -17.298 15.432 -43.909 57 HD22 LEU 7 1HD2 LEU 7 -16.180 16.319 -42.873 58 HD23 LEU 7 2HD2 LEU 7 -17.871 16.115 -42.368 59 H ARG 8 H ARG 8 -21.304 15.204 -44.187 60 HA ARG 8 HA ARG 8 -23.602 15.966 -45.883 61 HB2 ARG 8 2HB ARG 8 -23.277 14.074 -43.517 62 HB3 ARG 8 3HB ARG 8 -24.837 14.435 -44.262 63 HG2 ARG 8 2HG ARG 8 -24.032 13.604 -46.448 64 HG3 ARG 8 3HG ARG 8 -22.442 13.269 -45.752 65 HD2 ARG 8 2HD ARG 8 -23.736 11.216 -45.927 66 HD3 ARG 8 3HD ARG 8 -23.411 11.608 -44.231 67 HE ARG 8 HE ARG 8 -25.982 12.633 -45.146 68 HH11 ARG 8 2HH1 ARG 8 -24.542 9.604 -44.140 69 HH12 ARG 8 1HH1 ARG 8 -25.972 9.116 -43.261 70 HH21 ARG 8 1HH2 ARG 8 -27.815 11.881 -44.135 71 HH22 ARG 8 2HH2 ARG 8 -27.801 10.324 -43.361 72 H GLY 9 H GLY 9 -25.596 16.739 -44.984 73 HA2 GLY 9 HA2 GLY 9 -26.903 18.207 -43.726 74 HA3 GLY 9 HA3 GLY 9 -25.640 18.282 -42.502 75 H SER 10 H SER 10 -26.316 20.571 -42.486 76 HA SER 10 HA SER 10 -24.610 22.249 -44.204 77 HB2 SER 10 2HB SER 10 -26.845 21.982 -45.383 78 HB3 SER 10 3HB SER 10 -27.590 22.824 -44.012 79 HG SER 10 HG SER 10 -27.000 24.222 -45.777 80 H ARG 11 H ARG 11 -24.812 24.588 -43.510 81 HA ARG 11 HA ARG 11 -25.324 24.972 -40.601 82 HB2 ARG 11 2HB ARG 11 -22.985 24.332 -40.819 83 HB3 ARG 11 3HB ARG 11 -22.686 25.591 -42.010 84 HG2 ARG 11 2HG ARG 11 -23.743 26.369 -39.276 85 HG3 ARG 11 3HG ARG 11 -22.060 25.868 -39.428 86 HD2 ARG 11 2HD ARG 11 -21.592 27.592 -41.063 87 HD3 ARG 11 3HD ARG 11 -23.276 28.079 -41.122 88 HE ARG 11 HE ARG 11 -23.126 29.063 -38.988 89 HH11 ARG 11 1HH2 ARG 11 -19.879 27.990 -40.027 90 HH12 ARG 11 2HH2 ARG 11 -19.174 28.929 -38.704 91 HH21 ARG 11 1HH1 ARG 11 -21.968 30.207 -37.431 92 HH22 ARG 11 2HH1 ARG 11 -20.217 30.047 -37.416 93 H LEU 12 H LEU 12 -25.983 26.993 -40.021 94 HA LEU 12 HA LEU 12 -27.318 28.471 -42.081 95 HB2 LEU 12 2HB LEU 12 -28.262 28.044 -39.857 96 HB3 LEU 12 3HB LEU 12 -26.980 28.996 -39.106 97 HG LEU 12 HG LEU 12 -27.829 31.044 -40.240 98 HD11 LEU 12 1HD1 LEU 12 -30.077 29.219 -41.207 99 HD12 LEU 12 2HD1 LEU 12 -30.086 30.994 -41.286 100 HD13 LEU 12 3HD1 LEU 12 -28.910 30.084 -42.234 101 HD21 LEU 12 3HD2 LEU 12 -29.950 29.509 -38.683 102 HD22 LEU 12 1HD2 LEU 12 -28.607 30.437 -37.978 103 HD23 LEU 12 2HD2 LEU 12 -29.870 31.273 -38.896 104 H GLY 13 H GLY 13 -26.592 30.057 -43.303 105 HA2 GLY 13 HA2 GLY 13 -25.820 32.110 -43.915 106 HA3 GLY 13 HA3 GLY 13 -25.454 32.430 -42.224 107 H ALA 14 H ALA 14 -23.577 29.798 -42.816 108 HA ALA 14 HA ALA 14 -21.324 31.077 -44.205 109 HB1 ALA 14 3HB ALA 14 -21.215 32.082 -41.943 110 HB2 ALA 14 1HB ALA 14 -21.238 30.466 -41.214 111 HB3 ALA 14 2HB ALA 14 -19.853 30.984 -42.198 112 H VAL 15 H VAL 15 -19.299 29.604 -43.880 113 HA VAL 15 HA VAL 15 -19.972 26.883 -44.699 114 HB VAL 15 HB VAL 15 -17.547 26.570 -44.934 115 HG11 VAL 15 1HG1 VAL 15 -18.878 27.533 -46.779 116 HG12 VAL 15 2HG1 VAL 15 -18.508 29.170 -46.194 117 HG13 VAL 15 3HG1 VAL 15 -17.205 28.115 -46.777 118 HG21 VAL 15 3HG2 VAL 15 -15.968 28.396 -44.636 119 HG22 VAL 15 1HG2 VAL 15 -17.240 29.464 -44.017 120 HG23 VAL 15 2HG2 VAL 15 -16.742 28.033 -43.088 121 H SER 16 H SER 16 -18.868 24.977 -43.793 122 HA SER 16 HA SER 16 -18.003 25.079 -40.992 123 HB2 SER 16 2HB SER 16 -20.484 24.695 -40.890 124 HB3 SER 16 3HB SER 16 -20.257 23.217 -41.837 125 HG SER 16 HG SER 16 -19.373 23.827 -39.203 126 H TYR 17 H TYR 17 -16.651 23.362 -40.437 127 HA TYR 17 HA TYR 17 -16.016 21.211 -42.313 128 HB2 TYR 17 2HB TYR 17 -13.569 21.961 -42.390 129 HB3 TYR 17 3HB TYR 17 -14.716 22.767 -43.429 130 HD1 TYR 17 HD1 TYR 17 -12.799 23.175 -40.234 131 HD2 TYR 17 HD2 TYR 17 -15.053 25.119 -43.358 132 HE1 TYR 17 HE1 TYR 17 -12.064 25.392 -39.385 133 HE2 TYR 17 HE2 TYR 17 -14.310 27.338 -42.510 134 HH TYR 17 HH TYR 17 -13.068 28.461 -40.949 135 H GLU 18 H GLU 18 -14.380 19.725 -41.475 136 HA GLU 18 HA GLU 18 -15.012 19.153 -38.726 137 HB2 GLU 18 2HB GLU 18 -14.918 17.520 -40.617 138 HB3 GLU 18 3HB GLU 18 -13.159 17.680 -40.641 139 HG2 GLU 18 2HG GLU 18 -12.992 16.688 -38.419 140 HG3 GLU 18 3HG GLU 18 -14.744 16.765 -38.204 141 H THR 19 H THR 19 -12.531 20.927 -39.996 142 HA THR 19 HA THR 19 -10.554 21.803 -39.264 143 HB THR 19 HB THR 19 -11.521 21.538 -36.416 144 HG1 THR 19 HG1 THR 19 -13.281 22.209 -37.683 145 HG21 THR 19 1HG2 THR 19 -9.336 22.754 -36.907 146 HG22 THR 19 2HG2 THR 19 -10.253 23.875 -37.928 147 HG23 THR 19 3HG2 THR 19 -10.584 23.767 -36.183 148 H ASP 20 H ASP 20 -10.242 19.084 -39.807 149 HA ASP 20 HA ASP 20 -8.778 17.801 -37.637 150 HB2 ASP 20 2HB ASP 20 -8.660 15.913 -39.072 151 HB3 ASP 20 3HB ASP 20 -10.277 16.585 -39.182 152 H ARG 21 H ARG 21 -7.684 20.290 -38.568 153 HA ARG 21 HA ARG 21 -4.830 19.569 -38.837 154 HB2 ARG 21 2HB ARG 21 -6.194 21.543 -40.730 155 HB3 ARG 21 3HB ARG 21 -4.453 21.271 -40.597 156 HG2 ARG 21 2HG ARG 21 -4.780 18.901 -41.334 157 HG3 ARG 21 3HG ARG 21 -6.503 19.246 -41.562 158 HD2 ARG 21 2HD ARG 21 -5.472 19.400 -43.693 159 HD3 ARG 21 3HD ARG 21 -5.922 21.027 -43.206 160 HE ARG 21 HE ARG 21 -3.158 19.849 -43.246 161 HH11 ARG 21 1HH2 ARG 21 -5.080 22.786 -43.143 162 HH12 ARG 21 2HH2 ARG 21 -3.685 23.804 -43.372 163 HH21 ARG 21 2HH1 ARG 21 -1.440 21.208 -43.532 164 HH22 ARG 21 1HH1 ARG 21 -1.685 22.929 -43.587 165 H ASN 22 H ASN 22 -6.453 20.474 -36.646 166 HA ASN 22 HA ASN 22 -6.789 23.223 -36.490 167 HB2 ASN 22 2HB ASN 22 -7.421 22.886 -34.187 168 HB3 ASN 22 3HB ASN 22 -8.042 21.570 -35.164 169 HD21 ASN 22 2HD2 ASN 22 -6.190 22.349 -32.369 170 HD22 ASN 22 1HD2 ASN 22 -5.630 20.716 -32.053 171 H HIS 23 H HIS 23 -5.793 24.940 -35.801 172 HA HIS 23 HA HIS 23 -3.618 24.965 -33.880 173 HB2 HIS 23 2HB HIS 23 -2.336 24.674 -35.982 174 HB3 HIS 23 3HB HIS 23 -3.182 26.046 -36.700 175 HD2 HIS 23 HD2 HIS 23 -1.604 28.084 -36.757 176 HE1 HIS 23 HE1 HIS 23 0.334 27.658 -32.978 177 HE2 HIS 23 HE2 HIS 23 0.142 29.106 -35.066 178 H ASP 24 H ASP 24 -3.462 27.052 -32.903 179 HA ASP 24 HA ASP 24 -4.448 28.835 -31.909 180 HB2 ASP 24 2HB ASP 24 -3.785 29.707 -34.288 181 HB3 ASP 24 3HB ASP 24 -5.523 29.813 -34.545 182 H LEU 25 H LEU 25 -6.845 30.263 -32.237 183 HA LEU 25 HA LEU 25 -8.717 28.355 -31.040 184 HB2 LEU 25 2HB LEU 25 -8.975 31.311 -31.643 185 HB3 LEU 25 3HB LEU 25 -10.089 30.347 -30.677 186 HG LEU 25 HG LEU 25 -7.188 30.948 -29.942 187 HD11 LEU 25 1HD1 LEU 25 -8.628 32.911 -29.806 188 HD12 LEU 25 2HD1 LEU 25 -9.830 32.011 -28.863 189 HD13 LEU 25 3HD1 LEU 25 -8.219 32.345 -28.177 190 HD21 LEU 25 3HD2 LEU 25 -7.812 30.025 -27.722 191 HD22 LEU 25 1HD2 LEU 25 -9.385 29.525 -28.377 192 HD23 LEU 25 2HD2 LEU 25 -7.867 28.798 -28.987 193 H ALA 26 H ALA 26 -8.772 27.093 -33.066 194 HA ALA 26 HA ALA 26 -10.497 28.109 -35.228 195 HB1 ALA 26 3HB ALA 26 -9.631 26.186 -36.451 196 HB2 ALA 26 1HB ALA 26 -8.314 27.137 -35.755 197 HB3 ALA 26 2HB ALA 26 -8.795 25.605 -34.992 198 HA PRO 27 HA PRO 27 -12.429 28.780 -34.927 199 HB2 PRO 27 2HB PRO 27 -15.054 27.590 -35.846 200 HB3 PRO 27 3HB PRO 27 -14.214 29.068 -36.420 201 HG2 PRO 27 2HG PRO 27 -13.981 26.779 -37.816 202 HG3 PRO 27 3HG PRO 27 -12.502 27.742 -37.476 203 HD2 PRO 27 2HD PRO 27 -13.502 25.264 -36.039 204 HD3 PRO 27 3HD PRO 27 -11.836 25.699 -36.537 205 H ARG 28 H ARG 28 -12.331 29.275 -32.747 206 HA ARG 28 HA ARG 28 -14.898 29.246 -31.288 207 HB2 ARG 28 2HB ARG 28 -14.067 28.198 -29.339 208 HB3 ARG 28 3HB ARG 28 -13.705 27.171 -30.724 209 HG2 ARG 28 2HG ARG 28 -11.341 27.917 -30.679 210 HG3 ARG 28 3HG ARG 28 -11.704 28.956 -29.278 211 HD2 ARG 28 2HD ARG 28 -12.445 26.971 -28.001 212 HD3 ARG 28 3HD ARG 28 -12.063 25.929 -29.386 213 HE ARG 28 HE ARG 28 -9.693 27.285 -28.850 214 HH11 ARG 28 2HH1 ARG 28 -11.710 25.063 -27.042 215 HH12 ARG 28 1HH1 ARG 28 -10.382 24.522 -26.054 216 HH21 ARG 28 2HH2 ARG 28 -8.039 26.543 -27.542 217 HH22 ARG 28 1HH2 ARG 28 -8.370 25.331 -26.344 218 H GLN 29 H GLN 29 -14.837 30.369 -29.241 219 HA GLN 29 HA GLN 29 -13.213 32.872 -29.191 220 HB2 GLN 29 2HB GLN 29 -16.214 32.712 -28.691 221 HB3 GLN 29 3HB GLN 29 -15.215 34.157 -28.669 222 HG2 GLN 29 2HG GLN 29 -15.587 34.513 -30.857 223 HG3 GLN 29 3HG GLN 29 -14.974 32.912 -31.280 224 HE21 GLN 29 1HE2 GLN 29 -16.710 31.155 -30.198 225 HE22 GLN 29 2HE2 GLN 29 -18.299 31.374 -30.934 226 H ILE 30 H ILE 30 -12.185 32.738 -27.313 227 HA ILE 30 HA ILE 30 -13.375 31.442 -24.923 228 HB ILE 30 HB ILE 30 -10.674 32.818 -25.087 229 HG12 ILE 30 2HG1 ILE 30 -10.539 31.158 -26.784 230 HG13 ILE 30 3HG1 ILE 30 -9.655 30.596 -25.377 231 HG21 ILE 30 1HG2 ILE 30 -10.189 31.346 -23.139 232 HG22 ILE 30 2HG2 ILE 30 -11.513 32.470 -22.822 233 HG23 ILE 30 3HG2 ILE 30 -11.869 30.767 -23.169 234 HD11 ILE 30 3HD1 ILE 30 -10.856 28.757 -26.385 235 HD12 ILE 30 1HD1 ILE 30 -11.580 29.108 -24.809 236 HD13 ILE 30 2HD1 ILE 30 -12.389 29.637 -26.310 237 H ALA 31 H ALA 31 -14.895 32.714 -23.966 238 HA ALA 31 HA ALA 31 -14.325 35.606 -23.488 239 HB1 ALA 31 3HB ALA 31 -16.707 35.662 -22.743 240 HB2 ALA 31 1HB ALA 31 -16.489 35.191 -24.433 241 HB3 ALA 31 2HB ALA 31 -16.860 33.953 -23.207 242 H ARG 32 H ARG 32 -14.796 36.412 -21.316 243 HA ARG 32 HA ARG 32 -14.213 34.473 -19.115 244 HB2 ARG 32 2HB ARG 32 -12.848 37.068 -19.785 245 HB3 ARG 32 3HB ARG 32 -13.206 36.771 -18.077 246 HG2 ARG 32 2HG ARG 32 -12.072 34.690 -18.066 247 HG3 ARG 32 3HG ARG 32 -11.819 34.706 -19.825 248 HD2 ARG 32 2HD ARG 32 -10.298 36.578 -19.636 249 HD3 ARG 32 3HD ARG 32 -10.636 36.750 -17.906 250 HE ARG 32 HE ARG 32 -9.669 34.450 -17.593 251 HH11 ARG 32 1HH2 ARG 32 -8.539 36.282 -20.373 252 HH12 ARG 32 2HH2 ARG 32 -6.966 35.552 -20.309 253 HH21 ARG 32 2HH1 ARG 32 -7.873 33.272 -17.841 254 HH22 ARG 32 1HH1 ARG 32 -6.639 33.782 -18.982 255 H TYR 33 H TYR 33 -15.213 34.803 -17.174 256 HA TYR 33 HA TYR 33 -17.221 36.973 -16.989 257 HB2 TYR 33 2HB TYR 33 -17.896 34.054 -16.525 258 HB3 TYR 33 3HB TYR 33 -18.920 35.409 -16.164 259 HD1 TYR 33 HD1 TYR 33 -17.249 33.627 -19.014 260 HD2 TYR 33 HD2 TYR 33 -20.382 36.275 -17.739 261 HE1 TYR 33 HE1 TYR 33 -18.348 33.429 -21.249 262 HE2 TYR 33 HE2 TYR 33 -21.445 36.116 -19.976 263 HH TYR 33 HH TYR 33 -21.442 35.106 -21.958 264 H ARG 34 H ARG 34 -17.637 37.680 -14.959 265 HA ARG 34 HA ARG 34 -15.936 36.693 -12.703 266 HB2 ARG 34 2HB ARG 34 -15.533 38.995 -13.597 267 HB3 ARG 34 3HB ARG 34 -17.195 39.424 -13.214 268 HG2 ARG 34 2HG ARG 34 -16.787 39.103 -10.819 269 HG3 ARG 34 3HG ARG 34 -15.150 38.503 -11.137 270 HD2 ARG 34 2HD ARG 34 -14.548 40.706 -12.128 271 HD3 ARG 34 3HD ARG 34 -16.197 41.263 -11.862 272 HE ARG 34 HE ARG 34 -15.849 41.361 -9.531 273 HH11 ARG 34 2HH1 ARG 34 -12.785 40.492 -11.120 274 HH12 ARG 34 1HH1 ARG 34 -11.893 40.888 -9.679 275 HH21 ARG 34 1HH2 ARG 34 -14.582 41.868 -7.804 276 HH22 ARG 34 2HH2 ARG 34 -12.860 41.650 -7.889 277 H THR 35 H THR 35 -16.859 35.845 -10.983 278 HA THR 35 HA THR 35 -19.762 35.552 -10.772 279 HB THR 35 HB THR 35 -19.279 34.150 -8.793 280 HG1 THR 35 HG1 THR 35 -16.595 34.539 -9.387 281 HG21 THR 35 1HG2 THR 35 -17.535 33.478 -11.197 282 HG22 THR 35 2HG2 THR 35 -18.040 32.374 -9.902 283 HG23 THR 35 3HG2 THR 35 -19.251 33.087 -10.990 284 H ASP 36 H ASP 36 -20.523 35.660 -8.288 285 HA ASP 36 HA ASP 36 -20.480 38.527 -7.717 286 HB2 ASP 36 2HB ASP 36 -22.580 37.154 -7.741 287 HB3 ASP 36 3HB ASP 36 -21.984 36.254 -6.347 288 H ASN 37 H ASN 37 -18.644 35.888 -6.741 289 HA ASN 37 HA ASN 37 -17.808 37.046 -4.141 290 HB2 ASN 37 2HB ASN 37 -18.616 34.722 -4.280 291 HB3 ASN 37 3HB ASN 37 -17.395 34.344 -5.469 292 HD21 ASN 37 1HD2 ASN 37 -16.037 32.931 -4.429 293 HD22 ASN 37 2HD2 ASN 37 -15.440 33.166 -2.821 294 H GLY 38 H GLY 38 -17.153 37.826 -7.141 295 HA2 GLY 38 HA2 GLY 38 -15.425 39.078 -8.046 296 HA3 GLY 38 HA3 GLY 38 -14.350 38.618 -6.716 297 H GLU 39 H GLU 39 -15.667 35.810 -7.913 298 HA GLU 39 HA GLU 39 -12.971 35.085 -8.740 299 HB2 GLU 39 2HB GLU 39 -15.296 33.172 -8.773 300 HB3 GLU 39 3HB GLU 39 -13.590 32.865 -8.530 301 HG2 GLU 39 2HG GLU 39 -14.117 34.485 -6.374 302 HG3 GLU 39 3HG GLU 39 -15.749 33.862 -6.708 303 H GLU 40 H GLU 40 -12.259 35.256 -10.723 304 HA GLU 40 HA GLU 40 -14.144 35.347 -13.011 305 HB2 GLU 40 2HB GLU 40 -11.265 36.204 -12.645 306 HB3 GLU 40 3HB GLU 40 -12.036 36.110 -14.241 307 HG2 GLU 40 2HG GLU 40 -13.763 37.654 -13.595 308 HG3 GLU 40 3HG GLU 40 -13.190 37.687 -11.922 309 H PHE 41 H PHE 41 -14.428 33.829 -14.420 310 HA PHE 41 HA PHE 41 -12.431 31.633 -14.812 311 HB2 PHE 41 2HB PHE 41 -15.454 31.451 -14.705 312 HB3 PHE 41 3HB PHE 41 -14.394 30.149 -15.166 313 HD1 PHE 41 HD2 PHE 41 -15.543 32.205 -12.247 314 HD2 PHE 41 HD1 PHE 41 -13.140 28.857 -13.561 315 HE1 PHE 41 HE2 PHE 41 -15.291 31.454 -9.944 316 HE2 PHE 41 HE1 PHE 41 -12.831 28.160 -11.206 317 HZ PHE 41 HZ PHE 41 -13.898 29.462 -9.378 318 H GLU 42 H GLU 42 -12.639 30.519 -16.836 319 HA GLU 42 HA GLU 42 -13.390 32.325 -19.068 320 HB2 GLU 42 2HB GLU 42 -11.478 29.968 -19.255 321 HB3 GLU 42 3HB GLU 42 -11.787 31.275 -20.396 322 HG2 GLU 42 2HG GLU 42 -9.846 32.053 -19.537 323 HG3 GLU 42 3HG GLU 42 -11.012 32.825 -18.463 324 H VAL 43 H VAL 43 -14.722 31.731 -20.615 325 HA VAL 43 HA VAL 43 -15.791 28.927 -20.715 326 HB VAL 43 HB VAL 43 -17.402 31.428 -21.211 327 HG11 VAL 43 1HG1 VAL 43 -19.284 29.918 -21.312 328 HG12 VAL 43 2HG1 VAL 43 -18.104 29.400 -22.503 329 HG13 VAL 43 3HG1 VAL 43 -18.245 28.512 -20.972 330 HG21 VAL 43 3HG2 VAL 43 -17.619 29.536 -18.843 331 HG22 VAL 43 1HG2 VAL 43 -16.830 31.127 -18.761 332 HG23 VAL 43 2HG2 VAL 43 -18.531 31.034 -19.160 333 HA PRO 44 HA PRO 44 -14.421 29.511 -25.033 334 HB2 PRO 44 2HB PRO 44 -14.780 26.572 -25.081 335 HB3 PRO 44 3HB PRO 44 -13.384 27.526 -25.609 336 HG2 PRO 44 2HG PRO 44 -13.340 26.052 -23.297 337 HG3 PRO 44 3HG PRO 44 -12.527 27.644 -23.391 338 HD2 PRO 44 2HD PRO 44 -15.233 26.995 -22.212 339 HD3 PRO 44 3HD PRO 44 -13.932 28.075 -21.606 340 H PHE 45 H PHE 45 -15.816 30.001 -26.522 341 HA PHE 45 HA PHE 45 -18.438 28.549 -26.884 342 HB2 PHE 45 2HB PHE 45 -17.645 31.432 -27.313 343 HB3 PHE 45 3HB PHE 45 -19.019 30.756 -28.125 344 HD1 PHE 45 HD2 PHE 45 -17.598 31.614 -24.795 345 HD2 PHE 45 HD1 PHE 45 -21.116 30.357 -26.944 346 HE1 PHE 45 HE2 PHE 45 -18.995 32.100 -22.813 347 HE2 PHE 45 HE1 PHE 45 -22.508 30.866 -24.953 348 HZ PHE 45 HZ PHE 45 -21.425 31.686 -22.849 349 H ALA 46 H ALA 46 -19.018 27.919 -28.971 350 HA ALA 46 HA ALA 46 -16.797 27.622 -30.902 351 HB1 ALA 46 3HB ALA 46 -18.189 25.666 -30.320 352 HB2 ALA 46 1HB ALA 46 -19.637 26.512 -30.914 353 HB3 ALA 46 2HB ALA 46 -18.333 26.076 -32.038 354 H ASP 47 H ASP 47 -17.059 28.200 -33.166 355 HA ASP 47 HA ASP 47 -18.032 30.799 -33.704 356 HB2 ASP 47 2HB ASP 47 -16.277 29.685 -34.967 357 HB3 ASP 47 3HB ASP 47 -17.412 28.462 -35.548 358 H ASP 48 H ASP 48 -19.845 27.828 -33.664 359 HA ASP 48 HA ASP 48 -22.127 28.756 -35.236 360 HB2 ASP 48 2HB ASP 48 -21.421 26.371 -34.934 361 HB3 ASP 48 3HB ASP 48 -21.889 26.485 -33.239 362 H ALA 49 H ALA 49 -20.985 29.523 -32.147 363 HA ALA 49 HA ALA 49 -23.649 30.361 -31.085 364 HB1 ALA 49 3HB ALA 49 -22.562 28.472 -29.859 365 HB2 ALA 49 1HB ALA 49 -21.153 29.517 -29.553 366 HB3 ALA 49 2HB ALA 49 -22.737 29.927 -28.865 367 H GLU 50 H GLU 50 -23.351 32.092 -29.358 368 HA GLU 50 HA GLU 50 -21.202 34.060 -29.879 369 HB2 GLU 50 2HB GLU 50 -22.732 35.906 -29.904 370 HB3 GLU 50 3HB GLU 50 -23.197 34.763 -31.165 371 HG2 GLU 50 2HG GLU 50 -24.995 33.872 -29.653 372 HG3 GLU 50 3HG GLU 50 -24.552 35.084 -28.448 373 H ILE 51 H ILE 51 -21.107 35.691 -28.064 374 HA ILE 51 HA ILE 51 -21.186 34.362 -25.481 375 HB ILE 51 HB ILE 51 -20.185 37.158 -25.996 376 HG12 ILE 51 2HG1 ILE 51 -19.118 35.805 -27.706 377 HG13 ILE 51 3HG1 ILE 51 -17.961 36.335 -26.483 378 HG21 ILE 51 1HG2 ILE 51 -18.700 36.661 -24.100 379 HG22 ILE 51 2HG2 ILE 51 -20.389 36.427 -23.629 380 HG23 ILE 51 3HG2 ILE 51 -19.358 35.030 -23.981 381 HD11 ILE 51 3HD1 ILE 51 -18.063 34.018 -25.500 382 HD12 ILE 51 1HD1 ILE 51 -19.155 33.558 -26.824 383 HD13 ILE 51 2HD1 ILE 51 -17.492 34.061 -27.172 384 HA PRO 52 HA PRO 52 -24.940 36.808 -24.505 385 HB2 PRO 52 2HB PRO 52 -25.657 35.326 -22.318 386 HB3 PRO 52 3HB PRO 52 -26.034 34.835 -24.001 387 HG2 PRO 52 2HG PRO 52 -23.784 33.905 -22.208 388 HG3 PRO 52 3HG PRO 52 -24.844 32.926 -23.283 389 HD2 PRO 52 2HD PRO 52 -22.298 33.776 -23.957 390 HD3 PRO 52 3HD PRO 52 -23.565 33.511 -25.170 391 H GLY 53 H GLY 53 -25.241 38.330 -22.895 392 HA2 GLY 53 HA2 GLY 53 -23.150 39.658 -21.703 393 HA3 GLY 53 HA3 GLY 53 -24.820 39.753 -21.135 394 H THR 54 H THR 54 -24.888 36.903 -20.208 395 HA THR 54 HA THR 54 -22.680 36.769 -18.287 396 HB THR 54 HB THR 54 -24.263 36.151 -16.421 397 HG1 THR 54 HG1 THR 54 -26.442 36.315 -16.693 398 HG21 THR 54 1HG2 THR 54 -23.740 38.600 -16.706 399 HG22 THR 54 2HG2 THR 54 -25.259 38.782 -17.581 400 HG23 THR 54 3HG2 THR 54 -25.260 38.265 -15.879 401 H TRP 55 H TRP 55 -22.485 34.620 -17.215 402 HA TRP 55 HA TRP 55 -23.838 32.307 -18.384 403 HB2 TRP 55 2HB TRP 55 -22.089 33.003 -20.094 404 HB3 TRP 55 3HB TRP 55 -20.867 32.658 -18.880 405 HD1 TRP 55 HD1 TRP 55 -20.319 30.154 -18.400 406 HE1 TRP 55 HE1 TRP 55 -20.674 28.004 -19.714 407 HE3 TRP 55 HE3 TRP 55 -24.032 31.762 -21.486 408 HZ2 TRP 55 HZ2 TRP 55 -22.478 27.037 -21.784 409 HZ3 TRP 55 HZ3 TRP 55 -25.079 30.204 -23.131 410 HH2 TRP 55 HH2 TRP 55 -24.302 27.849 -23.291 411 H LEU 56 H LEU 56 -23.387 30.335 -17.215 412 HA LEU 56 HA LEU 56 -22.717 30.746 -14.446 413 HB2 LEU 56 2HB LEU 56 -24.220 28.913 -15.903 414 HB3 LEU 56 3HB LEU 56 -22.824 27.965 -15.388 415 HG LEU 56 HG LEU 56 -24.559 29.605 -13.496 416 HD11 LEU 56 1HD1 LEU 56 -25.878 27.813 -14.559 417 HD12 LEU 56 2HD1 LEU 56 -24.638 26.620 -14.112 418 HD13 LEU 56 3HD1 LEU 56 -25.577 27.454 -12.851 419 HD21 LEU 56 3HD2 LEU 56 -22.319 29.106 -12.593 420 HD22 LEU 56 1HD2 LEU 56 -23.548 28.148 -11.761 421 HD23 LEU 56 2HD2 LEU 56 -22.515 27.393 -12.997 422 H CYS 57 H CYS 57 -20.854 30.589 -13.423 423 HA CYS 57 HA CYS 57 -18.419 29.724 -14.880 424 HB2 CYS 57 2HB CYS 57 -18.891 31.310 -12.325 425 HB3 CYS 57 3HB CYS 57 -17.294 30.800 -12.874 426 HG CYS 57 HG CYS 57 -17.463 31.897 -15.269 427 H ARG 58 H ARG 58 -16.729 28.547 -13.665 428 HA ARG 58 HA ARG 58 -17.770 26.050 -12.737 429 HB2 ARG 58 2HB ARG 58 -14.897 27.030 -12.539 430 HB3 ARG 58 3HB ARG 58 -15.454 25.365 -12.458 431 HG2 ARG 58 2HG ARG 58 -16.308 25.585 -14.832 432 HG3 ARG 58 3HG ARG 58 -15.598 27.209 -14.884 433 HD2 ARG 58 2HD ARG 58 -14.057 25.726 -15.936 434 HD3 ARG 58 3HD ARG 58 -13.361 26.233 -14.387 435 HE ARG 58 HE ARG 58 -14.826 23.754 -14.109 436 HH11 ARG 58 2HH2 ARG 58 -11.761 24.910 -15.355 437 HH12 ARG 58 1HH2 ARG 58 -10.980 23.370 -15.115 438 HH21 ARG 58 1HH1 ARG 58 -13.766 21.822 -13.822 439 HH22 ARG 58 2HH1 ARG 58 -12.093 21.671 -14.275 440 H ASN 59 H ASN 59 -17.088 28.879 -10.877 441 HA ASN 59 HA ASN 59 -16.789 27.597 -8.331 442 HB2 ASN 59 2HB ASN 59 -16.173 29.894 -8.687 443 HB3 ASN 59 3HB ASN 59 -17.831 30.321 -9.135 444 HD21 ASN 59 1HD2 ASN 59 -17.672 32.013 -7.514 445 HD22 ASN 59 2HD2 ASN 59 -17.808 31.598 -5.837 446 H GLY 60 H GLY 60 -19.504 27.989 -10.426 447 HA2 GLY 60 HA2 GLY 60 -21.591 26.877 -10.244 448 HA3 GLY 60 HA3 GLY 60 -21.423 26.782 -8.490 449 H MET 61 H MET 61 -20.667 29.861 -9.860 450 HA MET 61 HA MET 61 -23.329 31.002 -9.165 451 HB2 MET 61 2HB MET 61 -21.386 31.635 -7.688 452 HB3 MET 61 3HB MET 61 -20.610 32.345 -9.088 453 HG2 MET 61 2HG MET 61 -21.747 34.024 -7.676 454 HG3 MET 61 3HG MET 61 -22.366 33.995 -9.320 455 HE1 MET 61 3HE MET 61 -23.053 33.383 -5.545 456 HE2 MET 61 1HE MET 61 -24.637 32.577 -5.536 457 HE3 MET 61 2HE MET 61 -23.207 31.705 -6.123 458 H GLU 62 H GLU 62 -24.216 32.546 -10.595 459 HA GLU 62 HA GLU 62 -23.433 32.361 -13.390 460 HB2 GLU 62 2HB GLU 62 -25.782 32.670 -12.640 461 HB3 GLU 62 3HB GLU 62 -25.376 34.317 -12.126 462 HG2 GLU 62 2HG GLU 62 -24.641 34.833 -14.465 463 HG3 GLU 62 3HG GLU 62 -25.064 33.193 -14.955 464 H GLY 63 H GLY 63 -21.645 33.245 -14.134 465 HA2 GLY 63 HA2 GLY 63 -20.414 35.594 -12.918 466 HA3 GLY 63 HA3 GLY 63 -19.762 34.641 -14.233 467 H THR 64 H THR 64 -20.096 37.584 -14.000 468 HA THR 64 HA THR 64 -21.775 38.052 -16.426 469 HB THR 64 HB THR 64 -20.579 40.081 -14.501 470 HG1 THR 64 HG1 THR 64 -22.272 38.905 -13.573 471 HG21 THR 64 1HG2 THR 64 -22.486 40.420 -16.863 472 HG22 THR 64 2HG2 THR 64 -22.260 41.647 -15.596 473 HG23 THR 64 3HG2 THR 64 -20.902 41.182 -16.624 474 H LEU 65 H LEU 65 -20.951 38.877 -18.290 475 HA LEU 65 HA LEU 65 -18.311 38.151 -18.976 476 HB2 LEU 65 2HB LEU 65 -20.416 38.267 -20.347 477 HB3 LEU 65 3HB LEU 65 -20.258 39.999 -20.391 478 HG LEU 65 HG LEU 65 -18.591 37.820 -21.702 479 HD11 LEU 65 1HD1 LEU 65 -20.681 38.622 -22.777 480 HD12 LEU 65 2HD1 LEU 65 -20.031 40.273 -22.799 481 HD13 LEU 65 3HD1 LEU 65 -19.254 38.998 -23.758 482 HD21 LEU 65 3HD2 LEU 65 -17.174 39.566 -22.768 483 HD22 LEU 65 1HD2 LEU 65 -17.797 40.752 -21.595 484 HD23 LEU 65 2HD2 LEU 65 -16.845 39.335 -21.060 485 H ILE 66 H ILE 66 -16.415 39.170 -18.628 486 HA ILE 66 HA ILE 66 -16.314 42.135 -18.314 487 HB ILE 66 HB ILE 66 -14.634 42.035 -16.646 488 HG12 ILE 66 2HG1 ILE 66 -13.371 40.056 -17.009 489 HG13 ILE 66 3HG1 ILE 66 -14.035 39.966 -15.383 490 HG21 ILE 66 1HG2 ILE 66 -15.907 41.383 -14.737 491 HG22 ILE 66 2HG2 ILE 66 -17.000 42.077 -15.952 492 HG23 ILE 66 3HG2 ILE 66 -16.932 40.322 -15.709 493 HD11 ILE 66 3HD1 ILE 66 -14.206 37.817 -16.251 494 HD12 ILE 66 1HD1 ILE 66 -15.847 38.488 -16.380 495 HD13 ILE 66 2HD1 ILE 66 -14.795 38.420 -17.812 496 H GLU 67 H GLU 67 -14.352 43.168 -18.804 497 HA GLU 67 HA GLU 67 -12.664 41.774 -20.837 498 HB2 GLU 67 2HB GLU 67 -13.138 44.739 -20.370 499 HB3 GLU 67 3HB GLU 67 -12.027 44.046 -21.558 500 HG2 GLU 67 2HG GLU 67 -13.933 42.921 -22.690 501 HG3 GLU 67 3HG GLU 67 -15.051 43.638 -21.528 502 H GLY 68 H GLY 68 -10.493 41.660 -20.604 503 HA2 GLY 68 HA2 GLY 68 -8.858 43.344 -19.012 504 HA3 GLY 68 HA3 GLY 68 -9.171 41.871 -18.081 505 H ASP 69 H ASP 69 -9.144 39.893 -19.926 506 HA ASP 69 HA ASP 69 -6.926 40.189 -21.854 507 HB2 ASP 69 2HB ASP 69 -5.756 39.377 -19.885 508 HB3 ASP 69 3HB ASP 69 -6.954 38.115 -19.628 509 H LEU 70 H LEU 70 -8.131 39.867 -23.615 510 HA LEU 70 HA LEU 70 -9.729 37.377 -23.917 511 HB2 LEU 70 2HB LEU 70 -10.552 40.186 -24.719 512 HB3 LEU 70 3HB LEU 70 -11.378 38.732 -25.261 513 HG LEU 70 HG LEU 70 -11.133 39.516 -22.325 514 HD11 LEU 70 1HD1 LEU 70 -13.455 40.241 -22.496 515 HD12 LEU 70 2HD1 LEU 70 -12.433 41.179 -23.601 516 HD13 LEU 70 3HD1 LEU 70 -13.473 39.880 -24.228 517 HD21 LEU 70 3HD2 LEU 70 -11.549 37.109 -22.626 518 HD22 LEU 70 1HD2 LEU 70 -13.014 37.914 -22.052 519 HD23 LEU 70 2HD2 LEU 70 -12.867 37.459 -23.766 520 HA PRO 71 HA PRO 71 -7.420 37.046 -27.689 521 HB2 PRO 71 2HB PRO 71 -8.830 35.240 -29.126 522 HB3 PRO 71 3HB PRO 71 -8.116 34.838 -27.539 523 HG2 PRO 71 2HG PRO 71 -10.977 35.704 -28.101 524 HG3 PRO 71 3HG PRO 71 -10.419 34.266 -27.185 525 HD2 PRO 71 2HD PRO 71 -11.092 36.610 -25.956 526 HD3 PRO 71 3HD PRO 71 -9.776 35.568 -25.342 527 H GLU 72 H GLU 72 -8.167 39.427 -27.807 528 HA GLU 72 HA GLU 72 -9.172 41.253 -28.762 529 HB2 GLU 72 2HB GLU 72 -7.740 39.761 -30.951 530 HB3 GLU 72 3HB GLU 72 -8.293 41.445 -31.126 531 HG2 GLU 72 2HG GLU 72 -6.944 42.075 -29.134 532 HG3 GLU 72 3HG GLU 72 -6.336 40.422 -29.027 533 HA PRO 73 HA PRO 73 -13.161 39.527 -30.467 534 HB2 PRO 73 2HB PRO 73 -14.176 41.325 -28.275 535 HB3 PRO 73 3HB PRO 73 -14.819 39.749 -28.834 536 HG2 PRO 73 2HG PRO 73 -13.389 39.901 -26.548 537 HG3 PRO 73 3HG PRO 73 -13.078 38.559 -27.699 538 HD2 PRO 73 2HD PRO 73 -11.537 41.158 -27.387 539 HD3 PRO 73 3HD PRO 73 -10.930 39.480 -27.465 540 H LYS 74 H LYS 74 -14.939 40.825 -31.404 541 HA LYS 74 HA LYS 74 -14.040 43.113 -32.867 542 HB2 LYS 74 2HB LYS 74 -16.273 43.216 -33.772 543 HB3 LYS 74 3HB LYS 74 -15.736 41.541 -33.713 544 HG2 LYS 74 2HG LYS 74 -17.091 41.146 -31.681 545 HG3 LYS 74 3HG LYS 74 -17.615 42.833 -31.666 546 HD2 LYS 74 2HD LYS 74 -18.179 40.887 -33.943 547 HD3 LYS 74 3HD LYS 74 -19.285 41.222 -32.601 548 HE2 LYS 74 2HE LYS 74 -19.310 43.639 -33.222 549 HE3 LYS 74 3HE LYS 74 -18.262 43.287 -34.602 550 HZ1 LYS 74 HZ1 LYS 74 -20.013 41.836 -35.481 551 HZ2 LYS 74 HZ2 LYS 74 -20.985 42.162 -34.208 552 HZ3 LYS 74 HZ3 LYS 74 -20.595 43.344 -35.262 553 H LYS 75 H LYS 75 -14.938 45.232 -32.960 554 HA LYS 75 HA LYS 75 -15.095 46.605 -30.419 555 HB2 LYS 75 2HB LYS 75 -14.128 47.580 -32.516 556 HB3 LYS 75 3HB LYS 75 -15.730 47.573 -33.234 557 HG2 LYS 75 2HG LYS 75 -15.318 49.797 -32.531 558 HG3 LYS 75 3HG LYS 75 -16.527 49.151 -31.445 559 HD2 LYS 75 2HD LYS 75 -14.924 50.479 -30.189 560 HD3 LYS 75 3HD LYS 75 -14.791 48.799 -29.705 561 HE2 LYS 75 2HE LYS 75 -12.577 49.638 -29.845 562 HE3 LYS 75 3HE LYS 75 -12.782 48.555 -31.218 563 HZ1 LYS 75 HZ1 LYS 75 -12.963 51.527 -31.330 564 HZ2 LYS 75 HZ2 LYS 75 -11.698 50.643 -31.853 565 HZ3 LYS 75 HZ3 LYS 75 -13.131 50.537 -32.622 566 H VAL 76 H VAL 76 -16.777 47.377 -29.307 567 HA VAL 76 HA VAL 76 -19.570 47.155 -30.276 568 HB VAL 76 HB VAL 76 -20.301 46.212 -28.108 569 HG11 VAL 76 1HG1 VAL 76 -18.363 44.362 -29.545 570 HG12 VAL 76 2HG1 VAL 76 -19.768 43.903 -28.565 571 HG13 VAL 76 3HG1 VAL 76 -20.007 44.760 -30.097 572 HG21 VAL 76 3HG2 VAL 76 -17.360 45.588 -27.592 573 HG22 VAL 76 1HG2 VAL 76 -18.334 46.778 -26.697 574 HG23 VAL 76 2HG2 VAL 76 -18.747 45.061 -26.621 575 H LYS 77 H LYS 77 -21.093 48.347 -28.890 576 HA LYS 77 HA LYS 77 -19.876 50.637 -27.409 577 HB2 LYS 77 2HB LYS 77 -22.095 50.761 -29.493 578 HB3 LYS 77 3HB LYS 77 -21.666 52.089 -28.410 579 HG2 LYS 77 2HG LYS 77 -19.351 52.099 -29.335 580 HG3 LYS 77 3HG LYS 77 -19.818 50.826 -30.482 581 HD2 LYS 77 2HD LYS 77 -21.549 52.322 -31.443 582 HD3 LYS 77 3HD LYS 77 -21.075 53.601 -30.302 583 HE2 LYS 77 2HE LYS 77 -18.773 53.581 -31.245 584 HE3 LYS 77 3HE LYS 77 -19.246 52.313 -32.383 585 HZ1 LYS 77 HZ1 LYS 77 -20.415 55.047 -32.299 586 HZ2 LYS 77 HZ2 LYS 77 -19.352 54.510 -33.413 587 HZ3 LYS 77 HZ3 LYS 77 -20.853 53.874 -33.351 588 HA PRO 78 HA PRO 78 -22.710 49.777 -24.169 589 HB2 PRO 78 2HB PRO 78 -23.359 52.723 -24.058 590 HB3 PRO 78 3HB PRO 78 -22.894 51.622 -22.725 591 HG2 PRO 78 2HG PRO 78 -21.068 53.316 -23.770 592 HG3 PRO 78 3HG PRO 78 -20.607 51.614 -23.434 593 HD2 PRO 78 2HD PRO 78 -21.431 52.848 -26.079 594 HD3 PRO 78 3HD PRO 78 -20.040 51.786 -25.707 595 HA PRO 79 HA PRO 79 -26.869 49.654 -25.859 596 HB2 PRO 79 2HB PRO 79 -28.399 49.093 -23.667 597 HB3 PRO 79 3HB PRO 79 -27.260 47.914 -24.387 598 HG2 PRO 79 2HG PRO 79 -26.776 49.762 -22.023 599 HG3 PRO 79 3HG PRO 79 -26.472 47.997 -22.126 600 HD2 PRO 79 2HD PRO 79 -24.497 49.820 -22.538 601 HD3 PRO 79 3HD PRO 79 -24.573 48.312 -23.497 602 H ARG 80 H ARG 80 -28.787 50.844 -26.036 603 HA ARG 80 HA ARG 80 -29.149 53.355 -24.478 604 HB2 ARG 80 2HB ARG 80 -28.959 53.187 -27.515 605 HB3 ARG 80 3HB ARG 80 -29.558 54.583 -26.613 606 HG2 ARG 80 2HG ARG 80 -27.357 54.788 -25.460 607 HG3 ARG 80 3HG ARG 80 -26.721 53.459 -26.439 608 HD2 ARG 80 2HD ARG 80 -27.824 56.070 -27.545 609 HD3 ARG 80 3HD ARG 80 -26.106 55.718 -27.289 610 HE ARG 80 HE ARG 80 -27.041 53.630 -28.882 611 HH11 ARG 80 2HH1 ARG 80 -26.782 57.099 -29.282 612 HH12 ARG 80 1HH1 ARG 80 -26.644 56.979 -31.015 613 HH21 ARG 80 2HH2 ARG 80 -26.874 53.551 -31.091 614 HH22 ARG 80 1HH2 ARG 80 -26.692 55.020 -32.005 Start of MODEL 28 1 H1 SER 1 1H SER 1 15.366 23.342 -61.013 2 H2 SER 1 2H SER 1 16.212 22.485 -62.124 3 H3 SER 1 3H SER 1 16.522 22.281 -60.525 4 HA SER 1 HA SER 1 14.384 21.342 -60.129 5 HB2 SER 1 2HB SER 1 13.920 21.637 -63.122 6 HB3 SER 1 3HB SER 1 12.791 20.984 -61.916 7 HG SER 1 HG SER 1 12.397 23.206 -62.442 8 H MET 2 H MET 2 15.358 18.056 -61.224 9 HA MET 2 HA MET 2 13.288 19.648 -59.780 10 HB2 MET 2 2HB MET 2 13.595 16.706 -60.458 11 HB3 MET 2 3HB MET 2 12.481 17.271 -59.222 12 HG2 MET 2 2HG MET 2 11.216 17.026 -61.189 13 HG3 MET 2 3HG MET 2 11.370 18.751 -60.884 14 HE1 MET 2 3HE MET 2 10.247 17.543 -63.574 15 HE2 MET 2 1HE MET 2 10.438 19.287 -63.278 16 HE3 MET 2 2HE MET 2 11.066 18.565 -64.776 17 H ALA 3 H ALA 3 14.519 18.768 -56.483 18 HA ALA 3 HA ALA 3 11.939 18.971 -57.793 19 HB1 ALA 3 3HB ALA 3 12.285 18.171 -55.481 20 HB2 ALA 3 1HB ALA 3 12.890 19.777 -55.016 21 HB3 ALA 3 2HB ALA 3 11.204 19.569 -55.533 22 H ASP 4 H ASP 4 10.605 21.030 -57.080 23 HA ASP 4 HA ASP 4 12.019 23.579 -57.532 24 HB2 ASP 4 2HB ASP 4 11.329 22.685 -59.780 25 HB3 ASP 4 3HB ASP 4 9.654 22.699 -59.232 26 H ARG 5 H ARG 5 10.609 25.451 -57.088 27 HA ARG 5 HA ARG 5 9.152 25.033 -54.581 28 HB2 ARG 5 2HB ARG 5 9.693 27.551 -56.210 29 HB3 ARG 5 3HB ARG 5 8.902 27.523 -54.628 30 HG2 ARG 5 2HG ARG 5 10.929 26.486 -53.622 31 HG3 ARG 5 3HG ARG 5 11.745 26.565 -55.196 32 HD2 ARG 5 2HD ARG 5 11.474 29.028 -55.216 33 HD3 ARG 5 3HD ARG 5 10.689 28.971 -53.640 34 HE ARG 5 HE ARG 5 13.552 28.678 -54.250 35 HH11 ARG 5 2HH1 ARG 5 11.169 28.172 -51.725 36 HH12 ARG 5 1HH1 ARG 5 12.376 28.177 -50.468 37 HH21 ARG 5 1HH2 ARG 5 15.026 28.679 -52.596 38 HH22 ARG 5 2HH2 ARG 5 14.497 28.455 -50.955 39 H VAL 6 H VAL 6 7.052 25.446 -54.089 40 HA VAL 6 HA VAL 6 5.047 25.874 -56.231 41 HB VAL 6 HB VAL 6 3.663 24.102 -55.187 42 HG11 VAL 6 1HG1 VAL 6 4.917 23.699 -57.283 43 HG12 VAL 6 2HG1 VAL 6 6.264 23.034 -56.332 44 HG13 VAL 6 3HG1 VAL 6 4.685 22.226 -56.326 45 HG21 VAL 6 3HG2 VAL 6 6.206 23.161 -53.805 46 HG22 VAL 6 1HG2 VAL 6 4.787 23.868 -52.995 47 HG23 VAL 6 2HG2 VAL 6 4.643 22.326 -53.846 48 H LEU 7 H LEU 7 2.963 26.492 -55.451 49 HA LEU 7 HA LEU 7 2.982 28.214 -53.069 50 HB2 LEU 7 2HB LEU 7 0.781 27.474 -55.037 51 HB3 LEU 7 3HB LEU 7 0.622 28.661 -53.751 52 HG LEU 7 HG LEU 7 2.512 28.874 -56.133 53 HD11 LEU 7 1HD1 LEU 7 -0.015 30.415 -55.420 54 HD12 LEU 7 2HD1 LEU 7 1.024 30.691 -56.837 55 HD13 LEU 7 3HD1 LEU 7 0.124 29.173 -56.685 56 HD21 LEU 7 3HD2 LEU 7 3.510 30.040 -54.218 57 HD22 LEU 7 1HD2 LEU 7 2.867 31.215 -55.365 58 HD23 LEU 7 2HD2 LEU 7 1.965 30.853 -53.877 59 H ARG 8 H ARG 8 1.453 28.055 -51.380 60 HA ARG 8 HA ARG 8 1.081 25.303 -50.341 61 HB2 ARG 8 2HB ARG 8 2.058 27.019 -48.886 62 HB3 ARG 8 3HB ARG 8 0.629 28.034 -49.094 63 HG2 ARG 8 2HG ARG 8 -0.771 26.415 -47.939 64 HG3 ARG 8 3HG ARG 8 0.606 25.309 -47.744 65 HD2 ARG 8 2HD ARG 8 1.663 26.750 -46.175 66 HD3 ARG 8 3HD ARG 8 0.792 28.165 -46.766 67 HE ARG 8 HE ARG 8 -0.888 27.803 -45.294 68 HH11 ARG 8 2HH1 ARG 8 0.665 24.630 -45.533 69 HH12 ARG 8 1HH1 ARG 8 -0.292 24.061 -44.175 70 HH21 ARG 8 1HH2 ARG 8 -1.934 26.983 -43.655 71 HH22 ARG 8 2HH2 ARG 8 -1.628 25.320 -43.124 72 H GLY 9 H GLY 9 -0.827 24.341 -49.919 73 HA2 GLY 9 HA2 GLY 9 -3.413 25.659 -50.690 74 HA3 GLY 9 HA3 GLY 9 -3.133 23.931 -50.619 75 H SER 10 H SER 10 -4.084 25.783 -47.117 76 HA SER 10 HA SER 10 -3.143 27.453 -49.380 77 HB2 SER 10 2HB SER 10 -5.374 28.479 -49.664 78 HB3 SER 10 3HB SER 10 -5.347 26.774 -50.138 79 HG SER 10 HG SER 10 -7.178 27.243 -48.862 80 H ARG 11 H ARG 11 -4.947 27.498 -46.281 81 HA ARG 11 HA ARG 11 -4.701 30.269 -45.945 82 HB2 ARG 11 2HB ARG 11 -5.337 28.032 -43.996 83 HB3 ARG 11 3HB ARG 11 -5.346 29.727 -43.504 84 HG2 ARG 11 2HG ARG 11 -7.038 30.273 -45.196 85 HG3 ARG 11 3HG ARG 11 -7.017 28.611 -45.799 86 HD2 ARG 11 2HD ARG 11 -8.961 28.982 -44.375 87 HD3 ARG 11 3HD ARG 11 -7.895 27.779 -43.669 88 HE ARG 11 HE ARG 11 -8.328 30.585 -42.721 89 HH11 ARG 11 1HH2 ARG 11 -6.908 27.428 -41.985 90 HH12 ARG 11 2HH2 ARG 11 -6.523 27.974 -40.347 91 HH21 ARG 11 1HH1 ARG 11 -7.756 31.061 -40.573 92 HH22 ARG 11 2HH1 ARG 11 -6.941 29.800 -39.646 93 H LEU 12 H LEU 12 -1.820 31.071 -43.994 94 HA LEU 12 HA LEU 12 -4.517 31.966 -44.880 95 HB2 LEU 12 2HB LEU 12 -2.234 33.346 -43.449 96 HB3 LEU 12 3HB LEU 12 -3.623 34.189 -44.082 97 HG LEU 12 HG LEU 12 -3.898 33.890 -41.750 98 HD11 LEU 12 1HD1 LEU 12 -5.930 33.766 -43.172 99 HD12 LEU 12 2HD1 LEU 12 -5.840 31.992 -43.119 100 HD13 LEU 12 3HD1 LEU 12 -6.095 32.914 -41.628 101 HD21 LEU 12 3HD2 LEU 12 -4.121 31.790 -40.595 102 HD22 LEU 12 1HD2 LEU 12 -3.862 30.870 -42.082 103 HD23 LEU 12 2HD2 LEU 12 -2.545 31.845 -41.397 104 H GLY 13 H GLY 13 -1.103 32.360 -45.849 105 HA2 GLY 13 HA2 GLY 13 -1.829 34.352 -47.893 106 HA3 GLY 13 HA3 GLY 13 -0.220 33.932 -47.332 107 H ALA 14 H ALA 14 -1.863 31.082 -48.270 108 HA ALA 14 HA ALA 14 -1.239 29.521 -49.727 109 HB1 ALA 14 3HB ALA 14 -2.865 30.769 -51.075 110 HB2 ALA 14 1HB ALA 14 -1.542 31.715 -51.798 111 HB3 ALA 14 2HB ALA 14 -1.645 29.964 -52.078 112 H VAL 15 H VAL 15 0.946 30.900 -48.471 113 HA VAL 15 HA VAL 15 3.134 29.574 -49.916 114 HB VAL 15 HB VAL 15 4.652 31.449 -49.318 115 HG11 VAL 15 1HG1 VAL 15 4.234 32.817 -51.274 116 HG12 VAL 15 2HG1 VAL 15 3.852 31.127 -51.647 117 HG13 VAL 15 3HG1 VAL 15 2.542 32.287 -51.335 118 HG21 VAL 15 3HG2 VAL 15 3.227 32.671 -47.689 119 HG22 VAL 15 1HG2 VAL 15 3.868 33.712 -48.967 120 HG23 VAL 15 2HG2 VAL 15 2.179 33.187 -49.026 121 H SER 16 H SER 16 4.883 29.053 -48.529 122 HA SER 16 HA SER 16 3.892 28.353 -45.851 123 HB2 SER 16 2HB SER 16 6.399 27.504 -47.334 124 HB3 SER 16 3HB SER 16 5.778 26.818 -45.826 125 HG SER 16 HG SER 16 4.100 25.918 -46.876 126 H TYR 17 H TYR 17 4.845 28.894 -43.909 127 HA TYR 17 HA TYR 17 7.290 30.507 -43.769 128 HB2 TYR 17 2HB TYR 17 6.097 32.456 -42.635 129 HB3 TYR 17 3HB TYR 17 5.928 32.332 -44.368 130 HD1 TYR 17 HD2 TYR 17 4.101 31.886 -41.133 131 HD2 TYR 17 HD1 TYR 17 3.812 31.952 -45.435 132 HE1 TYR 17 HE2 TYR 17 1.623 31.880 -40.967 133 HE2 TYR 17 HE1 TYR 17 1.334 31.953 -45.268 134 HH TYR 17 HH TYR 17 -0.344 31.867 -42.102 135 H GLU 18 H GLU 18 4.520 29.422 -42.042 136 HA GLU 18 HA GLU 18 6.028 28.305 -39.798 137 HB2 GLU 18 2HB GLU 18 5.748 30.846 -39.329 138 HB3 GLU 18 3HB GLU 18 4.034 30.511 -39.111 139 HG2 GLU 18 2HG GLU 18 4.629 28.888 -37.287 140 HG3 GLU 18 3HG GLU 18 6.337 29.207 -37.578 141 H THR 19 H THR 19 4.647 27.045 -41.667 142 HA THR 19 HA THR 19 1.754 27.095 -41.120 143 HB THR 19 HB THR 19 1.828 26.355 -43.645 144 HG1 THR 19 HG1 THR 19 4.052 26.097 -43.814 145 HG21 THR 19 1HG2 THR 19 2.585 29.147 -42.701 146 HG22 THR 19 2HG2 THR 19 1.948 28.741 -44.307 147 HG23 THR 19 3HG2 THR 19 0.938 28.504 -42.870 148 H ASP 20 H ASP 20 0.415 25.369 -41.152 149 HA ASP 20 HA ASP 20 1.626 22.628 -41.126 150 HB2 ASP 20 2HB ASP 20 1.121 23.632 -38.886 151 HB3 ASP 20 3HB ASP 20 -0.573 23.760 -39.356 152 H ARG 21 H ARG 21 0.340 20.901 -41.972 153 HA ARG 21 HA ARG 21 -1.458 21.682 -44.100 154 HB2 ARG 21 2HB ARG 21 -1.592 19.413 -44.724 155 HB3 ARG 21 3HB ARG 21 0.069 19.776 -44.323 156 HG2 ARG 21 2HG ARG 21 -1.867 18.204 -42.558 157 HG3 ARG 21 3HG ARG 21 -0.695 17.531 -43.667 158 HD2 ARG 21 2HD ARG 21 0.593 17.308 -41.862 159 HD3 ARG 21 3HD ARG 21 1.027 18.975 -42.184 160 HE ARG 21 HE ARG 21 -0.410 19.692 -40.363 161 HH11 ARG 21 1HH1 ARG 21 -0.436 16.176 -40.521 162 HH12 ARG 21 2HH1 ARG 21 -1.116 16.072 -38.919 163 HH21 ARG 21 1HH2 ARG 21 -1.195 19.508 -38.502 164 HH22 ARG 21 2HH2 ARG 21 -1.531 17.947 -37.750 165 H ASN 22 H ASN 22 -2.148 21.199 -40.839 166 HA ASN 22 HA ASN 22 -5.067 21.243 -41.397 167 HB2 ASN 22 2HB ASN 22 -4.297 18.919 -40.752 168 HB3 ASN 22 3HB ASN 22 -3.741 19.579 -39.212 169 HD21 ASN 22 2HD2 ASN 22 -5.352 17.763 -38.586 170 HD22 ASN 22 1HD2 ASN 22 -7.024 18.273 -38.400 171 H HIS 23 H HIS 23 -4.208 23.518 -41.289 172 HA HIS 23 HA HIS 23 -2.703 24.477 -39.173 173 HB2 HIS 23 2HB HIS 23 -3.074 25.342 -41.577 174 HB3 HIS 23 3HB HIS 23 -4.428 26.251 -40.922 175 HD2 HIS 23 HD2 HIS 23 -3.841 28.486 -39.609 176 HE1 HIS 23 HE1 HIS 23 0.408 28.239 -39.777 177 HE2 HIS 23 HE2 HIS 23 -1.561 29.724 -39.166 178 H ASP 24 H ASP 24 -6.228 24.508 -39.327 179 HA ASP 24 HA ASP 24 -6.315 25.313 -36.485 180 HB2 ASP 24 2HB ASP 24 -8.006 26.663 -38.626 181 HB3 ASP 24 3HB ASP 24 -8.306 26.772 -36.898 182 H LEU 25 H LEU 25 -8.133 24.604 -35.375 183 HA LEU 25 HA LEU 25 -10.193 22.987 -36.730 184 HB2 LEU 25 2HB LEU 25 -8.432 22.045 -34.426 185 HB3 LEU 25 3HB LEU 25 -9.981 21.305 -34.802 186 HG LEU 25 HG LEU 25 -7.619 21.382 -36.730 187 HD11 LEU 25 1HD1 LEU 25 -7.368 19.005 -36.170 188 HD12 LEU 25 2HD1 LEU 25 -7.168 20.011 -34.729 189 HD13 LEU 25 3HD1 LEU 25 -8.689 19.126 -34.984 190 HD21 LEU 25 3HD2 LEU 25 -8.923 19.636 -37.937 191 HD22 LEU 25 1HD2 LEU 25 -10.275 19.865 -36.809 192 HD23 LEU 25 2HD2 LEU 25 -9.782 21.173 -37.910 193 H ALA 26 H ALA 26 -12.166 23.093 -35.738 194 HA ALA 26 HA ALA 26 -13.868 24.052 -34.572 195 HB1 ALA 26 3HB ALA 26 -13.187 22.262 -33.107 196 HB2 ALA 26 1HB ALA 26 -12.020 23.318 -32.286 197 HB3 ALA 26 2HB ALA 26 -13.760 23.644 -32.152 198 HA PRO 27 HA PRO 27 -11.994 28.340 -34.337 199 HB2 PRO 27 2HB PRO 27 -14.031 29.581 -35.751 200 HB3 PRO 27 3HB PRO 27 -12.557 28.881 -36.484 201 HG2 PRO 27 2HG PRO 27 -15.276 27.563 -36.165 202 HG3 PRO 27 3HG PRO 27 -14.255 27.657 -37.640 203 HD2 PRO 27 2HD PRO 27 -14.199 25.456 -36.122 204 HD3 PRO 27 3HD PRO 27 -12.648 26.147 -36.710 205 H ARG 28 H ARG 28 -12.343 29.427 -32.647 206 HA ARG 28 HA ARG 28 -14.924 29.368 -31.154 207 HB2 ARG 28 2HB ARG 28 -13.899 28.422 -29.215 208 HB3 ARG 28 3HB ARG 28 -13.548 27.390 -30.595 209 HG2 ARG 28 2HG ARG 28 -11.276 28.689 -30.759 210 HG3 ARG 28 3HG ARG 28 -11.707 29.334 -29.179 211 HD2 ARG 28 2HD ARG 28 -10.348 27.535 -28.668 212 HD3 ARG 28 3HD ARG 28 -11.967 26.851 -28.442 213 HE ARG 28 HE ARG 28 -11.388 26.260 -31.085 214 HH11 ARG 28 1HH1 ARG 28 -9.763 25.478 -28.080 215 HH12 ARG 28 2HH1 ARG 28 -8.878 24.160 -28.798 216 HH21 ARG 28 1HH2 ARG 28 -10.113 24.662 -31.973 217 HH22 ARG 28 2HH2 ARG 28 -9.114 23.690 -30.929 218 H GLN 29 H GLN 29 -14.880 30.509 -29.108 219 HA GLN 29 HA GLN 29 -13.393 33.100 -29.062 220 HB2 GLN 29 2HB GLN 29 -16.390 32.790 -28.618 221 HB3 GLN 29 3HB GLN 29 -15.462 34.285 -28.576 222 HG2 GLN 29 2HG GLN 29 -15.828 34.615 -30.769 223 HG3 GLN 29 3HG GLN 29 -15.104 33.059 -31.174 224 HE21 GLN 29 1HE2 GLN 29 -16.733 31.177 -30.152 225 HE22 GLN 29 2HE2 GLN 29 -18.338 31.314 -30.867 226 H ILE 30 H ILE 30 -12.222 32.592 -27.182 227 HA ILE 30 HA ILE 30 -13.547 31.663 -24.754 228 HB ILE 30 HB ILE 30 -10.758 32.756 -25.258 229 HG12 ILE 30 2HG1 ILE 30 -10.048 30.465 -24.789 230 HG13 ILE 30 3HG1 ILE 30 -11.726 29.964 -24.550 231 HG21 ILE 30 1HG2 ILE 30 -11.383 33.266 -22.923 232 HG22 ILE 30 2HG2 ILE 30 -12.036 31.623 -22.718 233 HG23 ILE 30 3HG2 ILE 30 -10.291 31.890 -22.931 234 HD11 ILE 30 3HD1 ILE 30 -10.639 29.213 -26.678 235 HD12 ILE 30 1HD1 ILE 30 -12.183 30.041 -26.876 236 HD13 ILE 30 2HD1 ILE 30 -10.650 30.904 -27.218 237 H ALA 31 H ALA 31 -14.991 32.915 -23.893 238 HA ALA 31 HA ALA 31 -14.418 35.805 -23.374 239 HB1 ALA 31 3HB ALA 31 -16.964 34.160 -23.118 240 HB2 ALA 31 1HB ALA 31 -16.793 35.847 -22.580 241 HB3 ALA 31 2HB ALA 31 -16.607 35.448 -24.296 242 H ARG 32 H ARG 32 -14.552 36.560 -21.218 243 HA ARG 32 HA ARG 32 -14.179 34.499 -19.076 244 HB2 ARG 32 2HB ARG 32 -12.738 37.046 -19.595 245 HB3 ARG 32 3HB ARG 32 -13.373 36.913 -17.954 246 HG2 ARG 32 2HG ARG 32 -12.327 34.749 -17.639 247 HG3 ARG 32 3HG ARG 32 -11.677 34.794 -19.294 248 HD2 ARG 32 2HD ARG 32 -10.200 36.573 -18.758 249 HD3 ARG 32 3HD ARG 32 -11.042 36.931 -17.236 250 HE ARG 32 HE ARG 32 -9.599 34.338 -17.688 251 HH11 ARG 32 1HH1 ARG 32 -10.081 37.093 -15.470 252 HH12 ARG 32 2HH1 ARG 32 -8.889 36.436 -14.390 253 HH21 ARG 32 1HH2 ARG 32 -8.498 33.470 -16.058 254 HH22 ARG 32 2HH2 ARG 32 -8.052 34.444 -14.675 255 H TYR 33 H TYR 33 -15.248 34.798 -17.126 256 HA TYR 33 HA TYR 33 -17.336 36.898 -16.971 257 HB2 TYR 33 2HB TYR 33 -17.911 33.963 -16.543 258 HB3 TYR 33 3HB TYR 33 -18.978 35.277 -16.150 259 HD1 TYR 33 HD2 TYR 33 -17.297 33.551 -19.005 260 HD2 TYR 33 HD1 TYR 33 -20.415 36.224 -17.736 261 HE1 TYR 33 HE2 TYR 33 -18.379 33.373 -21.246 262 HE2 TYR 33 HE1 TYR 33 -21.488 36.054 -19.977 263 HH TYR 33 HH TYR 33 -21.468 35.063 -21.961 264 H ARG 34 H ARG 34 -17.619 37.711 -14.970 265 HA ARG 34 HA ARG 34 -15.990 36.642 -12.719 266 HB2 ARG 34 2HB ARG 34 -15.479 38.920 -13.519 267 HB3 ARG 34 3HB ARG 34 -17.131 39.429 -13.180 268 HG2 ARG 34 2HG ARG 34 -16.824 39.299 -10.840 269 HG3 ARG 34 3HG ARG 34 -15.477 38.161 -10.984 270 HD2 ARG 34 2HD ARG 34 -14.642 40.327 -10.283 271 HD3 ARG 34 3HD ARG 34 -14.025 39.875 -11.864 272 HE ARG 34 HE ARG 34 -16.326 41.768 -11.522 273 HH11 ARG 34 1HH2 ARG 34 -13.184 41.142 -13.082 274 HH12 ARG 34 2HH2 ARG 34 -13.187 42.731 -13.792 275 HH21 ARG 34 1HH1 ARG 34 -16.227 43.708 -12.558 276 HH22 ARG 34 2HH1 ARG 34 -14.861 44.104 -13.554 277 H THR 35 H THR 35 -16.901 35.782 -11.020 278 HA THR 35 HA THR 35 -19.808 35.570 -10.768 279 HB THR 35 HB THR 35 -19.394 34.134 -8.844 280 HG1 THR 35 HG1 THR 35 -16.673 34.522 -9.372 281 HG21 THR 35 1HG2 THR 35 -17.587 33.446 -11.181 282 HG22 THR 35 2HG2 THR 35 -18.210 32.352 -9.931 283 HG23 THR 35 3HG2 THR 35 -19.336 33.138 -11.057 284 H ASP 36 H ASP 36 -20.596 35.694 -8.318 285 HA ASP 36 HA ASP 36 -20.451 38.495 -7.696 286 HB2 ASP 36 2HB ASP 36 -22.522 37.096 -7.584 287 HB3 ASP 36 3HB ASP 36 -21.841 36.229 -6.205 288 H ASN 37 H ASN 37 -18.516 35.832 -6.583 289 HA ASN 37 HA ASN 37 -17.682 37.368 -4.171 290 HB2 ASN 37 2HB ASN 37 -16.278 34.927 -5.090 291 HB3 ASN 37 3HB ASN 37 -16.394 35.605 -3.505 292 HD21 ASN 37 1HD2 ASN 37 -16.850 32.925 -4.501 293 HD22 ASN 37 2HD2 ASN 37 -18.451 32.497 -3.850 294 H GLY 38 H GLY 38 -17.131 37.795 -7.384 295 HA2 GLY 38 HA2 GLY 38 -15.504 39.033 -8.510 296 HA3 GLY 38 HA3 GLY 38 -14.392 38.893 -7.145 297 H GLU 39 H GLU 39 -15.610 35.807 -7.816 298 HA GLU 39 HA GLU 39 -12.968 34.963 -8.699 299 HB2 GLU 39 2HB GLU 39 -15.355 33.136 -8.832 300 HB3 GLU 39 3HB GLU 39 -13.683 32.775 -8.495 301 HG2 GLU 39 2HG GLU 39 -14.258 34.355 -6.346 302 HG3 GLU 39 3HG GLU 39 -15.896 33.816 -6.787 303 H GLU 40 H GLU 40 -12.278 35.146 -10.753 304 HA GLU 40 HA GLU 40 -14.245 35.224 -12.982 305 HB2 GLU 40 2HB GLU 40 -11.364 36.102 -12.707 306 HB3 GLU 40 3HB GLU 40 -12.098 35.817 -14.294 307 HG2 GLU 40 2HG GLU 40 -13.908 37.374 -13.785 308 HG3 GLU 40 3HG GLU 40 -13.208 37.709 -12.201 309 H PHE 41 H PHE 41 -14.511 33.764 -14.442 310 HA PHE 41 HA PHE 41 -12.552 31.532 -14.814 311 HB2 PHE 41 2HB PHE 41 -15.578 31.384 -14.747 312 HB3 PHE 41 3HB PHE 41 -14.535 30.078 -15.214 313 HD1 PHE 41 HD2 PHE 41 -15.613 32.150 -12.241 314 HD2 PHE 41 HD1 PHE 41 -13.361 28.719 -13.634 315 HE1 PHE 41 HE2 PHE 41 -15.306 31.391 -9.958 316 HE2 PHE 41 HE1 PHE 41 -13.031 27.993 -11.289 317 HZ PHE 41 HZ PHE 41 -13.989 29.339 -9.432 318 H GLU 42 H GLU 42 -12.660 30.505 -16.818 319 HA GLU 42 HA GLU 42 -13.372 32.315 -19.071 320 HB2 GLU 42 2HB GLU 42 -11.375 30.029 -19.207 321 HB3 GLU 42 3HB GLU 42 -11.645 31.375 -20.310 322 HG2 GLU 42 2HG GLU 42 -9.781 32.145 -19.284 323 HG3 GLU 42 3HG GLU 42 -11.018 32.876 -18.269 324 H VAL 43 H VAL 43 -14.774 31.754 -20.577 325 HA VAL 43 HA VAL 43 -15.702 28.902 -20.782 326 HB VAL 43 HB VAL 43 -17.415 31.350 -21.220 327 HG11 VAL 43 1HG1 VAL 43 -18.128 28.402 -20.965 328 HG12 VAL 43 2HG1 VAL 43 -19.237 29.761 -21.269 329 HG13 VAL 43 3HG1 VAL 43 -18.066 29.302 -22.496 330 HG21 VAL 43 3HG2 VAL 43 -16.806 31.127 -18.800 331 HG22 VAL 43 1HG2 VAL 43 -18.501 30.873 -19.148 332 HG23 VAL 43 2HG2 VAL 43 -17.449 29.468 -18.835 333 HA PRO 44 HA PRO 44 -14.417 29.713 -25.072 334 HB2 PRO 44 2HB PRO 44 -14.382 26.749 -25.253 335 HB3 PRO 44 3HB PRO 44 -13.114 27.924 -25.686 336 HG2 PRO 44 2HG PRO 44 -12.934 26.342 -23.450 337 HG3 PRO 44 3HG PRO 44 -12.324 28.026 -23.461 338 HD2 PRO 44 2HD PRO 44 -14.967 27.001 -22.390 339 HD3 PRO 44 3HD PRO 44 -13.806 28.167 -21.673 340 H PHE 45 H PHE 45 -15.976 30.220 -26.385 341 HA PHE 45 HA PHE 45 -18.406 28.524 -26.835 342 HB2 PHE 45 2HB PHE 45 -17.751 31.436 -27.342 343 HB3 PHE 45 3HB PHE 45 -19.108 30.673 -28.113 344 HD1 PHE 45 HD1 PHE 45 -17.628 31.659 -24.840 345 HD2 PHE 45 HD2 PHE 45 -21.149 30.181 -26.851 346 HE1 PHE 45 HE1 PHE 45 -18.975 32.064 -22.806 347 HE2 PHE 45 HE2 PHE 45 -22.491 30.598 -24.793 348 HZ PHE 45 HZ PHE 45 -21.378 31.517 -22.749 349 H ALA 46 H ALA 46 -18.942 27.848 -28.918 350 HA ALA 46 HA ALA 46 -16.715 27.707 -30.880 351 HB1 ALA 46 3HB ALA 46 -17.954 25.640 -30.330 352 HB2 ALA 46 1HB ALA 46 -19.470 26.397 -30.877 353 HB3 ALA 46 2HB ALA 46 -18.157 26.086 -32.035 354 H ASP 47 H ASP 47 -17.068 28.326 -33.127 355 HA ASP 47 HA ASP 47 -18.157 30.886 -33.531 356 HB2 ASP 47 2HB ASP 47 -16.375 29.830 -34.866 357 HB3 ASP 47 3HB ASP 47 -17.539 28.692 -35.547 358 H ASP 48 H ASP 48 -19.840 27.857 -33.585 359 HA ASP 48 HA ASP 48 -22.193 28.688 -35.091 360 HB2 ASP 48 2HB ASP 48 -21.404 26.335 -34.781 361 HB3 ASP 48 3HB ASP 48 -21.799 26.457 -33.069 362 H ALA 49 H ALA 49 -21.033 29.483 -31.991 363 HA ALA 49 HA ALA 49 -23.701 30.388 -30.985 364 HB1 ALA 49 3HB ALA 49 -21.274 29.465 -29.392 365 HB2 ALA 49 1HB ALA 49 -22.835 29.991 -28.733 366 HB3 ALA 49 2HB ALA 49 -22.740 28.497 -29.683 367 H GLU 50 H GLU 50 -23.532 32.264 -29.473 368 HA GLU 50 HA GLU 50 -21.135 33.960 -29.750 369 HB2 GLU 50 2HB GLU 50 -22.329 35.932 -30.287 370 HB3 GLU 50 3HB GLU 50 -22.772 34.694 -31.465 371 HG2 GLU 50 2HG GLU 50 -24.880 34.278 -30.122 372 HG3 GLU 50 3HG GLU 50 -24.453 35.663 -29.115 373 H ILE 51 H ILE 51 -20.764 35.324 -28.057 374 HA ILE 51 HA ILE 51 -21.203 34.339 -25.512 375 HB ILE 51 HB ILE 51 -20.279 37.163 -26.064 376 HG12 ILE 51 2HG1 ILE 51 -19.073 35.789 -27.671 377 HG13 ILE 51 3HG1 ILE 51 -18.003 36.372 -26.398 378 HG21 ILE 51 1HG2 ILE 51 -20.553 36.491 -23.670 379 HG22 ILE 51 2HG2 ILE 51 -19.454 35.136 -23.947 380 HG23 ILE 51 3HG2 ILE 51 -18.864 36.791 -24.094 381 HD11 ILE 51 3HD1 ILE 51 -17.457 34.089 -26.993 382 HD12 ILE 51 1HD1 ILE 51 -18.107 34.082 -25.356 383 HD13 ILE 51 2HD1 ILE 51 -19.127 33.563 -26.719 384 HA PRO 52 HA PRO 52 -25.022 36.639 -24.495 385 HB2 PRO 52 2HB PRO 52 -25.695 35.125 -22.338 386 HB3 PRO 52 3HB PRO 52 -26.013 34.597 -24.020 387 HG2 PRO 52 2HG PRO 52 -23.755 33.791 -22.178 388 HG3 PRO 52 3HG PRO 52 -24.738 32.757 -23.277 389 HD2 PRO 52 2HD PRO 52 -22.213 33.783 -23.879 390 HD3 PRO 52 3HD PRO 52 -23.393 33.341 -25.109 391 H GLY 53 H GLY 53 -25.322 38.174 -22.899 392 HA2 GLY 53 HA2 GLY 53 -23.241 39.538 -21.735 393 HA3 GLY 53 HA3 GLY 53 -24.909 39.622 -21.160 394 H THR 54 H THR 54 -24.905 36.779 -20.207 395 HA THR 54 HA THR 54 -22.724 36.700 -18.261 396 HB THR 54 HB THR 54 -24.285 36.112 -16.393 397 HG1 THR 54 HG1 THR 54 -26.356 36.936 -18.170 398 HG21 THR 54 1HG2 THR 54 -25.313 38.227 -15.882 399 HG22 THR 54 2HG2 THR 54 -23.752 38.520 -16.644 400 HG23 THR 54 3HG2 THR 54 -25.229 38.749 -17.580 401 H TRP 55 H TRP 55 -22.502 34.573 -17.176 402 HA TRP 55 HA TRP 55 -23.850 32.244 -18.331 403 HB2 TRP 55 2HB TRP 55 -22.078 32.921 -20.016 404 HB3 TRP 55 3HB TRP 55 -20.872 32.610 -18.776 405 HD1 TRP 55 HD1 TRP 55 -20.302 30.116 -18.245 406 HE1 TRP 55 HE1 TRP 55 -20.622 27.941 -19.532 407 HE3 TRP 55 HE3 TRP 55 -23.933 31.656 -21.451 408 HZ2 TRP 55 HZ2 TRP 55 -22.389 26.924 -21.610 409 HZ3 TRP 55 HZ3 TRP 55 -24.960 30.061 -23.078 410 HH2 TRP 55 HH2 TRP 55 -24.186 27.701 -23.165 411 H LEU 56 H LEU 56 -23.491 30.323 -17.109 412 HA LEU 56 HA LEU 56 -22.799 30.778 -14.361 413 HB2 LEU 56 2HB LEU 56 -24.413 28.999 -15.744 414 HB3 LEU 56 3HB LEU 56 -23.067 27.976 -15.235 415 HG LEU 56 HG LEU 56 -24.655 29.758 -13.346 416 HD11 LEU 56 1HD1 LEU 56 -25.811 27.693 -12.644 417 HD12 LEU 56 2HD1 LEU 56 -26.122 28.048 -14.348 418 HD13 LEU 56 3HD1 LEU 56 -24.960 26.775 -13.908 419 HD21 LEU 56 3HD2 LEU 56 -23.715 28.264 -11.599 420 HD22 LEU 56 1HD2 LEU 56 -22.763 27.416 -12.841 421 HD23 LEU 56 2HD2 LEU 56 -22.440 29.117 -12.473 422 H CYS 57 H CYS 57 -20.958 30.552 -13.337 423 HA CYS 57 HA CYS 57 -18.556 29.566 -14.775 424 HB2 CYS 57 2HB CYS 57 -18.996 31.314 -12.328 425 HB3 CYS 57 3HB CYS 57 -17.402 30.759 -12.855 426 HG CYS 57 HG CYS 57 -19.633 32.280 -14.767 427 H ARG 58 H ARG 58 -16.873 28.431 -13.539 428 HA ARG 58 HA ARG 58 -17.971 25.990 -12.494 429 HB2 ARG 58 2HB ARG 58 -15.040 26.793 -12.531 430 HB3 ARG 58 3HB ARG 58 -15.708 25.164 -12.433 431 HG2 ARG 58 2HG ARG 58 -16.763 25.524 -14.704 432 HG3 ARG 58 3HG ARG 58 -15.905 27.074 -14.795 433 HD2 ARG 58 2HD ARG 58 -13.729 25.845 -14.558 434 HD3 ARG 58 3HD ARG 58 -14.625 24.325 -14.567 435 HE ARG 58 HE ARG 58 -14.969 24.509 -16.859 436 HH11 ARG 58 1HH2 ARG 58 -13.632 27.583 -15.795 437 HH12 ARG 58 2HH2 ARG 58 -13.729 28.240 -17.428 438 HH21 ARG 58 1HH1 ARG 58 -14.920 25.471 -18.913 439 HH22 ARG 58 2HH1 ARG 58 -14.357 27.131 -19.036 440 H ASN 59 H ASN 59 -17.158 28.826 -10.798 441 HA ASN 59 HA ASN 59 -16.790 27.686 -8.189 442 HB2 ASN 59 2HB ASN 59 -16.184 29.939 -8.655 443 HB3 ASN 59 3HB ASN 59 -17.822 30.345 -9.188 444 HD21 ASN 59 1HD2 ASN 59 -17.859 32.142 -7.758 445 HD22 ASN 59 2HD2 ASN 59 -17.959 31.904 -6.024 446 H GLY 60 H GLY 60 -19.539 27.875 -10.277 447 HA2 GLY 60 HA2 GLY 60 -21.618 26.815 -9.988 448 HA3 GLY 60 HA3 GLY 60 -21.420 26.820 -8.234 449 H MET 61 H MET 61 -20.703 29.815 -9.870 450 HA MET 61 HA MET 61 -23.354 30.950 -9.122 451 HB2 MET 61 2HB MET 61 -21.438 31.589 -7.601 452 HB3 MET 61 3HB MET 61 -20.653 32.350 -8.963 453 HG2 MET 61 2HG MET 61 -21.880 33.955 -7.528 454 HG3 MET 61 3HG MET 61 -22.424 33.974 -9.202 455 HE1 MET 61 3HE MET 61 -24.525 35.343 -8.653 456 HE2 MET 61 1HE MET 61 -25.745 34.906 -7.435 457 HE3 MET 61 2HE MET 61 -24.126 35.417 -6.918 458 H GLU 62 H GLU 62 -24.220 32.560 -10.442 459 HA GLU 62 HA GLU 62 -23.630 32.509 -13.274 460 HB2 GLU 62 2HB GLU 62 -25.318 34.343 -11.537 461 HB3 GLU 62 3HB GLU 62 -25.207 34.512 -13.285 462 HG2 GLU 62 2HG GLU 62 -26.165 31.982 -11.873 463 HG3 GLU 62 3HG GLU 62 -27.222 33.276 -12.420 464 H GLY 63 H GLY 63 -21.837 33.290 -14.109 465 HA2 GLY 63 HA2 GLY 63 -20.382 35.553 -12.928 466 HA3 GLY 63 HA3 GLY 63 -19.837 34.540 -14.241 467 H THR 64 H THR 64 -20.047 37.537 -14.030 468 HA THR 64 HA THR 64 -21.754 37.999 -16.437 469 HB THR 64 HB THR 64 -20.629 40.049 -14.491 470 HG1 THR 64 HG1 THR 64 -22.274 38.821 -13.575 471 HG21 THR 64 1HG2 THR 64 -20.974 41.153 -16.613 472 HG22 THR 64 2HG2 THR 64 -22.531 40.342 -16.866 473 HG23 THR 64 3HG2 THR 64 -22.351 41.563 -15.586 474 H LEU 65 H LEU 65 -20.987 38.846 -18.281 475 HA LEU 65 HA LEU 65 -18.435 38.033 -19.073 476 HB2 LEU 65 2HB LEU 65 -20.545 38.219 -20.366 477 HB3 LEU 65 3HB LEU 65 -20.394 39.959 -20.363 478 HG LEU 65 HG LEU 65 -18.790 37.858 -21.859 479 HD11 LEU 65 1HD1 LEU 65 -20.977 38.650 -22.751 480 HD12 LEU 65 2HD1 LEU 65 -20.369 40.317 -22.750 481 HD13 LEU 65 3HD1 LEU 65 -19.635 39.101 -23.814 482 HD21 LEU 65 3HD2 LEU 65 -17.038 39.387 -21.323 483 HD22 LEU 65 1HD2 LEU 65 -17.535 39.738 -22.967 484 HD23 LEU 65 2HD2 LEU 65 -18.077 40.808 -21.654 485 H ILE 66 H ILE 66 -16.492 38.888 -18.787 486 HA ILE 66 HA ILE 66 -16.055 41.807 -19.061 487 HB ILE 66 HB ILE 66 -14.264 41.817 -17.492 488 HG12 ILE 66 2HG1 ILE 66 -13.441 39.499 -17.633 489 HG13 ILE 66 3HG1 ILE 66 -13.639 40.057 -15.992 490 HG21 ILE 66 1HG2 ILE 66 -16.808 40.766 -16.195 491 HG22 ILE 66 2HG2 ILE 66 -15.504 41.631 -15.375 492 HG23 ILE 66 3HG2 ILE 66 -16.441 42.440 -16.646 493 HD11 ILE 66 3HD1 ILE 66 -15.483 38.181 -17.381 494 HD12 ILE 66 1HD1 ILE 66 -14.347 37.801 -16.084 495 HD13 ILE 66 2HD1 ILE 66 -15.751 38.839 -15.770 496 H GLU 67 H GLU 67 -13.956 42.363 -19.963 497 HA GLU 67 HA GLU 67 -13.312 40.633 -22.150 498 HB2 GLU 67 2HB GLU 67 -13.212 43.197 -22.054 499 HB3 GLU 67 3HB GLU 67 -11.657 43.006 -21.248 500 HG2 GLU 67 2HG GLU 67 -11.212 43.353 -23.561 501 HG3 GLU 67 3HG GLU 67 -10.874 41.657 -23.251 502 H GLY 68 H GLY 68 -11.973 39.007 -22.309 503 HA2 GLY 68 HA2 GLY 68 -9.903 38.293 -20.369 504 HA3 GLY 68 HA3 GLY 68 -10.246 37.497 -21.910 505 H ASP 69 H ASP 69 -9.078 40.655 -20.724 506 HA ASP 69 HA ASP 69 -7.710 41.275 -23.182 507 HB2 ASP 69 2HB ASP 69 -8.982 42.890 -21.823 508 HB3 ASP 69 3HB ASP 69 -7.797 42.746 -20.527 509 H LEU 70 H LEU 70 -6.405 39.177 -22.848 510 HA LEU 70 HA LEU 70 -3.957 39.333 -21.289 511 HB2 LEU 70 2HB LEU 70 -4.786 37.542 -23.600 512 HB3 LEU 70 3HB LEU 70 -3.328 37.312 -22.642 513 HG LEU 70 HG LEU 70 -6.138 37.223 -21.462 514 HD11 LEU 70 1HD1 LEU 70 -4.302 34.946 -22.297 515 HD12 LEU 70 2HD1 LEU 70 -5.856 34.787 -21.445 516 HD13 LEU 70 3HD1 LEU 70 -5.819 35.419 -23.098 517 HD21 LEU 70 3HD2 LEU 70 -5.006 36.086 -19.575 518 HD22 LEU 70 1HD2 LEU 70 -3.431 36.355 -20.354 519 HD23 LEU 70 2HD2 LEU 70 -4.404 37.733 -19.788 520 HA PRO 71 HA PRO 71 -1.528 41.672 -24.191 521 HB2 PRO 71 2HB PRO 71 0.999 41.252 -23.323 522 HB3 PRO 71 3HB PRO 71 -0.240 41.992 -22.274 523 HG2 PRO 71 2HG PRO 71 0.568 39.060 -22.368 524 HG3 PRO 71 3HG PRO 71 0.495 40.135 -20.933 525 HD2 PRO 71 2HD PRO 71 -1.576 38.491 -21.627 526 HD3 PRO 71 3HD PRO 71 -1.852 40.104 -20.906 527 H GLU 72 H GLU 72 -2.554 39.734 -25.595 528 HA GLU 72 HA GLU 72 -2.414 37.907 -26.979 529 HB2 GLU 72 2HB GLU 72 -1.310 38.576 -29.104 530 HB3 GLU 72 3HB GLU 72 -2.464 39.713 -28.431 531 HG2 GLU 72 2HG GLU 72 -0.738 41.214 -27.682 532 HG3 GLU 72 3HG GLU 72 0.525 40.038 -28.019 533 HA PRO 73 HA PRO 73 1.573 36.163 -25.318 534 HB2 PRO 73 2HB PRO 73 -0.247 33.934 -24.430 535 HB3 PRO 73 3HB PRO 73 1.141 34.671 -23.574 536 HG2 PRO 73 2HG PRO 73 -1.381 35.316 -22.865 537 HG3 PRO 73 3HG PRO 73 -0.145 36.612 -23.010 538 HD2 PRO 73 2HD PRO 73 -2.221 35.764 -25.061 539 HD3 PRO 73 3HD PRO 73 -1.848 37.394 -24.446 540 H LYS 74 H LYS 74 2.897 34.758 -26.305 541 HA LYS 74 HA LYS 74 1.930 32.458 -27.892 542 HB2 LYS 74 2HB LYS 74 1.904 34.365 -29.488 543 HB3 LYS 74 3HB LYS 74 3.625 34.635 -29.201 544 HG2 LYS 74 2HG LYS 74 4.127 32.363 -30.085 545 HG3 LYS 74 3HG LYS 74 2.392 32.066 -30.307 546 HD2 LYS 74 2HD LYS 74 2.280 33.950 -31.923 547 HD3 LYS 74 3HD LYS 74 4.019 34.245 -31.699 548 HE2 LYS 74 2HE LYS 74 4.508 31.946 -32.513 549 HE3 LYS 74 3HE LYS 74 2.779 31.650 -32.728 550 HZ1 LYS 74 HZ1 LYS 74 3.823 32.289 -34.816 551 HZ2 LYS 74 HZ2 LYS 74 2.746 33.440 -34.381 552 HZ3 LYS 74 HZ3 LYS 74 4.352 33.703 -34.188 553 H LYS 75 H LYS 75 4.961 34.301 -27.391 554 HA LYS 75 HA LYS 75 6.433 31.799 -26.763 555 HB2 LYS 75 2HB LYS 75 7.231 33.503 -28.462 556 HB3 LYS 75 3HB LYS 75 7.570 34.595 -27.115 557 HG2 LYS 75 2HG LYS 75 9.111 32.876 -26.152 558 HG3 LYS 75 3HG LYS 75 8.755 31.788 -27.496 559 HD2 LYS 75 2HD LYS 75 9.891 34.591 -27.921 560 HD3 LYS 75 3HD LYS 75 10.919 33.193 -27.579 561 HE2 LYS 75 2HE LYS 75 10.007 31.990 -29.537 562 HE3 LYS 75 3HE LYS 75 8.976 33.376 -29.918 563 HZ1 LYS 75 HZ1 LYS 75 11.024 33.412 -31.221 564 HZ2 LYS 75 HZ2 LYS 75 10.996 34.708 -30.230 565 HZ3 LYS 75 HZ3 LYS 75 11.948 33.428 -29.878 566 H VAL 76 H VAL 76 4.821 31.880 -24.869 567 HA VAL 76 HA VAL 76 6.082 33.125 -22.458 568 HB VAL 76 HB VAL 76 3.111 33.152 -23.130 569 HG11 VAL 76 1HG1 VAL 76 4.597 34.226 -20.688 570 HG12 VAL 76 2HG1 VAL 76 2.889 34.529 -21.068 571 HG13 VAL 76 3HG1 VAL 76 3.416 32.891 -20.706 572 HG21 VAL 76 3HG2 VAL 76 5.129 35.431 -22.912 573 HG22 VAL 76 1HG2 VAL 76 4.296 34.900 -24.388 574 HG23 VAL 76 2HG2 VAL 76 3.373 35.635 -23.078 575 H LYS 77 H LYS 77 6.041 31.912 -20.639 576 HA LYS 77 HA LYS 77 4.647 29.279 -20.606 577 HB2 LYS 77 2HB LYS 77 7.568 29.799 -19.902 578 HB3 LYS 77 3HB LYS 77 6.693 28.323 -19.492 579 HG2 LYS 77 2HG LYS 77 6.269 27.893 -21.913 580 HG3 LYS 77 3HG LYS 77 7.168 29.360 -22.321 581 HD2 LYS 77 2HD LYS 77 8.611 27.480 -22.657 582 HD3 LYS 77 3HD LYS 77 9.211 28.402 -21.272 583 HE2 LYS 77 2HE LYS 77 8.156 26.766 -19.724 584 HE3 LYS 77 3HE LYS 77 7.500 25.875 -21.104 585 HZ1 LYS 77 HZ1 LYS 77 9.787 25.417 -21.808 586 HZ2 LYS 77 HZ2 LYS 77 10.394 26.246 -20.538 587 HZ3 LYS 77 HZ3 LYS 77 9.555 24.869 -20.290 588 HA PRO 78 HA PRO 78 3.332 30.365 -16.546 589 HB2 PRO 78 2HB PRO 78 4.201 27.621 -15.631 590 HB3 PRO 78 3HB PRO 78 2.642 28.459 -15.351 591 HG2 PRO 78 2HG PRO 78 2.818 26.552 -17.257 592 HG3 PRO 78 3HG PRO 78 1.957 28.087 -17.619 593 HD2 PRO 78 2HD PRO 78 4.801 27.312 -18.341 594 HD3 PRO 78 3HD PRO 78 3.527 28.037 -19.368 595 HA PRO 79 HA PRO 79 6.953 31.617 -14.296 596 HB2 PRO 79 2HB PRO 79 5.934 32.564 -11.956 597 HB3 PRO 79 3HB PRO 79 5.570 33.320 -13.537 598 HG2 PRO 79 2HG PRO 79 3.886 31.292 -12.017 599 HG3 PRO 79 3HG PRO 79 3.366 32.867 -12.704 600 HD2 PRO 79 2HD PRO 79 3.016 30.526 -14.055 601 HD3 PRO 79 3HD PRO 79 3.441 32.040 -14.910 602 H ARG 80 H ARG 80 5.105 28.965 -13.063 603 HA ARG 80 HA ARG 80 7.354 27.997 -11.364 604 HB2 ARG 80 2HB ARG 80 4.413 28.006 -10.580 605 HB3 ARG 80 3HB ARG 80 5.681 27.165 -9.704 606 HG2 ARG 80 2HG ARG 80 5.575 30.199 -10.102 607 HG3 ARG 80 3HG ARG 80 4.950 29.355 -8.697 608 HD2 ARG 80 2HD ARG 80 7.858 29.292 -9.581 609 HD3 ARG 80 3HD ARG 80 7.193 30.343 -8.324 610 HE ARG 80 HE ARG 80 6.464 27.772 -7.548 611 HH11 ARG 80 1HH1 ARG 80 9.522 29.394 -8.074 612 HH12 ARG 80 2HH1 ARG 80 10.359 28.382 -6.927 613 HH21 ARG 80 1HH2 ARG 80 7.592 26.516 -6.109 614 HH22 ARG 80 2HH2 ARG 80 9.287 26.802 -5.845 Start of MODEL 29 1 H1 SER 1 1H SER 1 -4.800 9.697 -57.134 2 H2 SER 1 2H SER 1 -5.647 11.108 -57.049 3 H3 SER 1 3H SER 1 -6.015 9.860 -56.057 4 HA SER 1 HA SER 1 -4.839 11.495 -54.807 5 HB2 SER 1 2HB SER 1 -2.924 10.077 -54.016 6 HB3 SER 1 3HB SER 1 -4.489 9.247 -54.070 7 HG SER 1 HG SER 1 -2.859 7.960 -54.999 8 H MET 2 H MET 2 -2.311 10.134 -56.993 9 HA MET 2 HA MET 2 -0.546 12.259 -56.493 10 HB2 MET 2 2HB MET 2 -0.539 10.211 -58.743 11 HB3 MET 2 3HB MET 2 0.832 11.237 -58.303 12 HG2 MET 2 2HG MET 2 0.826 10.278 -56.018 13 HG3 MET 2 3HG MET 2 -0.487 9.191 -56.484 14 HE1 MET 2 3HE MET 2 0.890 7.125 -55.616 15 HE2 MET 2 1HE MET 2 2.559 6.769 -56.111 16 HE3 MET 2 2HE MET 2 2.213 8.217 -55.142 17 H ALA 3 H ALA 3 -3.160 12.499 -58.660 18 HA ALA 3 HA ALA 3 -1.929 14.520 -60.401 19 HB1 ALA 3 3HB ALA 3 -4.813 13.582 -60.108 20 HB2 ALA 3 1HB ALA 3 -4.165 14.609 -61.403 21 HB3 ALA 3 2HB ALA 3 -3.614 12.930 -61.252 22 H ASP 4 H ASP 4 -3.342 14.592 -57.232 23 HA ASP 4 HA ASP 4 -4.358 17.350 -57.424 24 HB2 ASP 4 2HB ASP 4 -5.515 15.732 -56.021 25 HB3 ASP 4 3HB ASP 4 -4.045 15.432 -55.091 26 H ARG 5 H ARG 5 -2.907 18.933 -57.625 27 HA ARG 5 HA ARG 5 -0.458 19.025 -55.914 28 HB2 ARG 5 2HB ARG 5 -0.480 19.408 -58.944 29 HB3 ARG 5 3HB ARG 5 0.918 19.585 -57.874 30 HG2 ARG 5 2HG ARG 5 0.737 17.169 -57.260 31 HG3 ARG 5 3HG ARG 5 -0.611 17.004 -58.400 32 HD2 ARG 5 2HD ARG 5 0.909 17.773 -60.241 33 HD3 ARG 5 3HD ARG 5 2.257 17.712 -59.079 34 HE ARG 5 HE ARG 5 0.765 15.238 -59.059 35 HH11 ARG 5 2HH1 ARG 5 3.143 16.839 -61.085 36 HH12 ARG 5 1HH1 ARG 5 3.676 15.327 -61.772 37 HH21 ARG 5 2HH2 ARG 5 1.432 13.440 -59.940 38 HH22 ARG 5 1HH2 ARG 5 2.724 13.407 -61.124 39 H VAL 6 H VAL 6 0.519 21.052 -55.713 40 HA VAL 6 HA VAL 6 -1.351 23.305 -55.743 41 HB VAL 6 HB VAL 6 0.343 24.496 -54.427 42 HG11 VAL 6 1HG1 VAL 6 -0.169 21.685 -53.380 43 HG12 VAL 6 2HG1 VAL 6 0.208 23.134 -52.430 44 HG13 VAL 6 3HG1 VAL 6 -1.317 23.040 -53.325 45 HG21 VAL 6 3HG2 VAL 6 2.410 23.491 -55.406 46 HG22 VAL 6 1HG2 VAL 6 2.369 23.392 -53.641 47 HG23 VAL 6 2HG2 VAL 6 2.023 21.949 -54.609 48 H LEU 7 H LEU 7 -0.172 22.310 -58.306 49 HA LEU 7 HA LEU 7 1.460 24.519 -59.343 50 HB2 LEU 7 2HB LEU 7 0.171 22.119 -60.706 51 HB3 LEU 7 3HB LEU 7 1.320 23.218 -61.460 52 HG LEU 7 HG LEU 7 1.943 21.415 -59.077 53 HD11 LEU 7 1HD1 LEU 7 1.558 20.165 -61.169 54 HD12 LEU 7 2HD1 LEU 7 2.750 21.187 -62.002 55 HD13 LEU 7 3HD1 LEU 7 3.261 20.114 -60.679 56 HD21 LEU 7 3HD2 LEU 7 3.380 23.404 -59.048 57 HD22 LEU 7 1HD2 LEU 7 4.308 21.994 -59.566 58 HD23 LEU 7 2HD2 LEU 7 3.762 23.181 -60.772 59 H ARG 8 H ARG 8 -1.907 23.943 -59.033 60 HA ARG 8 HA ARG 8 -2.717 25.736 -61.251 61 HB2 ARG 8 2HB ARG 8 -4.374 24.196 -59.210 62 HB3 ARG 8 3HB ARG 8 -5.019 25.157 -60.551 63 HG2 ARG 8 2HG ARG 8 -3.787 23.686 -62.165 64 HG3 ARG 8 3HG ARG 8 -3.253 22.681 -60.805 65 HD2 ARG 8 2HD ARG 8 -5.642 22.221 -60.242 66 HD3 ARG 8 3HD ARG 8 -6.130 23.155 -61.673 67 HE ARG 8 HE ARG 8 -4.246 21.182 -62.480 68 HH11 ARG 8 1HH2 ARG 8 -7.602 21.268 -61.416 69 HH12 ARG 8 2HH2 ARG 8 -7.954 19.746 -62.192 70 HH21 ARG 8 2HH1 ARG 8 -4.798 19.279 -63.458 71 HH22 ARG 8 1HH1 ARG 8 -6.423 18.672 -63.329 72 H GLY 9 H GLY 9 -4.175 27.515 -60.882 73 HA2 GLY 9 HA2 GLY 9 -3.127 29.406 -58.937 74 HA3 GLY 9 HA3 GLY 9 -4.395 29.686 -60.124 75 H SER 10 H SER 10 -5.256 30.989 -58.283 76 HA SER 10 HA SER 10 -6.232 29.881 -55.874 77 HB2 SER 10 2HB SER 10 -7.393 32.236 -57.404 78 HB3 SER 10 3HB SER 10 -7.537 31.915 -55.666 79 HG SER 10 HG SER 10 -5.274 32.190 -55.484 80 H ARG 11 H ARG 11 -7.569 29.558 -59.037 81 HA ARG 11 HA ARG 11 -9.748 27.894 -57.877 82 HB2 ARG 11 2HB ARG 11 -10.757 29.799 -59.034 83 HB3 ARG 11 3HB ARG 11 -9.865 29.407 -60.511 84 HG2 ARG 11 2HG ARG 11 -11.085 27.291 -60.744 85 HG3 ARG 11 3HG ARG 11 -11.821 27.498 -59.151 86 HD2 ARG 11 2HD ARG 11 -13.454 28.051 -60.823 87 HD3 ARG 11 3HD ARG 11 -13.000 29.522 -59.948 88 HE ARG 11 HE ARG 11 -11.391 29.202 -62.328 89 HH11 ARG 11 1HH1 ARG 11 -14.627 30.176 -61.411 90 HH12 ARG 11 2HH1 ARG 11 -14.828 31.173 -62.828 91 HH21 ARG 11 2HH2 ARG 11 -11.708 30.497 -64.108 92 HH22 ARG 11 1HH2 ARG 11 -13.214 31.342 -64.311 93 H LEU 12 H LEU 12 -9.595 25.834 -58.325 94 HA LEU 12 HA LEU 12 -7.286 24.905 -59.958 95 HB2 LEU 12 2HB LEU 12 -8.658 23.637 -57.548 96 HB3 LEU 12 3HB LEU 12 -7.305 22.967 -58.439 97 HG LEU 12 HG LEU 12 -6.095 25.241 -57.844 98 HD11 LEU 12 1HD1 LEU 12 -7.982 26.357 -56.674 99 HD12 LEU 12 2HD1 LEU 12 -8.125 24.975 -55.570 100 HD13 LEU 12 3HD1 LEU 12 -6.679 26.008 -55.550 101 HD21 LEU 12 3HD2 LEU 12 -5.196 24.164 -55.819 102 HD22 LEU 12 1HD2 LEU 12 -6.558 23.019 -55.813 103 HD23 LEU 12 2HD2 LEU 12 -5.369 22.998 -57.135 104 H GLY 13 H GLY 13 -10.445 25.106 -60.589 105 HA2 GLY 13 HA2 GLY 13 -11.632 24.060 -62.347 106 HA3 GLY 13 HA3 GLY 13 -10.546 22.672 -62.281 107 H ALA 14 H ALA 14 -10.823 22.382 -59.343 108 HA ALA 14 HA ALA 14 -13.532 21.292 -58.934 109 HB1 ALA 14 3HB ALA 14 -11.544 20.235 -57.891 110 HB2 ALA 14 1HB ALA 14 -11.195 21.749 -57.023 111 HB3 ALA 14 2HB ALA 14 -12.677 20.836 -56.667 112 H VAL 15 H VAL 15 -14.690 22.175 -56.844 113 HA VAL 15 HA VAL 15 -15.254 24.992 -57.265 114 HB VAL 15 HB VAL 15 -16.176 23.194 -54.983 115 HG11 VAL 15 1HG1 VAL 15 -17.250 25.868 -56.007 116 HG12 VAL 15 2HG1 VAL 15 -18.018 24.850 -54.769 117 HG13 VAL 15 3HG1 VAL 15 -16.452 25.591 -54.441 118 HG21 VAL 15 3HG2 VAL 15 -16.932 22.302 -57.157 119 HG22 VAL 15 1HG2 VAL 15 -18.286 23.021 -56.284 120 HG23 VAL 15 2HG2 VAL 15 -17.531 23.909 -57.625 121 H SER 16 H SER 16 -13.883 26.451 -56.860 122 HA SER 16 HA SER 16 -12.585 26.853 -54.266 123 HB2 SER 16 2HB SER 16 -10.318 26.770 -55.337 124 HB3 SER 16 3HB SER 16 -11.094 25.197 -55.152 125 HG SER 16 HG SER 16 -11.747 25.373 -57.374 126 H TYR 17 H TYR 17 -11.520 28.880 -54.113 127 HA TYR 17 HA TYR 17 -11.772 30.901 -56.210 128 HB2 TYR 17 2HB TYR 17 -13.390 32.235 -54.643 129 HB3 TYR 17 3HB TYR 17 -14.020 31.018 -55.722 130 HD1 TYR 17 HD1 TYR 17 -12.940 31.467 -52.135 131 HD2 TYR 17 HD2 TYR 17 -15.384 29.276 -54.938 132 HE1 TYR 17 HE1 TYR 17 -14.047 30.277 -50.247 133 HE2 TYR 17 HE2 TYR 17 -16.478 28.082 -53.051 134 HH TYR 17 HH TYR 17 -16.601 27.819 -50.776 135 H GLU 18 H GLU 18 -11.092 33.031 -55.514 136 HA GLU 18 HA GLU 18 -8.815 32.900 -53.707 137 HB2 GLU 18 2HB GLU 18 -8.258 35.086 -54.559 138 HB3 GLU 18 3HB GLU 18 -8.683 34.012 -55.888 139 HG2 GLU 18 2HG GLU 18 -10.912 35.042 -56.068 140 HG3 GLU 18 3HG GLU 18 -10.577 36.073 -54.676 141 H THR 19 H THR 19 -11.931 33.410 -52.986 142 HA THR 19 HA THR 19 -13.175 34.194 -51.315 143 HB THR 19 HB THR 19 -12.381 34.633 -49.116 144 HG1 THR 19 HG1 THR 19 -9.917 34.860 -50.400 145 HG21 THR 19 1HG2 THR 19 -10.808 32.324 -50.328 146 HG22 THR 19 2HG2 THR 19 -11.223 32.550 -48.616 147 HG23 THR 19 3HG2 THR 19 -12.507 32.279 -49.802 148 H ASP 20 H ASP 20 -14.071 36.001 -50.230 149 HA ASP 20 HA ASP 20 -13.641 38.483 -51.720 150 HB2 ASP 20 2HB ASP 20 -15.895 37.517 -51.270 151 HB3 ASP 20 3HB ASP 20 -15.651 37.812 -49.545 152 H ARG 21 H ARG 21 -13.506 40.585 -50.651 153 HA ARG 21 HA ARG 21 -11.740 40.587 -48.229 154 HB2 ARG 21 2HB ARG 21 -11.163 41.961 -50.895 155 HB3 ARG 21 3HB ARG 21 -10.174 42.080 -49.442 156 HG2 ARG 21 2HG ARG 21 -9.778 39.591 -49.554 157 HG3 ARG 21 3HG ARG 21 -10.656 39.568 -51.096 158 HD2 ARG 21 2HD ARG 21 -9.002 41.292 -51.965 159 HD3 ARG 21 3HD ARG 21 -8.084 41.066 -50.477 160 HE ARG 21 HE ARG 21 -7.424 38.914 -51.168 161 HH11 ARG 21 1HH2 ARG 21 -9.650 40.195 -53.612 162 HH12 ARG 21 2HH2 ARG 21 -9.168 38.917 -54.735 163 HH21 ARG 21 2HH1 ARG 21 -6.992 37.347 -52.759 164 HH22 ARG 21 1HH1 ARG 21 -7.830 37.507 -54.306 165 H ASN 22 H ASN 22 -12.886 43.932 -47.471 166 HA ASN 22 HA ASN 22 -10.543 42.110 -47.198 167 HB2 ASN 22 2HB ASN 22 -11.120 44.916 -46.166 168 HB3 ASN 22 3HB ASN 22 -9.654 44.005 -45.825 169 HD21 ASN 22 2HD2 ASN 22 -8.164 43.518 -47.594 170 HD22 ASN 22 1HD2 ASN 22 -8.216 44.522 -49.035 171 H HIS 23 H HIS 23 -13.532 41.946 -46.016 172 HA HIS 23 HA HIS 23 -13.158 41.771 -43.154 173 HB2 HIS 23 2HB HIS 23 -15.424 40.844 -43.166 174 HB3 HIS 23 3HB HIS 23 -15.318 42.294 -44.152 175 HD2 HIS 23 HD2 HIS 23 -15.839 42.079 -46.754 176 HE1 HIS 23 HE1 HIS 23 -16.659 37.896 -46.881 177 HE2 HIS 23 HE2 HIS 23 -16.710 40.066 -48.218 178 H ASP 24 H ASP 24 -13.709 39.771 -41.926 179 HA ASP 24 HA ASP 24 -12.662 37.243 -43.047 180 HB2 ASP 24 2HB ASP 24 -11.097 36.910 -41.257 181 HB3 ASP 24 3HB ASP 24 -10.693 38.405 -42.096 182 H LEU 25 H LEU 25 -12.957 35.411 -41.673 183 HA LEU 25 HA LEU 25 -14.959 35.637 -39.494 184 HB2 LEU 25 2HB LEU 25 -14.897 33.526 -41.688 185 HB3 LEU 25 3HB LEU 25 -15.867 33.406 -40.224 186 HG LEU 25 HG LEU 25 -16.191 35.596 -42.329 187 HD11 LEU 25 1HD1 LEU 25 -17.862 33.107 -41.781 188 HD12 LEU 25 2HD1 LEU 25 -18.235 34.386 -42.960 189 HD13 LEU 25 3HD1 LEU 25 -16.804 33.368 -43.185 190 HD21 LEU 25 3HD2 LEU 25 -18.354 36.017 -41.179 191 HD22 LEU 25 1HD2 LEU 25 -17.919 34.833 -39.926 192 HD23 LEU 25 2HD2 LEU 25 -16.986 36.336 -40.112 193 H ALA 26 H ALA 26 -14.580 34.349 -37.759 194 HA ALA 26 HA ALA 26 -12.114 32.681 -37.701 195 HB1 ALA 26 3HB ALA 26 -11.553 33.736 -35.527 196 HB2 ALA 26 1HB ALA 26 -11.613 34.928 -36.837 197 HB3 ALA 26 2HB ALA 26 -12.960 34.803 -35.683 198 HA PRO 27 HA PRO 27 -14.648 29.763 -35.358 199 HB2 PRO 27 2HB PRO 27 -12.843 28.049 -34.471 200 HB3 PRO 27 3HB PRO 27 -12.988 28.370 -36.212 201 HG2 PRO 27 2HG PRO 27 -11.018 29.699 -34.309 202 HG3 PRO 27 3HG PRO 27 -10.650 28.814 -35.827 203 HD2 PRO 27 2HD PRO 27 -10.978 31.528 -35.774 204 HD3 PRO 27 3HD PRO 27 -11.515 30.541 -37.164 205 H ARG 28 H ARG 28 -13.603 28.595 -33.016 206 HA ARG 28 HA ARG 28 -15.252 29.669 -31.209 207 HB2 ARG 28 2HB ARG 28 -14.236 28.291 -29.492 208 HB3 ARG 28 3HB ARG 28 -14.219 27.439 -31.034 209 HG2 ARG 28 2HG ARG 28 -11.803 28.022 -31.311 210 HG3 ARG 28 3HG ARG 28 -11.843 28.880 -29.757 211 HD2 ARG 28 2HD ARG 28 -12.496 26.781 -28.615 212 HD3 ARG 28 3HD ARG 28 -12.404 25.918 -30.166 213 HE ARG 28 HE ARG 28 -9.927 27.239 -29.770 214 HH11 ARG 28 2HH1 ARG 28 -11.665 24.582 -28.288 215 HH12 ARG 28 1HH1 ARG 28 -10.202 23.816 -27.731 216 HH21 ARG 28 1HH2 ARG 28 -8.102 26.208 -29.032 217 HH22 ARG 28 2HH2 ARG 28 -8.240 24.718 -28.148 218 H GLN 29 H GLN 29 -15.192 30.582 -29.204 219 HA GLN 29 HA GLN 29 -13.561 33.093 -29.074 220 HB2 GLN 29 2HB GLN 29 -16.555 32.760 -28.692 221 HB3 GLN 29 3HB GLN 29 -15.650 34.274 -28.644 222 HG2 GLN 29 2HG GLN 29 -15.853 34.556 -30.870 223 HG3 GLN 29 3HG GLN 29 -15.223 32.945 -31.207 224 HE21 GLN 29 1HE2 GLN 29 -16.970 31.189 -30.234 225 HE22 GLN 29 2HE2 GLN 29 -18.538 31.384 -31.025 226 H ILE 30 H ILE 30 -12.398 32.577 -27.273 227 HA ILE 30 HA ILE 30 -13.640 31.686 -24.785 228 HB ILE 30 HB ILE 30 -10.827 32.649 -25.401 229 HG12 ILE 30 2HG1 ILE 30 -10.178 30.313 -25.096 230 HG13 ILE 30 3HG1 ILE 30 -11.855 29.850 -24.815 231 HG21 ILE 30 1HG2 ILE 30 -10.290 31.633 -23.159 232 HG22 ILE 30 2HG2 ILE 30 -11.344 33.037 -23.024 233 HG23 ILE 30 3HG2 ILE 30 -12.032 31.406 -22.881 234 HD11 ILE 30 3HD1 ILE 30 -10.859 30.917 -27.474 235 HD12 ILE 30 1HD1 ILE 30 -10.867 29.197 -27.036 236 HD13 ILE 30 2HD1 ILE 30 -12.396 30.065 -27.130 237 H ALA 31 H ALA 31 -15.011 33.023 -23.887 238 HA ALA 31 HA ALA 31 -14.289 35.874 -23.377 239 HB1 ALA 31 3HB ALA 31 -16.657 35.954 -22.520 240 HB2 ALA 31 1HB ALA 31 -16.501 35.630 -24.253 241 HB3 ALA 31 2HB ALA 31 -16.882 34.301 -23.131 242 H ARG 32 H ARG 32 -14.638 36.662 -21.180 243 HA ARG 32 HA ARG 32 -14.123 34.652 -19.019 244 HB2 ARG 32 2HB ARG 32 -12.854 37.319 -19.576 245 HB3 ARG 32 3HB ARG 32 -13.186 36.928 -17.885 246 HG2 ARG 32 2HG ARG 32 -11.870 34.973 -17.918 247 HG3 ARG 32 3HG ARG 32 -11.786 34.929 -19.685 248 HD2 ARG 32 2HD ARG 32 -10.464 37.060 -19.622 249 HD3 ARG 32 3HD ARG 32 -10.442 36.961 -17.849 250 HE ARG 32 HE ARG 32 -9.438 34.540 -18.454 251 HH11 ARG 32 2HH2 ARG 32 -8.453 37.617 -19.840 252 HH12 ARG 32 1HH2 ARG 32 -6.901 36.960 -20.337 253 HH21 ARG 32 1HH1 ARG 32 -7.515 33.803 -19.142 254 HH22 ARG 32 2HH1 ARG 32 -6.349 34.920 -19.866 255 H TYR 33 H TYR 33 -15.210 34.910 -17.083 256 HA TYR 33 HA TYR 33 -17.256 37.030 -16.907 257 HB2 TYR 33 2HB TYR 33 -17.928 34.096 -16.533 258 HB3 TYR 33 3HB TYR 33 -18.960 35.441 -16.150 259 HD1 TYR 33 HD2 TYR 33 -17.214 33.782 -19.020 260 HD2 TYR 33 HD1 TYR 33 -20.420 36.334 -17.723 261 HE1 TYR 33 HE2 TYR 33 -18.253 33.651 -21.281 262 HE2 TYR 33 HE1 TYR 33 -21.423 36.239 -20.004 263 HH TYR 33 HH TYR 33 -21.342 35.323 -22.026 264 H ARG 34 H ARG 34 -17.690 37.697 -14.891 265 HA ARG 34 HA ARG 34 -16.011 36.644 -12.650 266 HB2 ARG 34 2HB ARG 34 -15.524 38.939 -13.461 267 HB3 ARG 34 3HB ARG 34 -17.190 39.409 -13.134 268 HG2 ARG 34 2HG ARG 34 -16.913 39.033 -10.758 269 HG3 ARG 34 3HG ARG 34 -15.307 38.325 -10.982 270 HD2 ARG 34 2HD ARG 34 -15.770 41.062 -12.094 271 HD3 ARG 34 3HD ARG 34 -15.781 40.914 -10.339 272 HE ARG 34 HE ARG 34 -13.476 40.174 -12.127 273 HH11 ARG 34 1HH2 ARG 34 -14.461 41.362 -8.958 274 HH12 ARG 34 2HH2 ARG 34 -12.802 41.451 -8.431 275 HH21 ARG 34 1HH1 ARG 34 -11.559 40.322 -11.451 276 HH22 ARG 34 2HH1 ARG 34 -11.145 40.870 -9.822 277 H THR 35 H THR 35 -16.906 35.793 -10.968 278 HA THR 35 HA THR 35 -19.805 35.448 -10.756 279 HB THR 35 HB THR 35 -19.316 34.001 -8.850 280 HG1 THR 35 HG1 THR 35 -16.620 34.534 -9.330 281 HG21 THR 35 1HG2 THR 35 -17.941 32.312 -9.920 282 HG22 THR 35 2HG2 THR 35 -19.172 32.981 -11.018 283 HG23 THR 35 3HG2 THR 35 -17.471 33.456 -11.194 284 H ASP 36 H ASP 36 -20.603 35.457 -8.300 285 HA ASP 36 HA ASP 36 -20.631 38.234 -7.611 286 HB2 ASP 36 2HB ASP 36 -22.597 36.661 -7.486 287 HB3 ASP 36 3HB ASP 36 -21.825 35.853 -6.121 288 H ASN 37 H ASN 37 -18.515 35.685 -6.544 289 HA ASN 37 HA ASN 37 -17.747 37.286 -4.151 290 HB2 ASN 37 2HB ASN 37 -16.280 34.846 -4.973 291 HB3 ASN 37 3HB ASN 37 -16.453 35.568 -3.412 292 HD21 ASN 37 1HD2 ASN 37 -16.942 32.843 -4.560 293 HD22 ASN 37 2HD2 ASN 37 -18.542 32.425 -3.912 294 H GLY 38 H GLY 38 -17.217 37.736 -7.334 295 HA2 GLY 38 HA2 GLY 38 -15.613 38.969 -8.489 296 HA3 GLY 38 HA3 GLY 38 -14.516 38.916 -7.105 297 H GLU 39 H GLU 39 -15.646 35.782 -7.791 298 HA GLU 39 HA GLU 39 -12.961 34.977 -8.615 299 HB2 GLU 39 2HB GLU 39 -15.339 33.129 -8.786 300 HB3 GLU 39 3HB GLU 39 -13.669 32.771 -8.453 301 HG2 GLU 39 2HG GLU 39 -14.231 34.327 -6.283 302 HG3 GLU 39 3HG GLU 39 -15.870 33.798 -6.718 303 H GLU 40 H GLU 40 -12.259 35.205 -10.667 304 HA GLU 40 HA GLU 40 -14.212 35.379 -12.893 305 HB2 GLU 40 2HB GLU 40 -11.338 36.224 -12.543 306 HB3 GLU 40 3HB GLU 40 -12.008 35.960 -14.162 307 HG2 GLU 40 2HG GLU 40 -13.883 37.469 -13.659 308 HG3 GLU 40 3HG GLU 40 -13.201 37.803 -12.068 309 H PHE 41 H PHE 41 -14.483 33.862 -14.384 310 HA PHE 41 HA PHE 41 -12.467 31.682 -14.804 311 HB2 PHE 41 2HB PHE 41 -15.491 31.471 -14.717 312 HB3 PHE 41 3HB PHE 41 -14.418 30.192 -15.232 313 HD1 PHE 41 HD1 PHE 41 -15.530 32.172 -12.238 314 HD2 PHE 41 HD2 PHE 41 -13.099 28.891 -13.680 315 HE1 PHE 41 HE1 PHE 41 -15.195 31.381 -9.949 316 HE2 PHE 41 HE2 PHE 41 -12.729 28.146 -11.348 317 HZ PHE 41 HZ PHE 41 -13.758 29.404 -9.467 318 H GLU 42 H GLU 42 -12.737 30.572 -16.922 319 HA GLU 42 HA GLU 42 -13.436 32.514 -19.066 320 HB2 GLU 42 2HB GLU 42 -11.386 30.289 -19.196 321 HB3 GLU 42 3HB GLU 42 -11.793 31.449 -20.457 322 HG2 GLU 42 2HG GLU 42 -10.428 33.003 -19.685 323 HG3 GLU 42 3HG GLU 42 -11.049 32.900 -18.049 324 H VAL 43 H VAL 43 -14.797 31.925 -20.594 325 HA VAL 43 HA VAL 43 -15.843 29.118 -20.657 326 HB VAL 43 HB VAL 43 -17.417 31.619 -21.226 327 HG11 VAL 43 1HG1 VAL 43 -19.322 30.143 -21.321 328 HG12 VAL 43 2HG1 VAL 43 -18.147 29.596 -22.500 329 HG13 VAL 43 3HG1 VAL 43 -18.309 28.722 -20.961 330 HG21 VAL 43 3HG2 VAL 43 -17.671 29.762 -18.834 331 HG22 VAL 43 1HG2 VAL 43 -16.857 31.339 -18.770 332 HG23 VAL 43 2HG2 VAL 43 -18.560 31.271 -19.170 333 HA PRO 44 HA PRO 44 -14.490 29.657 -25.002 334 HB2 PRO 44 2HB PRO 44 -14.216 27.014 -25.622 335 HB3 PRO 44 3HB PRO 44 -12.989 27.928 -24.704 336 HG2 PRO 44 2HG PRO 44 -15.104 26.066 -23.630 337 HG3 PRO 44 3HG PRO 44 -13.384 26.196 -23.156 338 HD2 PRO 44 2HD PRO 44 -15.472 27.366 -21.780 339 HD3 PRO 44 3HD PRO 44 -13.821 28.055 -21.772 340 H PHE 45 H PHE 45 -16.081 30.256 -26.308 341 HA PHE 45 HA PHE 45 -18.546 28.601 -26.684 342 HB2 PHE 45 2HB PHE 45 -17.832 31.467 -27.336 343 HB3 PHE 45 3HB PHE 45 -19.213 30.694 -28.048 344 HD1 PHE 45 HD2 PHE 45 -17.694 31.848 -24.853 345 HD2 PHE 45 HD1 PHE 45 -21.232 30.255 -26.745 346 HE1 PHE 45 HE2 PHE 45 -19.040 32.418 -22.850 347 HE2 PHE 45 HE1 PHE 45 -22.563 30.815 -24.721 348 HZ PHE 45 HZ PHE 45 -21.452 31.903 -22.768 349 H ALA 46 H ALA 46 -19.071 27.779 -28.673 350 HA ALA 46 HA ALA 46 -16.809 27.278 -30.471 351 HB1 ALA 46 3HB ALA 46 -18.311 25.452 -29.741 352 HB2 ALA 46 1HB ALA 46 -19.687 26.261 -30.529 353 HB3 ALA 46 2HB ALA 46 -18.337 25.639 -31.503 354 H ASP 47 H ASP 47 -17.028 27.430 -32.829 355 HA ASP 47 HA ASP 47 -17.637 29.907 -33.969 356 HB2 ASP 47 2HB ASP 47 -16.246 28.162 -34.984 357 HB3 ASP 47 3HB ASP 47 -17.627 27.082 -35.115 358 H ASP 48 H ASP 48 -19.867 27.311 -33.243 359 HA ASP 48 HA ASP 48 -22.071 28.256 -34.928 360 HB2 ASP 48 2HB ASP 48 -21.544 25.858 -34.392 361 HB3 ASP 48 3HB ASP 48 -22.009 26.172 -32.723 362 H ALA 49 H ALA 49 -20.857 29.228 -31.908 363 HA ALA 49 HA ALA 49 -23.496 30.292 -30.964 364 HB1 ALA 49 3HB ALA 49 -22.768 28.326 -29.657 365 HB2 ALA 49 1HB ALA 49 -21.229 29.140 -29.293 366 HB3 ALA 49 2HB ALA 49 -22.758 29.804 -28.678 367 H GLU 50 H GLU 50 -23.415 32.158 -29.579 368 HA GLU 50 HA GLU 50 -20.997 33.886 -29.788 369 HB2 GLU 50 2HB GLU 50 -23.844 34.658 -30.530 370 HB3 GLU 50 3HB GLU 50 -22.589 35.839 -30.136 371 HG2 GLU 50 2HG GLU 50 -21.170 35.020 -31.963 372 HG3 GLU 50 3HG GLU 50 -22.368 33.793 -32.371 373 H ILE 51 H ILE 51 -20.740 35.358 -28.205 374 HA ILE 51 HA ILE 51 -21.186 34.496 -25.614 375 HB ILE 51 HB ILE 51 -20.277 37.292 -26.292 376 HG12 ILE 51 2HG1 ILE 51 -19.053 35.866 -27.826 377 HG13 ILE 51 3HG1 ILE 51 -17.998 36.510 -26.573 378 HG21 ILE 51 1HG2 ILE 51 -20.550 36.720 -23.857 379 HG22 ILE 51 2HG2 ILE 51 -19.427 35.372 -24.081 380 HG23 ILE 51 3HG2 ILE 51 -18.871 37.022 -24.326 381 HD11 ILE 51 3HD1 ILE 51 -19.102 33.678 -26.744 382 HD12 ILE 51 1HD1 ILE 51 -17.442 34.198 -27.071 383 HD13 ILE 51 2HD1 ILE 51 -18.064 34.282 -25.428 384 HA PRO 52 HA PRO 52 -24.966 36.881 -24.612 385 HB2 PRO 52 2HB PRO 52 -25.651 35.398 -22.440 386 HB3 PRO 52 3HB PRO 52 -25.995 34.862 -24.115 387 HG2 PRO 52 2HG PRO 52 -23.751 34.015 -22.277 388 HG3 PRO 52 3HG PRO 52 -24.755 33.002 -23.373 389 HD2 PRO 52 2HD PRO 52 -22.202 34.008 -23.959 390 HD3 PRO 52 3HD PRO 52 -23.372 33.517 -25.187 391 H GLY 53 H GLY 53 -25.213 38.422 -23.013 392 HA2 GLY 53 HA2 GLY 53 -23.105 39.735 -21.834 393 HA3 GLY 53 HA3 GLY 53 -24.774 39.852 -21.272 394 H THR 54 H THR 54 -24.868 37.022 -20.325 395 HA THR 54 HA THR 54 -22.698 36.874 -18.369 396 HB THR 54 HB THR 54 -24.343 36.288 -16.527 397 HG1 THR 54 HG1 THR 54 -26.561 36.676 -16.921 398 HG21 THR 54 1HG2 THR 54 -25.339 38.420 -16.029 399 HG22 THR 54 2HG2 THR 54 -23.770 38.715 -16.771 400 HG23 THR 54 3HG2 THR 54 -25.237 38.939 -17.729 401 H TRP 55 H TRP 55 -22.541 34.755 -17.256 402 HA TRP 55 HA TRP 55 -23.852 32.437 -18.458 403 HB2 TRP 55 2HB TRP 55 -22.060 33.164 -20.116 404 HB3 TRP 55 3HB TRP 55 -20.871 32.810 -18.873 405 HD1 TRP 55 HD1 TRP 55 -20.314 30.312 -18.379 406 HE1 TRP 55 HE1 TRP 55 -20.645 28.152 -19.684 407 HE3 TRP 55 HE3 TRP 55 -23.972 31.883 -21.557 408 HZ2 TRP 55 HZ2 TRP 55 -22.448 27.146 -21.733 409 HZ3 TRP 55 HZ3 TRP 55 -25.027 30.294 -23.161 410 HH2 TRP 55 HH2 TRP 55 -24.262 27.931 -23.263 411 H LEU 56 H LEU 56 -23.453 30.476 -17.265 412 HA LEU 56 HA LEU 56 -22.761 30.868 -14.496 413 HB2 LEU 56 2HB LEU 56 -24.307 29.069 -15.952 414 HB3 LEU 56 3HB LEU 56 -22.922 28.091 -15.464 415 HG LEU 56 HG LEU 56 -24.603 29.743 -13.535 416 HD11 LEU 56 1HD1 LEU 56 -25.975 27.993 -14.601 417 HD12 LEU 56 2HD1 LEU 56 -24.755 26.768 -14.184 418 HD13 LEU 56 3HD1 LEU 56 -25.661 27.606 -12.902 419 HD21 LEU 56 3HD2 LEU 56 -22.605 27.479 -13.083 420 HD22 LEU 56 1HD2 LEU 56 -22.361 29.182 -12.667 421 HD23 LEU 56 2HD2 LEU 56 -23.603 28.249 -11.828 422 H CYS 57 H CYS 57 -20.877 30.640 -13.476 423 HA CYS 57 HA CYS 57 -18.467 29.864 -15.009 424 HB2 CYS 57 2HB CYS 57 -18.903 31.243 -12.336 425 HB3 CYS 57 3HB CYS 57 -17.312 30.782 -12.940 426 HG CYS 57 HG CYS 57 -17.492 32.066 -15.233 427 H ARG 58 H ARG 58 -16.771 28.648 -13.900 428 HA ARG 58 HA ARG 58 -17.745 26.059 -13.223 429 HB2 ARG 58 2HB ARG 58 -14.883 26.993 -12.819 430 HB3 ARG 58 3HB ARG 58 -15.453 25.366 -13.178 431 HG2 ARG 58 2HG ARG 58 -16.191 26.173 -15.455 432 HG3 ARG 58 3HG ARG 58 -15.500 27.761 -15.072 433 HD2 ARG 58 2HD ARG 58 -13.283 26.577 -14.654 434 HD3 ARG 58 3HD ARG 58 -14.028 25.133 -15.370 435 HE ARG 58 HE ARG 58 -14.335 27.475 -17.072 436 HH11 ARG 58 1HH2 ARG 58 -11.977 25.007 -16.262 437 HH12 ARG 58 2HH2 ARG 58 -11.097 25.247 -17.746 438 HH21 ARG 58 2HH1 ARG 58 -13.139 27.795 -18.858 439 HH22 ARG 58 1HH1 ARG 58 -11.757 26.775 -19.201 440 H ASN 59 H ASN 59 -17.078 28.704 -11.151 441 HA ASN 59 HA ASN 59 -16.752 27.316 -8.664 442 HB2 ASN 59 2HB ASN 59 -16.142 29.622 -8.999 443 HB3 ASN 59 3HB ASN 59 -17.801 30.069 -9.414 444 HD21 ASN 59 1HD2 ASN 59 -17.787 31.721 -7.819 445 HD22 ASN 59 2HD2 ASN 59 -17.752 31.326 -6.113 446 H GLY 60 H GLY 60 -19.512 27.726 -10.712 447 HA2 GLY 60 HA2 GLY 60 -21.628 26.719 -10.474 448 HA3 GLY 60 HA3 GLY 60 -21.394 26.553 -8.732 449 H MET 61 H MET 61 -20.552 29.671 -9.968 450 HA MET 61 HA MET 61 -23.155 30.843 -9.115 451 HB2 MET 61 2HB MET 61 -21.141 31.293 -7.667 452 HB3 MET 61 3HB MET 61 -20.384 32.102 -9.015 453 HG2 MET 61 2HG MET 61 -21.424 33.699 -7.470 454 HG3 MET 61 3HG MET 61 -22.110 33.800 -9.087 455 HE1 MET 61 3HE MET 61 -22.886 31.323 -6.016 456 HE2 MET 61 1HE MET 61 -22.658 32.953 -5.335 457 HE3 MET 61 2HE MET 61 -24.263 32.192 -5.311 458 H GLU 62 H GLU 62 -24.056 32.479 -10.385 459 HA GLU 62 HA GLU 62 -23.500 32.406 -13.223 460 HB2 GLU 62 2HB GLU 62 -25.758 32.707 -12.273 461 HB3 GLU 62 3HB GLU 62 -25.288 34.300 -11.661 462 HG2 GLU 62 2HG GLU 62 -24.836 35.059 -13.984 463 HG3 GLU 62 3HG GLU 62 -25.216 33.448 -14.595 464 H GLY 63 H GLY 63 -21.761 33.298 -14.098 465 HA2 GLY 63 HA2 GLY 63 -20.441 35.626 -12.921 466 HA3 GLY 63 HA3 GLY 63 -19.838 34.663 -14.248 467 H THR 64 H THR 64 -20.149 37.606 -13.981 468 HA THR 64 HA THR 64 -21.801 38.093 -16.422 469 HB THR 64 HB THR 64 -20.667 40.091 -14.437 470 HG1 THR 64 HG1 THR 64 -22.798 40.295 -13.768 471 HG21 THR 64 1HG2 THR 64 -20.921 41.245 -16.537 472 HG22 THR 64 2HG2 THR 64 -22.483 40.473 -16.868 473 HG23 THR 64 3HG2 THR 64 -22.329 41.674 -15.566 474 H LEU 65 H LEU 65 -20.957 38.972 -18.253 475 HA LEU 65 HA LEU 65 -18.337 38.268 -18.942 476 HB2 LEU 65 2HB LEU 65 -20.367 38.454 -20.384 477 HB3 LEU 65 3HB LEU 65 -20.284 40.203 -20.253 478 HG LEU 65 HG LEU 65 -17.918 39.959 -21.365 479 HD11 LEU 65 1HD1 LEU 65 -17.630 37.564 -20.973 480 HD12 LEU 65 2HD1 LEU 65 -19.035 37.221 -21.977 481 HD13 LEU 65 3HD1 LEU 65 -17.580 37.977 -22.688 482 HD21 LEU 65 3HD2 LEU 65 -19.918 40.782 -22.569 483 HD22 LEU 65 1HD2 LEU 65 -18.919 39.761 -23.615 484 HD23 LEU 65 2HD2 LEU 65 -20.412 39.107 -22.903 485 H ILE 66 H ILE 66 -16.421 39.178 -18.557 486 HA ILE 66 HA ILE 66 -16.112 42.131 -18.459 487 HB ILE 66 HB ILE 66 -14.588 42.094 -16.661 488 HG12 ILE 66 2HG1 ILE 66 -13.388 40.046 -16.807 489 HG13 ILE 66 3HG1 ILE 66 -14.147 40.103 -15.218 490 HG21 ILE 66 1HG2 ILE 66 -17.024 40.548 -15.756 491 HG22 ILE 66 2HG2 ILE 66 -15.992 41.595 -14.772 492 HG23 ILE 66 3HG2 ILE 66 -16.964 42.289 -16.085 493 HD11 ILE 66 3HD1 ILE 66 -14.882 38.431 -17.546 494 HD12 ILE 66 1HD1 ILE 66 -14.318 37.905 -15.956 495 HD13 ILE 66 2HD1 ILE 66 -15.940 38.619 -16.125 496 H GLU 67 H GLU 67 -14.014 42.926 -18.945 497 HA GLU 67 HA GLU 67 -12.313 41.108 -20.608 498 HB2 GLU 67 2HB GLU 67 -12.572 44.135 -20.636 499 HB3 GLU 67 3HB GLU 67 -11.394 43.202 -21.571 500 HG2 GLU 67 2HG GLU 67 -13.240 41.985 -22.702 501 HG3 GLU 67 3HG GLU 67 -14.428 42.932 -21.808 502 H GLY 68 H GLY 68 -10.078 41.046 -20.260 503 HA2 GLY 68 HA2 GLY 68 -9.134 41.595 -17.531 504 HA3 GLY 68 HA3 GLY 68 -8.254 40.801 -18.832 505 H ASP 69 H ASP 69 -8.926 43.267 -20.590 506 HA ASP 69 HA ASP 69 -6.690 44.994 -19.689 507 HB2 ASP 69 2HB ASP 69 -5.932 45.049 -21.924 508 HB3 ASP 69 3HB ASP 69 -6.152 43.369 -21.481 509 H LEU 70 H LEU 70 -7.012 46.710 -21.956 510 HA LEU 70 HA LEU 70 -8.438 48.794 -20.710 511 HB2 LEU 70 2HB LEU 70 -7.287 48.441 -23.484 512 HB3 LEU 70 3HB LEU 70 -8.237 49.860 -23.078 513 HG LEU 70 HG LEU 70 -6.692 50.409 -21.215 514 HD11 LEU 70 1HD1 LEU 70 -5.650 48.253 -20.719 515 HD12 LEU 70 2HD1 LEU 70 -4.983 48.159 -22.369 516 HD13 LEU 70 3HD1 LEU 70 -4.413 49.397 -21.228 517 HD21 LEU 70 3HD2 LEU 70 -4.892 51.240 -22.673 518 HD22 LEU 70 1HD2 LEU 70 -5.393 50.115 -23.956 519 HD23 LEU 70 2HD2 LEU 70 -6.471 51.435 -23.448 520 HA PRO 71 HA PRO 71 -9.670 50.831 -21.462 521 HB2 PRO 71 2HB PRO 71 -12.424 51.161 -20.334 522 HB3 PRO 71 3HB PRO 71 -11.470 52.282 -21.350 523 HG2 PRO 71 2HG PRO 71 -13.520 50.873 -22.420 524 HG3 PRO 71 3HG PRO 71 -11.975 51.028 -23.328 525 HD2 PRO 71 2HD PRO 71 -12.863 48.738 -21.531 526 HD3 PRO 71 3HD PRO 71 -12.269 48.668 -23.215 527 H GLU 72 H GLU 72 -10.744 48.254 -19.454 528 HA GLU 72 HA GLU 72 -9.874 49.654 -16.950 529 HB2 GLU 72 2HB GLU 72 -12.189 47.718 -17.286 530 HB3 GLU 72 3HB GLU 72 -11.599 48.405 -15.763 531 HG2 GLU 72 2HG GLU 72 -12.061 50.705 -16.718 532 HG3 GLU 72 3HG GLU 72 -12.859 49.922 -18.082 533 HA PRO 73 HA PRO 73 -7.369 45.786 -17.667 534 HB2 PRO 73 2HB PRO 73 -4.866 46.793 -17.177 535 HB3 PRO 73 3HB PRO 73 -5.682 46.923 -18.764 536 HG2 PRO 73 2HG PRO 73 -5.590 48.996 -16.544 537 HG3 PRO 73 3HG PRO 73 -5.240 49.228 -18.287 538 HD2 PRO 73 2HD PRO 73 -7.673 49.824 -17.238 539 HD3 PRO 73 3HD PRO 73 -7.521 49.093 -18.859 540 H LYS 74 H LYS 74 -6.682 44.367 -16.148 541 HA LYS 74 HA LYS 74 -6.127 45.196 -13.360 542 HB2 LYS 74 2HB LYS 74 -7.868 43.574 -12.493 543 HB3 LYS 74 3HB LYS 74 -8.460 45.080 -13.184 544 HG2 LYS 74 2HG LYS 74 -9.064 43.930 -15.284 545 HG3 LYS 74 3HG LYS 74 -8.457 42.398 -14.635 546 HD2 LYS 74 2HD LYS 74 -10.206 42.379 -12.922 547 HD3 LYS 74 3HD LYS 74 -10.647 44.050 -13.299 548 HE2 LYS 74 2HE LYS 74 -12.311 42.664 -14.312 549 HE3 LYS 74 3HE LYS 74 -11.317 43.369 -15.592 550 HZ1 LYS 74 HZ1 LYS 74 -11.259 40.575 -14.590 551 HZ2 LYS 74 HZ2 LYS 74 -11.572 41.100 -16.108 552 HZ3 LYS 74 HZ3 LYS 74 -10.052 41.184 -15.522 553 H LYS 75 H LYS 75 -5.082 43.733 -12.100 554 HA LYS 75 HA LYS 75 -3.369 41.869 -13.582 555 HB2 LYS 75 2HB LYS 75 -3.264 42.852 -10.705 556 HB3 LYS 75 3HB LYS 75 -2.045 41.834 -11.488 557 HG2 LYS 75 2HG LYS 75 -1.636 43.601 -13.179 558 HG3 LYS 75 3HG LYS 75 -2.804 44.657 -12.359 559 HD2 LYS 75 2HD LYS 75 -1.448 44.535 -10.279 560 HD3 LYS 75 3HD LYS 75 -0.245 43.543 -11.110 561 HE2 LYS 75 2HE LYS 75 -1.061 46.373 -11.929 562 HE3 LYS 75 3HE LYS 75 0.326 45.992 -10.908 563 HZ1 LYS 75 HZ1 LYS 75 1.262 44.706 -12.757 564 HZ2 LYS 75 HZ2 LYS 75 -0.005 45.090 -13.720 565 HZ3 LYS 75 HZ3 LYS 75 1.013 46.253 -13.204 566 H VAL 76 H VAL 76 -5.604 40.673 -13.817 567 HA VAL 76 HA VAL 76 -6.164 38.710 -11.695 568 HB VAL 76 HB VAL 76 -7.826 37.792 -13.263 569 HG11 VAL 76 1HG1 VAL 76 -7.995 40.806 -12.867 570 HG12 VAL 76 2HG1 VAL 76 -9.349 39.699 -13.177 571 HG13 VAL 76 3HG1 VAL 76 -8.423 39.562 -11.677 572 HG21 VAL 76 3HG2 VAL 76 -6.724 38.358 -15.429 573 HG22 VAL 76 1HG2 VAL 76 -8.400 38.913 -15.335 574 HG23 VAL 76 2HG2 VAL 76 -7.074 40.077 -15.141 575 H LYS 77 H LYS 77 -6.288 36.377 -12.206 576 HA LYS 77 HA LYS 77 -3.845 35.450 -13.634 577 HB2 LYS 77 2HB LYS 77 -3.969 35.045 -11.197 578 HB3 LYS 77 3HB LYS 77 -5.431 34.079 -11.439 579 HG2 LYS 77 2HG LYS 77 -4.132 32.485 -12.850 580 HG3 LYS 77 3HG LYS 77 -2.677 33.479 -12.617 581 HD2 LYS 77 2HD LYS 77 -2.795 33.078 -10.171 582 HD3 LYS 77 3HD LYS 77 -4.255 32.089 -10.404 583 HE2 LYS 77 2HE LYS 77 -2.964 30.533 -11.854 584 HE3 LYS 77 3HE LYS 77 -1.513 31.517 -11.621 585 HZ1 LYS 77 HZ1 LYS 77 -1.553 29.624 -10.100 586 HZ2 LYS 77 HZ2 LYS 77 -1.630 31.007 -9.239 587 HZ3 LYS 77 HZ3 LYS 77 -2.972 30.099 -9.453 588 HA PRO 78 HA PRO 78 -3.010 33.877 -14.934 589 HB2 PRO 78 2HB PRO 78 -2.752 33.301 -17.580 590 HB3 PRO 78 3HB PRO 78 -3.162 32.062 -16.353 591 HG2 PRO 78 2HG PRO 78 -5.064 33.603 -18.147 592 HG3 PRO 78 3HG PRO 78 -4.991 31.831 -17.884 593 HD2 PRO 78 2HD PRO 78 -6.735 33.431 -16.519 594 HD3 PRO 78 3HD PRO 78 -5.965 32.016 -15.744 595 HA PRO 79 HA PRO 79 -2.434 38.031 -16.141 596 HB2 PRO 79 2HB PRO 79 0.101 37.287 -17.593 597 HB3 PRO 79 3HB PRO 79 -0.153 38.524 -16.323 598 HG2 PRO 79 2HG PRO 79 0.987 36.163 -15.685 599 HG3 PRO 79 3HG PRO 79 -0.288 36.842 -14.618 600 HD2 PRO 79 2HD PRO 79 -0.582 34.733 -16.783 601 HD3 PRO 79 3HD PRO 79 -1.159 34.708 -15.092 602 H ARG 80 H ARG 80 -2.606 35.828 -18.785 603 HA ARG 80 HA ARG 80 -3.108 38.009 -20.778 604 HB2 ARG 80 2HB ARG 80 -1.940 35.235 -21.241 605 HB3 ARG 80 3HB ARG 80 -2.446 36.356 -22.512 606 HG2 ARG 80 2HG ARG 80 -0.789 38.030 -21.700 607 HG3 ARG 80 3HG ARG 80 -0.240 36.879 -20.467 608 HD2 ARG 80 2HD ARG 80 0.385 35.267 -22.231 609 HD3 ARG 80 3HD ARG 80 -0.151 36.392 -23.478 610 HE ARG 80 HE ARG 80 2.305 36.518 -21.860 611 HH11 ARG 80 1HH1 ARG 80 0.281 38.357 -24.057 612 HH12 ARG 80 2HH1 ARG 80 1.565 39.473 -24.436 613 HH21 ARG 80 2HH2 ARG 80 3.879 37.972 -22.392 614 HH22 ARG 80 1HH2 ARG 80 3.542 39.256 -23.517 Start of MODEL 30 1 H1 SER 1 1H SER 1 21.357 -0.061 3.688 2 H2 SER 1 2H SER 1 22.435 -1.297 3.748 3 H3 SER 1 3H SER 1 21.000 -1.495 2.981 4 HA SER 1 HA SER 1 23.123 0.366 2.161 5 HB2 SER 1 2HB SER 1 22.336 -2.280 0.877 6 HB3 SER 1 3HB SER 1 23.588 -1.153 0.310 7 HG SER 1 HG SER 1 24.471 -2.846 1.583 8 H MET 2 H MET 2 22.755 1.492 0.185 9 HA MET 2 HA MET 2 20.013 2.304 -0.193 10 HB2 MET 2 2HB MET 2 22.022 3.787 -0.316 11 HB3 MET 2 3HB MET 2 22.498 2.977 -1.810 12 HG2 MET 2 2HG MET 2 21.435 5.012 -2.411 13 HG3 MET 2 3HG MET 2 20.316 3.725 -2.838 14 HE1 MET 2 3HE MET 2 18.354 5.425 -3.136 15 HE2 MET 2 1HE MET 2 17.915 6.667 -1.943 16 HE3 MET 2 2HE MET 2 19.484 6.752 -2.776 17 H ALA 3 H ALA 3 22.143 0.154 -2.027 18 HA ALA 3 HA ALA 3 21.888 -1.142 -3.844 19 HB1 ALA 3 3HB ALA 3 19.033 -1.396 -2.848 20 HB2 ALA 3 1HB ALA 3 19.917 -2.556 -3.862 21 HB3 ALA 3 2HB ALA 3 20.444 -2.261 -2.195 22 H ASP 4 H ASP 4 21.619 1.634 -4.482 23 HA ASP 4 HA ASP 4 19.583 1.960 -6.525 24 HB2 ASP 4 2HB ASP 4 20.644 4.115 -6.924 25 HB3 ASP 4 3HB ASP 4 20.395 3.849 -5.219 26 H ARG 5 H ARG 5 21.361 1.433 -9.558 27 HA ARG 5 HA ARG 5 19.079 2.895 -8.283 28 HB2 ARG 5 2HB ARG 5 19.112 4.465 -10.102 29 HB3 ARG 5 3HB ARG 5 20.673 4.462 -9.287 30 HG2 ARG 5 2HG ARG 5 21.625 3.053 -11.113 31 HG3 ARG 5 3HG ARG 5 20.057 3.081 -11.941 32 HD2 ARG 5 2HD ARG 5 20.171 5.540 -12.103 33 HD3 ARG 5 3HD ARG 5 21.720 5.549 -11.264 34 HE ARG 5 HE ARG 5 21.179 4.773 -14.054 35 HH11 ARG 5 2HH1 ARG 5 23.610 4.664 -11.525 36 HH12 ARG 5 1HH1 ARG 5 24.902 4.393 -12.661 37 HH21 ARG 5 1HH2 ARG 5 22.874 4.427 -15.436 38 HH22 ARG 5 2HH2 ARG 5 24.490 4.263 -14.814 39 H VAL 6 H VAL 6 17.134 3.003 -9.532 40 HA VAL 6 HA VAL 6 16.626 0.702 -11.344 41 HB VAL 6 HB VAL 6 14.461 0.394 -10.189 42 HG11 VAL 6 1HG1 VAL 6 15.314 -0.936 -8.344 43 HG12 VAL 6 2HG1 VAL 6 16.392 -1.090 -9.741 44 HG13 VAL 6 3HG1 VAL 6 16.857 -0.059 -8.370 45 HG21 VAL 6 3HG2 VAL 6 14.094 1.181 -7.917 46 HG22 VAL 6 1HG2 VAL 6 15.609 2.098 -7.941 47 HG23 VAL 6 2HG2 VAL 6 14.262 2.563 -9.005 48 H LEU 7 H LEU 7 14.751 0.893 -12.644 49 HA LEU 7 HA LEU 7 14.233 3.618 -13.635 50 HB2 LEU 7 2HB LEU 7 13.200 0.906 -14.555 51 HB3 LEU 7 3HB LEU 7 12.940 2.433 -15.391 52 HG LEU 7 HG LEU 7 15.644 1.084 -14.974 53 HD11 LEU 7 1HD1 LEU 7 15.556 0.711 -17.395 54 HD12 LEU 7 2HD1 LEU 7 14.179 -0.060 -16.595 55 HD13 LEU 7 3HD1 LEU 7 13.949 1.468 -17.475 56 HD21 LEU 7 3HD2 LEU 7 15.955 3.517 -15.064 57 HD22 LEU 7 1HD2 LEU 7 16.485 2.789 -16.582 58 HD23 LEU 7 2HD2 LEU 7 14.915 3.621 -16.505 59 H ARG 8 H ARG 8 12.034 4.325 -14.115 60 HA ARG 8 HA ARG 8 9.981 3.523 -12.095 61 HB2 ARG 8 2HB ARG 8 11.255 5.604 -11.458 62 HB3 ARG 8 3HB ARG 8 10.623 6.390 -12.910 63 HG2 ARG 8 2HG ARG 8 8.316 6.141 -12.059 64 HG3 ARG 8 3HG ARG 8 8.915 5.214 -10.666 65 HD2 ARG 8 2HD ARG 8 10.239 7.195 -9.955 66 HD3 ARG 8 3HD ARG 8 9.554 8.125 -11.306 67 HE ARG 8 HE ARG 8 7.310 7.207 -10.030 68 HH11 ARG 8 1HH2 ARG 8 10.069 8.975 -8.787 69 HH12 ARG 8 2HH2 ARG 8 9.148 9.672 -7.482 70 HH21 ARG 8 1HH1 ARG 8 6.196 8.133 -8.349 71 HH22 ARG 8 2HH1 ARG 8 7.008 9.217 -7.260 72 H GLY 9 H GLY 9 7.840 3.665 -12.724 73 HA2 GLY 9 HA2 GLY 9 7.296 3.085 -15.472 74 HA3 GLY 9 HA3 GLY 9 6.114 3.260 -14.177 75 H SER 10 H SER 10 7.508 6.185 -14.033 76 HA SER 10 HA SER 10 6.359 7.450 -16.423 77 HB2 SER 10 2HB SER 10 4.462 7.302 -14.798 78 HB3 SER 10 3HB SER 10 5.417 8.248 -13.639 79 HG SER 10 HG SER 10 3.962 9.522 -14.946 80 H ARG 11 H ARG 11 7.118 9.544 -16.780 81 HA ARG 11 HA ARG 11 9.657 10.276 -15.392 82 HB2 ARG 11 2HB ARG 11 9.664 9.957 -17.856 83 HB3 ARG 11 3HB ARG 11 8.487 11.264 -18.024 84 HG2 ARG 11 2HG ARG 11 10.155 12.831 -16.950 85 HG3 ARG 11 3HG ARG 11 11.319 11.496 -16.895 86 HD2 ARG 11 2HD ARG 11 11.241 11.310 -19.356 87 HD3 ARG 11 3HD ARG 11 10.001 12.573 -19.418 88 HE ARG 11 HE ARG 11 12.645 13.199 -18.184 89 HH11 ARG 11 1HH2 ARG 11 10.576 13.715 -20.994 90 HH12 ARG 11 2HH2 ARG 11 11.445 15.176 -21.426 91 HH21 ARG 11 1HH1 ARG 11 13.737 15.005 -18.937 92 HH22 ARG 11 2HH1 ARG 11 13.150 15.808 -20.379 93 H LEU 12 H LEU 12 8.992 11.259 -13.538 94 HA LEU 12 HA LEU 12 7.009 13.403 -13.474 95 HB2 LEU 12 2HB LEU 12 9.019 12.330 -11.462 96 HB3 LEU 12 3HB LEU 12 8.088 13.793 -11.174 97 HG LEU 12 HG LEU 12 5.963 12.529 -11.425 98 HD11 LEU 12 1HD1 LEU 12 6.044 10.036 -11.159 99 HD12 LEU 12 2HD1 LEU 12 6.591 10.582 -12.739 100 HD13 LEU 12 3HD1 LEU 12 7.785 10.084 -11.515 101 HD21 LEU 12 3HD2 LEU 12 7.911 11.480 -9.333 102 HD22 LEU 12 1HD2 LEU 12 6.961 12.976 -9.224 103 HD23 LEU 12 2HD2 LEU 12 6.135 11.412 -9.229 104 H GLY 13 H GLY 13 7.338 15.616 -13.393 105 HA2 GLY 13 HA2 GLY 13 8.340 17.645 -13.803 106 HA3 GLY 13 HA3 GLY 13 9.860 16.945 -13.240 107 H ALA 14 H ALA 14 8.059 15.750 -16.068 108 HA ALA 14 HA ALA 14 10.344 15.582 -17.683 109 HB1 ALA 14 3HB ALA 14 7.405 15.619 -18.484 110 HB2 ALA 14 1HB ALA 14 8.742 15.026 -19.490 111 HB3 ALA 14 2HB ALA 14 8.341 14.197 -17.975 112 H VAL 15 H VAL 15 11.306 16.768 -19.194 113 HA VAL 15 HA VAL 15 10.155 19.293 -20.231 114 HB VAL 15 HB VAL 15 12.461 20.286 -20.055 115 HG11 VAL 15 1HG1 VAL 15 10.624 20.915 -18.515 116 HG12 VAL 15 2HG1 VAL 15 11.163 19.660 -17.381 117 HG13 VAL 15 3HG1 VAL 15 12.221 21.032 -17.761 118 HG21 VAL 15 3HG2 VAL 15 14.035 19.487 -18.401 119 HG22 VAL 15 1HG2 VAL 15 13.019 18.083 -18.037 120 HG23 VAL 15 2HG2 VAL 15 13.791 18.247 -19.636 121 H SER 16 H SER 16 11.832 18.604 -23.352 122 HA SER 16 HA SER 16 11.078 20.890 -21.668 123 HB2 SER 16 2HB SER 16 11.230 22.142 -23.758 124 HB3 SER 16 3HB SER 16 12.691 21.198 -23.438 125 HG SER 16 HG SER 16 12.009 20.992 -25.617 126 H TYR 17 H TYR 17 9.295 22.259 -22.194 127 HA TYR 17 HA TYR 17 6.796 20.806 -22.951 128 HB2 TYR 17 2HB TYR 17 5.696 22.381 -21.403 129 HB3 TYR 17 3HB TYR 17 6.883 21.338 -20.640 130 HD1 TYR 17 HD1 TYR 17 6.136 24.829 -21.643 131 HD2 TYR 17 HD2 TYR 17 8.915 22.207 -19.643 132 HE1 TYR 17 HE1 TYR 17 7.320 26.809 -20.671 133 HE2 TYR 17 HE2 TYR 17 10.106 24.174 -18.697 134 HH TYR 17 HH TYR 17 10.184 26.463 -18.549 135 H GLU 18 H GLU 18 8.837 22.909 -24.298 136 HA GLU 18 HA GLU 18 8.796 24.499 -25.913 137 HB2 GLU 18 2HB GLU 18 7.903 22.270 -26.853 138 HB3 GLU 18 3HB GLU 18 6.345 23.085 -26.982 139 HG2 GLU 18 2HG GLU 18 7.420 24.813 -28.456 140 HG3 GLU 18 3HG GLU 18 8.976 24.020 -28.236 141 H THR 19 H THR 19 7.585 25.525 -23.632 142 HA THR 19 HA THR 19 6.343 27.218 -22.814 143 HB THR 19 HB THR 19 6.132 28.542 -25.502 144 HG1 THR 19 HG1 THR 19 8.493 28.294 -23.941 145 HG21 THR 19 1HG2 THR 19 6.824 30.537 -24.190 146 HG22 THR 19 2HG2 THR 19 5.347 29.831 -23.535 147 HG23 THR 19 3HG2 THR 19 6.894 29.548 -22.714 148 H ASP 20 H ASP 20 4.869 24.903 -23.922 149 HA ASP 20 HA ASP 20 2.816 24.094 -24.064 150 HB2 ASP 20 2HB ASP 20 2.526 25.460 -21.982 151 HB3 ASP 20 3HB ASP 20 1.742 26.700 -22.962 152 H ARG 21 H ARG 21 0.614 24.241 -25.080 153 HA ARG 21 HA ARG 21 1.037 24.865 -27.884 154 HB2 ARG 21 2HB ARG 21 -1.468 23.837 -26.475 155 HB3 ARG 21 3HB ARG 21 -1.232 23.947 -28.214 156 HG2 ARG 21 2HG ARG 21 -0.580 21.798 -28.063 157 HG3 ARG 21 3HG ARG 21 0.975 22.491 -27.632 158 HD2 ARG 21 2HD ARG 21 0.532 20.757 -26.068 159 HD3 ARG 21 3HD ARG 21 0.301 22.256 -25.188 160 HE ARG 21 HE ARG 21 -1.912 20.573 -26.339 161 HH11 ARG 21 1HH2 ARG 21 -0.892 22.647 -23.629 162 HH12 ARG 21 2HH2 ARG 21 -2.388 22.335 -22.797 163 HH21 ARG 21 2HH1 ARG 21 -3.750 20.298 -25.183 164 HH22 ARG 21 1HH1 ARG 21 -3.941 21.073 -23.639 165 H ASN 22 H ASN 22 -0.070 26.175 -29.259 166 HA ASN 22 HA ASN 22 -0.831 28.795 -28.254 167 HB2 ASN 22 2HB ASN 22 0.517 28.332 -30.339 168 HB3 ASN 22 3HB ASN 22 -0.922 27.629 -31.074 169 HD21 ASN 22 2HD2 ASN 22 -0.864 29.204 -32.787 170 HD22 ASN 22 1HD2 ASN 22 -1.189 30.908 -32.454 171 H HIS 23 H HIS 23 -2.855 29.893 -28.731 172 HA HIS 23 HA HIS 23 -5.304 28.299 -28.488 173 HB2 HIS 23 2HB HIS 23 -5.071 30.579 -27.529 174 HB3 HIS 23 3HB HIS 23 -4.916 31.244 -29.159 175 HD2 HIS 23 HD2 HIS 23 -7.493 29.146 -27.097 176 HE1 HIS 23 HE1 HIS 23 -9.706 31.560 -29.831 177 HE2 HIS 23 HE2 HIS 23 -9.878 29.873 -27.928 178 H ASP 24 H ASP 24 -3.602 29.970 -31.068 179 HA ASP 24 HA ASP 24 -3.529 29.798 -33.286 180 HB2 ASP 24 2HB ASP 24 -3.122 27.381 -32.184 181 HB3 ASP 24 3HB ASP 24 -4.461 26.963 -33.243 182 H LEU 25 H LEU 25 -4.690 28.581 -35.364 183 HA LEU 25 HA LEU 25 -7.044 30.323 -35.657 184 HB2 LEU 25 2HB LEU 25 -5.524 28.685 -37.695 185 HB3 LEU 25 3HB LEU 25 -6.789 29.870 -38.033 186 HG LEU 25 HG LEU 25 -4.054 30.478 -36.816 187 HD11 LEU 25 1HD1 LEU 25 -5.218 31.122 -39.554 188 HD12 LEU 25 2HD1 LEU 25 -3.614 31.597 -38.951 189 HD13 LEU 25 3HD1 LEU 25 -3.987 29.887 -39.209 190 HD21 LEU 25 3HD2 LEU 25 -5.672 32.096 -35.962 191 HD22 LEU 25 1HD2 LEU 25 -4.672 32.866 -37.194 192 HD23 LEU 25 2HD2 LEU 25 -6.328 32.357 -37.599 193 H ALA 26 H ALA 26 -8.173 28.969 -34.143 194 HA ALA 26 HA ALA 26 -9.745 26.798 -35.464 195 HB1 ALA 26 3HB ALA 26 -10.340 26.076 -33.183 196 HB2 ALA 26 1HB ALA 26 -8.587 26.041 -33.466 197 HB3 ALA 26 2HB ALA 26 -9.306 27.359 -32.516 198 HA PRO 27 HA PRO 27 -13.094 29.820 -35.304 199 HB2 PRO 27 2HB PRO 27 -14.934 27.480 -35.777 200 HB3 PRO 27 3HB PRO 27 -14.783 29.020 -36.674 201 HG2 PRO 27 2HG PRO 27 -13.767 26.721 -37.674 202 HG3 PRO 27 3HG PRO 27 -12.818 28.243 -37.787 203 HD2 PRO 27 2HD PRO 27 -12.583 26.049 -35.690 204 HD3 PRO 27 3HD PRO 27 -11.311 26.787 -36.710 205 H ARG 28 H ARG 28 -12.442 29.850 -32.928 206 HA ARG 28 HA ARG 28 -14.864 29.438 -31.275 207 HB2 ARG 28 2HB ARG 28 -13.662 28.402 -29.477 208 HB3 ARG 28 3HB ARG 28 -13.407 27.488 -30.969 209 HG2 ARG 28 2HG ARG 28 -11.180 28.607 -31.252 210 HG3 ARG 28 3HG ARG 28 -11.436 29.417 -29.690 211 HD2 ARG 28 2HD ARG 28 -11.456 27.301 -28.519 212 HD3 ARG 28 3HD ARG 28 -11.505 26.397 -30.046 213 HE ARG 28 HE ARG 28 -9.149 27.982 -30.071 214 HH11 ARG 28 1HH2 ARG 28 -10.358 25.236 -28.261 215 HH12 ARG 28 2HH2 ARG 28 -8.770 24.547 -28.076 216 HH21 ARG 28 1HH1 ARG 28 -7.170 26.990 -29.898 217 HH22 ARG 28 2HH1 ARG 28 -7.017 25.529 -28.957 218 H GLN 29 H GLN 29 -14.766 30.479 -29.187 219 HA GLN 29 HA GLN 29 -13.318 33.077 -29.072 220 HB2 GLN 29 2HB GLN 29 -16.306 32.748 -28.563 221 HB3 GLN 29 3HB GLN 29 -15.380 34.242 -28.497 222 HG2 GLN 29 2HG GLN 29 -15.887 34.660 -30.637 223 HG3 GLN 29 3HG GLN 29 -15.063 33.189 -31.150 224 HE21 GLN 29 1HE2 GLN 29 -16.613 31.151 -30.157 225 HE22 GLN 29 2HE2 GLN 29 -18.206 31.235 -30.901 226 H ILE 30 H ILE 30 -12.313 33.059 -27.200 227 HA ILE 30 HA ILE 30 -13.447 31.767 -24.784 228 HB ILE 30 HB ILE 30 -10.828 33.289 -24.977 229 HG12 ILE 30 2HG1 ILE 30 -10.556 31.523 -26.518 230 HG13 ILE 30 3HG1 ILE 30 -9.718 31.066 -25.043 231 HG21 ILE 30 1HG2 ILE 30 -11.655 33.092 -22.696 232 HG22 ILE 30 2HG2 ILE 30 -11.983 31.361 -22.911 233 HG23 ILE 30 3HG2 ILE 30 -10.316 31.968 -22.905 234 HD11 ILE 30 3HD1 ILE 30 -12.369 29.980 -26.068 235 HD12 ILE 30 1HD1 ILE 30 -10.826 29.124 -25.929 236 HD13 ILE 30 2HD1 ILE 30 -11.687 29.606 -24.456 237 H ALA 31 H ALA 31 -15.040 32.907 -23.877 238 HA ALA 31 HA ALA 31 -14.575 35.805 -23.278 239 HB1 ALA 31 3HB ALA 31 -16.915 35.629 -22.342 240 HB2 ALA 31 1HB ALA 31 -16.772 35.486 -24.099 241 HB3 ALA 31 2HB ALA 31 -17.031 34.030 -23.096 242 H ARG 32 H ARG 32 -14.707 36.494 -21.121 243 HA ARG 32 HA ARG 32 -14.238 34.423 -19.009 244 HB2 ARG 32 2HB ARG 32 -12.747 36.925 -19.550 245 HB3 ARG 32 3HB ARG 32 -13.394 36.847 -17.914 246 HG2 ARG 32 2HG ARG 32 -12.398 34.670 -17.531 247 HG3 ARG 32 3HG ARG 32 -11.733 34.660 -19.179 248 HD2 ARG 32 2HD ARG 32 -10.220 36.429 -18.674 249 HD3 ARG 32 3HD ARG 32 -11.073 36.833 -17.168 250 HE ARG 32 HE ARG 32 -9.710 34.187 -17.536 251 HH11 ARG 32 1HH2 ARG 32 -10.080 37.039 -15.416 252 HH12 ARG 32 2HH2 ARG 32 -8.955 36.346 -14.290 253 HH21 ARG 32 1HH1 ARG 32 -8.695 33.313 -15.867 254 HH22 ARG 32 2HH1 ARG 32 -8.231 34.295 -14.496 255 H TYR 33 H TYR 33 -15.338 34.681 -17.074 256 HA TYR 33 HA TYR 33 -17.374 36.849 -16.926 257 HB2 TYR 33 2HB TYR 33 -18.008 33.925 -16.508 258 HB3 TYR 33 3HB TYR 33 -19.051 35.264 -16.127 259 HD1 TYR 33 HD1 TYR 33 -17.359 33.524 -18.973 260 HD2 TYR 33 HD2 TYR 33 -20.461 36.219 -17.723 261 HE1 TYR 33 HE1 TYR 33 -18.422 33.364 -21.227 262 HE2 TYR 33 HE2 TYR 33 -21.502 36.078 -19.992 263 HH TYR 33 HH TYR 33 -21.470 35.094 -21.982 264 H ARG 34 H ARG 34 -17.618 37.699 -14.967 265 HA ARG 34 HA ARG 34 -15.967 36.667 -12.710 266 HB2 ARG 34 2HB ARG 34 -15.522 38.951 -13.560 267 HB3 ARG 34 3HB ARG 34 -17.166 39.432 -13.148 268 HG2 ARG 34 2HG ARG 34 -16.684 39.121 -10.769 269 HG3 ARG 34 3HG ARG 34 -15.114 38.384 -11.138 270 HD2 ARG 34 2HD ARG 34 -14.417 40.533 -12.247 271 HD3 ARG 34 3HD ARG 34 -15.965 41.231 -11.783 272 HE ARG 34 HE ARG 34 -15.332 41.215 -9.493 273 HH11 ARG 34 1HH2 ARG 34 -12.556 40.275 -11.527 274 HH12 ARG 34 2HH2 ARG 34 -11.463 40.564 -10.207 275 HH21 ARG 34 2HH1 ARG 34 -13.810 41.589 -7.945 276 HH22 ARG 34 1HH1 ARG 34 -12.132 41.285 -8.277 277 H THR 35 H THR 35 -16.864 35.844 -10.955 278 HA THR 35 HA THR 35 -19.770 35.609 -10.680 279 HB THR 35 HB THR 35 -19.295 34.220 -8.692 280 HG1 THR 35 HG1 THR 35 -16.607 34.553 -9.333 281 HG21 THR 35 1HG2 THR 35 -19.317 33.151 -10.894 282 HG22 THR 35 2HG2 THR 35 -17.586 33.470 -11.097 283 HG23 THR 35 3HG2 THR 35 -18.143 32.401 -9.795 284 H ASP 36 H ASP 36 -20.483 35.780 -8.179 285 HA ASP 36 HA ASP 36 -20.347 38.661 -7.660 286 HB2 ASP 36 2HB ASP 36 -22.488 37.374 -7.631 287 HB3 ASP 36 3HB ASP 36 -21.902 36.459 -6.241 288 H ASN 37 H ASN 37 -18.602 35.953 -6.652 289 HA ASN 37 HA ASN 37 -17.681 37.139 -4.095 290 HB2 ASN 37 2HB ASN 37 -18.530 34.827 -4.190 291 HB3 ASN 37 3HB ASN 37 -17.335 34.414 -5.393 292 HD21 ASN 37 1HD2 ASN 37 -15.977 32.996 -4.351 293 HD22 ASN 37 2HD2 ASN 37 -15.351 33.249 -2.758 294 H GLY 38 H GLY 38 -17.061 37.870 -7.118 295 HA2 GLY 38 HA2 GLY 38 -15.324 39.100 -8.047 296 HA3 GLY 38 HA3 GLY 38 -14.234 38.614 -6.738 297 H GLU 39 H GLU 39 -15.613 35.827 -7.874 298 HA GLU 39 HA GLU 39 -12.953 35.057 -8.757 299 HB2 GLU 39 2HB GLU 39 -15.307 33.181 -8.713 300 HB3 GLU 39 3HB GLU 39 -13.600 32.852 -8.492 301 HG2 GLU 39 2HG GLU 39 -14.082 34.515 -6.354 302 HG3 GLU 39 3HG GLU 39 -15.724 33.900 -6.660 303 H GLU 40 H GLU 40 -12.284 35.184 -10.764 304 HA GLU 40 HA GLU 40 -14.236 35.223 -13.007 305 HB2 GLU 40 2HB GLU 40 -11.345 36.087 -12.764 306 HB3 GLU 40 3HB GLU 40 -12.148 35.872 -14.332 307 HG2 GLU 40 2HG GLU 40 -13.890 37.449 -13.721 308 HG3 GLU 40 3HG GLU 40 -13.162 37.685 -12.126 309 H PHE 41 H PHE 41 -14.530 33.720 -14.393 310 HA PHE 41 HA PHE 41 -12.533 31.521 -14.795 311 HB2 PHE 41 2HB PHE 41 -15.548 31.321 -14.590 312 HB3 PHE 41 3HB PHE 41 -14.484 30.018 -15.031 313 HD1 PHE 41 HD2 PHE 41 -12.978 28.964 -13.399 314 HD2 PHE 41 HD1 PHE 41 -15.665 32.110 -12.145 315 HE1 PHE 41 HE2 PHE 41 -12.586 28.359 -11.028 316 HE2 PHE 41 HE1 PHE 41 -15.332 31.445 -9.836 317 HZ PHE 41 HZ PHE 41 -13.773 29.598 -9.227 318 H GLU 42 H GLU 42 -12.808 30.356 -16.826 319 HA GLU 42 HA GLU 42 -13.441 32.254 -19.025 320 HB2 GLU 42 2HB GLU 42 -11.499 29.931 -19.238 321 HB3 GLU 42 3HB GLU 42 -11.734 31.315 -20.287 322 HG2 GLU 42 2HG GLU 42 -9.843 32.008 -19.240 323 HG3 GLU 42 3HG GLU 42 -11.063 32.726 -18.190 324 H VAL 43 H VAL 43 -14.835 31.713 -20.552 325 HA VAL 43 HA VAL 43 -15.887 28.912 -20.646 326 HB VAL 43 HB VAL 43 -17.460 31.401 -21.245 327 HG11 VAL 43 1HG1 VAL 43 -19.350 29.893 -21.313 328 HG12 VAL 43 2HG1 VAL 43 -18.156 29.340 -22.476 329 HG13 VAL 43 3HG1 VAL 43 -18.316 28.498 -20.920 330 HG21 VAL 43 3HG2 VAL 43 -17.697 29.594 -18.812 331 HG22 VAL 43 1HG2 VAL 43 -16.913 31.185 -18.782 332 HG23 VAL 43 2HG2 VAL 43 -18.612 31.081 -19.185 333 HA PRO 44 HA PRO 44 -14.353 29.511 -24.903 334 HB2 PRO 44 2HB PRO 44 -14.116 26.875 -25.573 335 HB3 PRO 44 3HB PRO 44 -12.908 27.723 -24.574 336 HG2 PRO 44 2HG PRO 44 -15.131 25.917 -23.634 337 HG3 PRO 44 3HG PRO 44 -13.425 25.966 -23.093 338 HD2 PRO 44 2HD PRO 44 -15.493 27.185 -21.754 339 HD3 PRO 44 3HD PRO 44 -13.830 27.847 -21.711 340 H PHE 45 H PHE 45 -15.727 29.978 -26.459 341 HA PHE 45 HA PHE 45 -18.264 28.406 -26.881 342 HB2 PHE 45 2HB PHE 45 -17.591 31.329 -27.280 343 HB3 PHE 45 3HB PHE 45 -18.933 30.599 -28.100 344 HD1 PHE 45 HD1 PHE 45 -17.598 31.682 -24.824 345 HD2 PHE 45 HD2 PHE 45 -20.983 29.937 -26.855 346 HE1 PHE 45 HE1 PHE 45 -19.024 32.130 -22.858 347 HE2 PHE 45 HE2 PHE 45 -22.396 30.370 -24.851 348 HZ PHE 45 HZ PHE 45 -21.393 31.445 -22.830 349 H ALA 46 H ALA 46 -18.785 27.789 -28.979 350 HA ALA 46 HA ALA 46 -16.568 27.750 -30.964 351 HB1 ALA 46 3HB ALA 46 -19.282 26.355 -30.958 352 HB2 ALA 46 1HB ALA 46 -17.974 26.113 -32.137 353 HB3 ALA 46 2HB ALA 46 -17.737 25.634 -30.446 354 H ASP 47 H ASP 47 -16.991 28.393 -33.201 355 HA ASP 47 HA ASP 47 -18.150 30.947 -33.513 356 HB2 ASP 47 2HB ASP 47 -16.358 30.003 -34.896 357 HB3 ASP 47 3HB ASP 47 -17.477 28.827 -35.588 358 H ASP 48 H ASP 48 -19.741 27.870 -33.626 359 HA ASP 48 HA ASP 48 -22.138 28.674 -35.073 360 HB2 ASP 48 2HB ASP 48 -21.275 26.337 -34.827 361 HB3 ASP 48 3HB ASP 48 -21.664 26.406 -33.110 362 H ALA 49 H ALA 49 -20.964 29.422 -31.958 363 HA ALA 49 HA ALA 49 -23.659 30.187 -30.905 364 HB1 ALA 49 3HB ALA 49 -21.153 29.396 -29.368 365 HB2 ALA 49 1HB ALA 49 -22.726 29.841 -28.672 366 HB3 ALA 49 2HB ALA 49 -22.574 28.357 -29.631 367 H GLU 50 H GLU 50 -23.656 32.078 -29.476 368 HA GLU 50 HA GLU 50 -21.438 34.029 -29.853 369 HB2 GLU 50 2HB GLU 50 -24.388 34.556 -30.347 370 HB3 GLU 50 3HB GLU 50 -23.239 35.840 -29.948 371 HG2 GLU 50 2HG GLU 50 -21.859 35.299 -31.893 372 HG3 GLU 50 3HG GLU 50 -22.919 33.953 -32.304 373 H ILE 51 H ILE 51 -20.940 35.162 -28.159 374 HA ILE 51 HA ILE 51 -21.339 34.278 -25.585 375 HB ILE 51 HB ILE 51 -20.441 37.094 -26.197 376 HG12 ILE 51 2HG1 ILE 51 -19.255 35.679 -27.799 377 HG13 ILE 51 3HG1 ILE 51 -18.183 36.352 -26.582 378 HG21 ILE 51 1HG2 ILE 51 -18.982 36.736 -24.277 379 HG22 ILE 51 2HG2 ILE 51 -20.659 36.464 -23.785 380 HG23 ILE 51 3HG2 ILE 51 -19.574 35.093 -24.067 381 HD11 ILE 51 3HD1 ILE 51 -19.224 33.494 -26.646 382 HD12 ILE 51 1HD1 ILE 51 -17.608 34.037 -27.133 383 HD13 ILE 51 2HD1 ILE 51 -18.085 34.153 -25.442 384 HA PRO 52 HA PRO 52 -25.123 36.606 -24.499 385 HB2 PRO 52 2HB PRO 52 -25.758 35.112 -22.319 386 HB3 PRO 52 3HB PRO 52 -26.111 34.571 -23.991 387 HG2 PRO 52 2HG PRO 52 -23.820 33.779 -22.188 388 HG3 PRO 52 3HG PRO 52 -24.825 32.734 -23.257 389 HD2 PRO 52 2HD PRO 52 -22.311 33.745 -23.911 390 HD3 PRO 52 3HD PRO 52 -23.518 33.289 -25.116 391 H GLY 53 H GLY 53 -25.391 38.149 -22.906 392 HA2 GLY 53 HA2 GLY 53 -23.286 39.519 -21.788 393 HA3 GLY 53 HA3 GLY 53 -24.944 39.610 -21.189 394 H THR 54 H THR 54 -24.957 36.796 -20.188 395 HA THR 54 HA THR 54 -22.725 36.716 -18.299 396 HB THR 54 HB THR 54 -24.281 36.130 -16.398 397 HG1 THR 54 HG1 THR 54 -26.469 36.301 -16.648 398 HG21 THR 54 1HG2 THR 54 -25.299 38.247 -15.891 399 HG22 THR 54 2HG2 THR 54 -23.769 38.562 -16.706 400 HG23 THR 54 3HG2 THR 54 -25.282 38.740 -17.599 401 H TRP 55 H TRP 55 -22.512 34.593 -17.169 402 HA TRP 55 HA TRP 55 -23.850 32.259 -18.314 403 HB2 TRP 55 2HB TRP 55 -22.095 32.969 -20.011 404 HB3 TRP 55 3HB TRP 55 -20.880 32.617 -18.792 405 HD1 TRP 55 HD1 TRP 55 -20.322 30.118 -18.301 406 HE1 TRP 55 HE1 TRP 55 -20.666 27.957 -19.606 407 HE3 TRP 55 HE3 TRP 55 -24.007 31.693 -21.430 408 HZ2 TRP 55 HZ2 TRP 55 -22.455 26.968 -21.670 409 HZ3 TRP 55 HZ3 TRP 55 -25.049 30.118 -23.066 410 HH2 TRP 55 HH2 TRP 55 -24.271 27.761 -23.195 411 H LEU 56 H LEU 56 -23.411 30.306 -17.134 412 HA LEU 56 HA LEU 56 -22.778 30.732 -14.361 413 HB2 LEU 56 2HB LEU 56 -24.262 28.890 -15.824 414 HB3 LEU 56 3HB LEU 56 -22.872 27.943 -15.296 415 HG LEU 56 HG LEU 56 -24.640 29.580 -13.432 416 HD11 LEU 56 1HD1 LEU 56 -25.642 27.421 -12.785 417 HD12 LEU 56 2HD1 LEU 56 -25.920 27.760 -14.500 418 HD13 LEU 56 3HD1 LEU 56 -24.673 26.587 -14.021 419 HD21 LEU 56 3HD2 LEU 56 -22.565 27.409 -12.888 420 HD22 LEU 56 1HD2 LEU 56 -22.415 29.127 -12.482 421 HD23 LEU 56 2HD2 LEU 56 -23.634 28.143 -11.670 422 H CYS 57 H CYS 57 -20.927 30.566 -13.305 423 HA CYS 57 HA CYS 57 -18.469 29.741 -14.740 424 HB2 CYS 57 2HB CYS 57 -19.052 31.372 -12.244 425 HB3 CYS 57 3HB CYS 57 -17.420 30.859 -12.684 426 HG CYS 57 HG CYS 57 -19.545 32.394 -14.694 427 H ARG 58 H ARG 58 -16.758 28.657 -13.489 428 HA ARG 58 HA ARG 58 -17.689 26.105 -12.641 429 HB2 ARG 58 2HB ARG 58 -14.885 27.155 -12.146 430 HB3 ARG 58 3HB ARG 58 -15.385 25.487 -12.386 431 HG2 ARG 58 2HG ARG 58 -15.948 26.017 -14.772 432 HG3 ARG 58 3HG ARG 58 -15.391 27.679 -14.505 433 HD2 ARG 58 2HD ARG 58 -13.160 26.629 -13.738 434 HD3 ARG 58 3HD ARG 58 -13.739 25.140 -14.491 435 HE ARG 58 HE ARG 58 -14.040 26.551 -16.605 436 HH11 ARG 58 1HH2 ARG 58 -11.363 27.322 -14.397 437 HH12 ARG 58 2HH2 ARG 58 -10.673 28.398 -15.611 438 HH21 ARG 58 1HH1 ARG 58 -12.978 27.993 -17.980 439 HH22 ARG 58 2HH1 ARG 58 -11.419 28.619 -17.448 440 H ASN 59 H ASN 59 -17.065 28.930 -10.716 441 HA ASN 59 HA ASN 59 -16.835 27.643 -8.175 442 HB2 ASN 59 2HB ASN 59 -16.149 29.908 -8.517 443 HB3 ASN 59 3HB ASN 59 -17.779 30.391 -9.011 444 HD21 ASN 59 1HD2 ASN 59 -17.672 32.091 -7.402 445 HD22 ASN 59 2HD2 ASN 59 -17.816 31.692 -5.724 446 H GLY 60 H GLY 60 -19.532 28.078 -10.286 447 HA2 GLY 60 HA2 GLY 60 -21.611 26.954 -10.111 448 HA3 GLY 60 HA3 GLY 60 -21.460 26.881 -8.354 449 H MET 61 H MET 61 -20.710 29.948 -9.748 450 HA MET 61 HA MET 61 -23.380 31.073 -9.076 451 HB2 MET 61 2HB MET 61 -21.470 31.751 -7.597 452 HB3 MET 61 3HB MET 61 -20.687 32.463 -8.994 453 HG2 MET 61 2HG MET 61 -21.894 34.127 -7.610 454 HG3 MET 61 3HG MET 61 -22.470 34.079 -9.273 455 HE1 MET 61 3HE MET 61 -25.745 35.092 -7.470 456 HE2 MET 61 1HE MET 61 -24.108 35.621 -7.036 457 HE3 MET 61 2HE MET 61 -24.568 35.463 -8.749 458 H GLU 62 H GLU 62 -24.280 32.606 -10.504 459 HA GLU 62 HA GLU 62 -23.528 32.404 -13.305 460 HB2 GLU 62 2HB GLU 62 -25.866 32.752 -12.526 461 HB3 GLU 62 3HB GLU 62 -25.431 34.396 -12.029 462 HG2 GLU 62 2HG GLU 62 -24.714 34.882 -14.381 463 HG3 GLU 62 3HG GLU 62 -25.170 33.246 -14.853 464 H GLY 63 H GLY 63 -21.755 33.268 -14.078 465 HA2 GLY 63 HA2 GLY 63 -20.426 35.587 -12.885 466 HA3 GLY 63 HA3 GLY 63 -19.841 34.600 -14.193 467 H THR 64 H THR 64 -20.092 37.569 -13.982 468 HA THR 64 HA THR 64 -21.780 38.022 -16.405 469 HB THR 64 HB THR 64 -20.634 40.084 -14.491 470 HG1 THR 64 HG1 THR 64 -22.303 38.886 -13.563 471 HG21 THR 64 1HG2 THR 64 -22.520 40.352 -16.882 472 HG22 THR 64 2HG2 THR 64 -22.346 41.595 -15.622 473 HG23 THR 64 3HG2 THR 64 -20.960 41.158 -16.626 474 H LEU 65 H LEU 65 -20.999 38.804 -18.261 475 HA LEU 65 HA LEU 65 -18.452 38.051 -19.030 476 HB2 LEU 65 2HB LEU 65 -20.496 38.284 -20.401 477 HB3 LEU 65 3HB LEU 65 -20.383 40.036 -20.301 478 HG LEU 65 HG LEU 65 -18.121 39.792 -21.529 479 HD11 LEU 65 1HD1 LEU 65 -17.628 37.492 -21.021 480 HD12 LEU 65 2HD1 LEU 65 -19.060 36.956 -21.907 481 HD13 LEU 65 3HD1 LEU 65 -17.705 37.767 -22.751 482 HD21 LEU 65 3HD2 LEU 65 -19.192 39.400 -23.722 483 HD22 LEU 65 1HD2 LEU 65 -20.622 38.724 -22.905 484 HD23 LEU 65 2HD2 LEU 65 -20.196 40.437 -22.697 485 H ILE 66 H ILE 66 -16.528 38.807 -18.835 486 HA ILE 66 HA ILE 66 -15.936 41.680 -19.171 487 HB ILE 66 HB ILE 66 -14.063 41.599 -17.689 488 HG12 ILE 66 2HG1 ILE 66 -13.497 39.182 -17.813 489 HG13 ILE 66 3HG1 ILE 66 -13.481 39.858 -16.197 490 HG21 ILE 66 1HG2 ILE 66 -16.137 42.425 -16.759 491 HG22 ILE 66 2HG2 ILE 66 -16.624 40.800 -16.250 492 HG23 ILE 66 3HG2 ILE 66 -15.215 41.570 -15.506 493 HD11 ILE 66 3HD1 ILE 66 -14.418 37.673 -16.084 494 HD12 ILE 66 1HD1 ILE 66 -15.636 38.889 -15.665 495 HD13 ILE 66 2HD1 ILE 66 -15.672 38.145 -17.241 496 H GLU 67 H GLU 67 -13.803 42.052 -20.177 497 HA GLU 67 HA GLU 67 -13.599 40.495 -22.524 498 HB2 GLU 67 2HB GLU 67 -11.582 42.455 -21.376 499 HB3 GLU 67 3HB GLU 67 -11.587 41.811 -23.027 500 HG2 GLU 67 2HG GLU 67 -13.914 42.756 -23.318 501 HG3 GLU 67 3HG GLU 67 -13.737 43.558 -21.756 502 H GLY 68 H GLY 68 -13.005 38.485 -22.690 503 HA2 GLY 68 HA2 GLY 68 -10.970 37.099 -21.181 504 HA3 GLY 68 HA3 GLY 68 -11.786 36.532 -22.640 505 H ASP 69 H ASP 69 -9.429 39.028 -21.675 506 HA ASP 69 HA ASP 69 -8.107 39.093 -24.253 507 HB2 ASP 69 2HB ASP 69 -8.446 41.081 -22.867 508 HB3 ASP 69 3HB ASP 69 -7.444 40.396 -21.588 509 H LEU 70 H LEU 70 -7.318 37.098 -24.655 510 HA LEU 70 HA LEU 70 -5.733 35.494 -22.961 511 HB2 LEU 70 2HB LEU 70 -5.936 35.585 -25.990 512 HB3 LEU 70 3HB LEU 70 -5.138 34.282 -25.117 513 HG LEU 70 HG LEU 70 -8.087 34.959 -24.788 514 HD11 LEU 70 1HD1 LEU 70 -6.751 32.789 -26.453 515 HD12 LEU 70 2HD1 LEU 70 -8.495 33.002 -26.208 516 HD13 LEU 70 3HD1 LEU 70 -7.578 34.229 -27.088 517 HD21 LEU 70 3HD2 LEU 70 -7.156 33.751 -22.853 518 HD22 LEU 70 1HD2 LEU 70 -8.194 32.685 -23.802 519 HD23 LEU 70 2HD2 LEU 70 -6.430 32.541 -23.937 520 HA PRO 71 HA PRO 71 -1.717 37.278 -23.532 521 HB2 PRO 71 2HB PRO 71 -0.463 35.779 -21.721 522 HB3 PRO 71 3HB PRO 71 -2.014 36.576 -21.340 523 HG2 PRO 71 2HG PRO 71 -1.519 33.665 -21.918 524 HG3 PRO 71 3HG PRO 71 -2.730 34.430 -20.847 525 HD2 PRO 71 2HD PRO 71 -2.987 33.631 -23.649 526 HD3 PRO 71 3HD PRO 71 -4.233 34.255 -22.551 527 H GLU 72 H GLU 72 0.238 35.558 -26.132 528 HA GLU 72 HA GLU 72 -2.077 37.412 -25.911 529 HB2 GLU 72 2HB GLU 72 0.723 38.110 -26.886 530 HB3 GLU 72 3HB GLU 72 -0.684 39.182 -26.846 531 HG2 GLU 72 2HG GLU 72 -0.707 38.959 -24.359 532 HG3 GLU 72 3HG GLU 72 0.790 38.037 -24.441 533 HA PRO 73 HA PRO 73 -1.836 35.222 -30.097 534 HB2 PRO 73 2HB PRO 73 -4.160 33.802 -30.088 535 HB3 PRO 73 3HB PRO 73 -2.650 33.185 -29.347 536 HG2 PRO 73 2HG PRO 73 -4.958 34.592 -27.968 537 HG3 PRO 73 3HG PRO 73 -4.158 33.061 -27.488 538 HD2 PRO 73 2HD PRO 73 -3.472 35.458 -26.379 539 HD3 PRO 73 3HD PRO 73 -2.251 34.188 -26.693 540 H LYS 74 H LYS 74 -2.916 35.936 -31.930 541 HA LYS 74 HA LYS 74 -5.246 37.769 -31.705 542 HB2 LYS 74 2HB LYS 74 -3.186 39.114 -31.334 543 HB3 LYS 74 3HB LYS 74 -2.555 38.576 -32.895 544 HG2 LYS 74 2HG LYS 74 -4.394 39.730 -34.067 545 HG3 LYS 74 3HG LYS 74 -5.160 40.120 -32.519 546 HD2 LYS 74 2HD LYS 74 -4.066 42.093 -33.290 547 HD3 LYS 74 3HD LYS 74 -3.131 41.488 -31.916 548 HE2 LYS 74 2HE LYS 74 -1.508 40.447 -33.503 549 HE3 LYS 74 3HE LYS 74 -2.467 41.033 -34.868 550 HZ1 LYS 74 HZ1 LYS 74 -0.606 42.518 -34.385 551 HZ2 LYS 74 HZ2 LYS 74 -2.007 43.310 -34.123 552 HZ3 LYS 74 HZ3 LYS 74 -1.125 42.767 -32.859 553 H LYS 75 H LYS 75 -6.467 37.938 -33.508 554 HA LYS 75 HA LYS 75 -5.826 36.237 -35.895 555 HB2 LYS 75 2HB LYS 75 -8.436 37.005 -34.546 556 HB3 LYS 75 3HB LYS 75 -8.401 36.664 -36.269 557 HG2 LYS 75 2HG LYS 75 -9.022 34.656 -35.207 558 HG3 LYS 75 3HG LYS 75 -7.391 34.435 -35.841 559 HD2 LYS 75 2HD LYS 75 -6.461 34.729 -33.566 560 HD3 LYS 75 3HD LYS 75 -8.092 35.022 -32.919 561 HE2 LYS 75 2HE LYS 75 -8.784 32.757 -33.565 562 HE3 LYS 75 3HE LYS 75 -7.252 32.499 -34.405 563 HZ1 LYS 75 HZ1 LYS 75 -6.139 32.761 -32.205 564 HZ2 LYS 75 HZ2 LYS 75 -7.602 32.751 -31.466 565 HZ3 LYS 75 HZ3 LYS 75 -7.092 31.448 -32.311 566 H VAL 76 H VAL 76 -6.250 37.046 -37.970 567 HA VAL 76 HA VAL 76 -5.501 39.871 -38.228 568 HB VAL 76 HB VAL 76 -5.828 37.870 -40.481 569 HG11 VAL 76 1HG1 VAL 76 -5.623 40.267 -41.167 570 HG12 VAL 76 2HG1 VAL 76 -4.147 40.413 -40.191 571 HG13 VAL 76 3HG1 VAL 76 -4.187 39.343 -41.609 572 HG21 VAL 76 3HG2 VAL 76 -4.214 36.900 -38.906 573 HG22 VAL 76 1HG2 VAL 76 -3.358 37.549 -40.300 574 HG23 VAL 76 2HG2 VAL 76 -3.368 38.459 -38.773 575 H LYS 77 H LYS 77 -7.626 40.432 -37.251 576 HA LYS 77 HA LYS 77 -9.565 41.149 -39.392 577 HB2 LYS 77 2HB LYS 77 -10.301 39.952 -36.683 578 HB3 LYS 77 3HB LYS 77 -11.445 40.729 -37.780 579 HG2 LYS 77 2HG LYS 77 -10.875 39.042 -39.541 580 HG3 LYS 77 3HG LYS 77 -9.837 38.207 -38.366 581 HD2 LYS 77 2HD LYS 77 -11.787 37.857 -36.878 582 HD3 LYS 77 3HD LYS 77 -12.830 38.701 -38.046 583 HE2 LYS 77 2HE LYS 77 -12.243 37.002 -39.774 584 HE3 LYS 77 3HE LYS 77 -11.242 36.150 -38.591 585 HZ1 LYS 77 HZ1 LYS 77 -14.177 36.573 -38.356 586 HZ2 LYS 77 HZ2 LYS 77 -13.456 35.165 -38.753 587 HZ3 LYS 77 HZ3 LYS 77 -13.256 35.786 -37.257 588 HA PRO 78 HA PRO 78 -9.225 45.110 -37.356 589 HB2 PRO 78 2HB PRO 78 -11.342 46.478 -38.396 590 HB3 PRO 78 3HB PRO 78 -9.931 45.989 -39.385 591 HG2 PRO 78 2HG PRO 78 -12.595 44.551 -39.105 592 HG3 PRO 78 3HG PRO 78 -11.732 44.993 -40.614 593 HD2 PRO 78 2HD PRO 78 -11.531 42.509 -39.498 594 HD3 PRO 78 3HD PRO 78 -10.141 43.282 -40.316 595 HA PRO 79 HA PRO 79 -12.015 45.010 -33.829 596 HB2 PRO 79 2HB PRO 79 -11.897 47.578 -32.887 597 HB3 PRO 79 3HB PRO 79 -10.521 46.438 -32.780 598 HG2 PRO 79 2HG PRO 79 -11.025 48.567 -34.889 599 HG3 PRO 79 3HG PRO 79 -9.522 48.268 -33.959 600 HD2 PRO 79 2HD PRO 79 -9.890 47.278 -36.472 601 HD3 PRO 79 3HD PRO 79 -9.009 46.346 -35.224 602 H ARG 80 H ARG 80 -15.247 46.582 -34.472 603 HA ARG 80 HA ARG 80 -13.656 44.883 -32.599 604 HB2 ARG 80 2HB ARG 80 -13.801 47.138 -31.613 605 HB3 ARG 80 3HB ARG 80 -15.552 47.145 -31.847 606 HG2 ARG 80 2HG ARG 80 -15.791 45.255 -30.275 607 HG3 ARG 80 3HG ARG 80 -14.028 45.176 -30.074 608 HD2 ARG 80 2HD ARG 80 -14.004 47.409 -29.067 609 HD3 ARG 80 3HD ARG 80 -15.712 47.633 -29.443 610 HE ARG 80 HE ARG 80 -16.349 46.253 -27.687 611 HH11 ARG 80 1HH1 ARG 80 -12.804 46.159 -27.812 612 HH12 ARG 80 2HH1 ARG 80 -12.771 45.395 -26.216 613 HH21 ARG 80 1HH2 ARG 80 -16.057 45.266 -25.684 614 HH22 ARG 80 2HH2 ARG 80 -14.396 44.948 -25.166 Start of MODEL 31 1 H1 SER 1 1H SER 1 -16.391 10.994 -15.111 2 H2 SER 1 2H SER 1 -16.876 9.568 -15.762 3 H3 SER 1 3H SER 1 -15.734 10.463 -16.513 4 HA SER 1 HA SER 1 -14.182 10.141 -14.728 5 HB2 SER 1 2HB SER 1 -15.925 9.939 -12.949 6 HB3 SER 1 3HB SER 1 -16.292 8.303 -13.531 7 HG SER 1 HG SER 1 -14.766 8.387 -11.775 8 H MET 2 H MET 2 -12.773 8.286 -14.628 9 HA MET 2 HA MET 2 -13.470 5.902 -16.211 10 HB2 MET 2 2HB MET 2 -12.449 7.649 -17.793 11 HB3 MET 2 3HB MET 2 -10.934 7.424 -16.913 12 HG2 MET 2 2HG MET 2 -11.187 4.911 -17.422 13 HG3 MET 2 3HG MET 2 -12.550 5.348 -18.446 14 HE1 MET 2 3HE MET 2 -10.012 4.359 -21.158 15 HE2 MET 2 1HE MET 2 -10.460 3.572 -19.629 16 HE3 MET 2 2HE MET 2 -11.711 4.319 -20.642 17 H ALA 3 H ALA 3 -13.411 5.752 -13.602 18 HA ALA 3 HA ALA 3 -10.911 5.377 -12.303 19 HB1 ALA 3 3HB ALA 3 -12.269 4.225 -10.595 20 HB2 ALA 3 1HB ALA 3 -13.067 5.707 -11.151 21 HB3 ALA 3 2HB ALA 3 -13.631 4.121 -11.729 22 H ASP 4 H ASP 4 -12.589 3.263 -14.522 23 HA ASP 4 HA ASP 4 -11.156 0.813 -13.931 24 HB2 ASP 4 2HB ASP 4 -12.191 0.023 -15.977 25 HB3 ASP 4 3HB ASP 4 -13.374 0.838 -14.963 26 H ARG 5 H ARG 5 -10.288 3.707 -15.520 27 HA ARG 5 HA ARG 5 -8.472 4.495 -16.572 28 HB2 ARG 5 2HB ARG 5 -7.271 2.169 -15.047 29 HB3 ARG 5 3HB ARG 5 -6.280 3.345 -15.892 30 HG2 ARG 5 2HG ARG 5 -7.086 5.173 -14.567 31 HG3 ARG 5 3HG ARG 5 -8.354 4.185 -13.826 32 HD2 ARG 5 2HD ARG 5 -6.689 2.788 -12.700 33 HD3 ARG 5 3HD ARG 5 -5.381 3.632 -13.529 34 HE ARG 5 HE ARG 5 -5.518 5.378 -12.040 35 HH11 ARG 5 1HH2 ARG 5 -8.516 3.551 -11.567 36 HH12 ARG 5 2HH2 ARG 5 -8.804 4.328 -10.040 37 HH21 ARG 5 1HH1 ARG 5 -6.045 6.357 -10.141 38 HH22 ARG 5 2HH1 ARG 5 -7.492 5.903 -9.293 39 H VAL 6 H VAL 6 -6.477 4.094 -17.915 40 HA VAL 6 HA VAL 6 -7.276 2.644 -20.376 41 HB VAL 6 HB VAL 6 -5.031 4.653 -19.930 42 HG11 VAL 6 1HG1 VAL 6 -4.591 3.259 -21.896 43 HG12 VAL 6 2HG1 VAL 6 -6.243 3.562 -22.499 44 HG13 VAL 6 3HG1 VAL 6 -5.052 4.875 -22.389 45 HG21 VAL 6 3HG2 VAL 6 -7.247 5.755 -19.630 46 HG22 VAL 6 1HG2 VAL 6 -6.430 6.293 -21.092 47 HG23 VAL 6 2HG2 VAL 6 -7.758 5.117 -21.206 48 H LEU 7 H LEU 7 -5.758 1.230 -21.331 49 HA LEU 7 HA LEU 7 -3.841 -0.142 -19.494 50 HB2 LEU 7 2HB LEU 7 -4.989 -0.986 -22.166 51 HB3 LEU 7 3HB LEU 7 -3.857 -1.919 -21.188 52 HG LEU 7 HG LEU 7 -6.702 -1.157 -20.384 53 HD11 LEU 7 1HD1 LEU 7 -7.156 -3.554 -20.635 54 HD12 LEU 7 2HD1 LEU 7 -6.567 -2.868 -22.157 55 HD13 LEU 7 3HD1 LEU 7 -5.476 -3.840 -21.145 56 HD21 LEU 7 3HD2 LEU 7 -5.329 -1.332 -18.364 57 HD22 LEU 7 1HD2 LEU 7 -6.354 -2.760 -18.504 58 HD23 LEU 7 2HD2 LEU 7 -4.632 -2.869 -18.934 59 H ARG 8 H ARG 8 -1.095 1.500 -21.163 60 HA ARG 8 HA ARG 8 -2.595 1.155 -18.581 61 HB2 ARG 8 2HB ARG 8 -0.786 -0.495 -18.854 62 HB3 ARG 8 3HB ARG 8 0.375 0.820 -19.071 63 HG2 ARG 8 2HG ARG 8 -0.125 1.646 -16.775 64 HG3 ARG 8 3HG ARG 8 -1.378 0.409 -16.600 65 HD2 ARG 8 2HD ARG 8 0.590 -0.323 -15.427 66 HD3 ARG 8 3HD ARG 8 0.343 -1.364 -16.839 67 HE ARG 8 HE ARG 8 2.124 0.821 -17.474 68 HH11 ARG 8 1HH1 ARG 8 2.167 -2.226 -15.745 69 HH12 ARG 8 2HH1 ARG 8 3.879 -2.443 -15.983 70 HH21 ARG 8 2HH2 ARG 8 4.303 0.478 -17.751 71 HH22 ARG 8 1HH2 ARG 8 5.051 -0.945 -17.087 72 H GLY 9 H GLY 9 -3.275 3.090 -17.987 73 HA2 GLY 9 HA2 GLY 9 -1.782 5.215 -17.051 74 HA3 GLY 9 HA3 GLY 9 -1.953 5.571 -18.771 75 H SER 10 H SER 10 -3.145 7.460 -18.256 76 HA SER 10 HA SER 10 -6.043 6.978 -17.912 77 HB2 SER 10 2HB SER 10 -6.330 8.679 -16.250 78 HB3 SER 10 3HB SER 10 -5.112 7.544 -15.656 79 HG SER 10 HG SER 10 -4.315 9.588 -15.314 80 H ARG 11 H ARG 11 -7.312 8.996 -18.390 81 HA ARG 11 HA ARG 11 -6.300 10.276 -20.870 82 HB2 ARG 11 2HB ARG 11 -9.060 10.231 -19.579 83 HB3 ARG 11 3HB ARG 11 -8.668 10.989 -21.127 84 HG2 ARG 11 2HG ARG 11 -7.949 8.800 -22.034 85 HG3 ARG 11 3HG ARG 11 -8.402 8.013 -20.512 86 HD2 ARG 11 2HD ARG 11 -10.729 8.689 -20.783 87 HD3 ARG 11 3HD ARG 11 -10.327 9.624 -22.224 88 HE ARG 11 HE ARG 11 -9.591 6.791 -22.428 89 HH11 ARG 11 1HH2 ARG 11 -12.243 8.998 -23.039 90 HH12 ARG 11 2HH2 ARG 11 -13.185 7.767 -23.828 91 HH21 ARG 11 2HH1 ARG 11 -10.625 5.467 -23.755 92 HH22 ARG 11 1HH1 ARG 11 -12.268 5.793 -24.266 93 H LEU 12 H LEU 12 -5.912 11.134 -17.744 94 HA LEU 12 HA LEU 12 -7.049 13.748 -17.591 95 HB2 LEU 12 2HB LEU 12 -4.697 12.565 -16.069 96 HB3 LEU 12 3HB LEU 12 -5.552 14.041 -15.634 97 HG LEU 12 HG LEU 12 -6.755 11.235 -15.662 98 HD11 LEU 12 1HD1 LEU 12 -6.043 13.093 -13.355 99 HD12 LEU 12 2HD1 LEU 12 -6.795 11.486 -13.225 100 HD13 LEU 12 3HD1 LEU 12 -5.139 11.641 -13.834 101 HD21 LEU 12 3HD2 LEU 12 -8.515 12.867 -16.156 102 HD22 LEU 12 1HD2 LEU 12 -8.682 12.296 -14.495 103 HD23 LEU 12 2HD2 LEU 12 -7.976 13.898 -14.808 104 H GLY 13 H GLY 13 -6.438 15.697 -18.225 105 HA2 GLY 13 HA2 GLY 13 -5.234 17.434 -19.112 106 HA3 GLY 13 HA3 GLY 13 -3.751 16.573 -18.700 107 H ALA 14 H ALA 14 -5.863 14.812 -20.822 108 HA ALA 14 HA ALA 14 -4.421 15.655 -23.283 109 HB1 ALA 14 3HB ALA 14 -3.048 13.930 -22.115 110 HB2 ALA 14 1HB ALA 14 -4.440 12.824 -22.135 111 HB3 ALA 14 2HB ALA 14 -3.680 13.338 -23.657 112 H VAL 15 H VAL 15 -5.153 14.152 -25.151 113 HA VAL 15 HA VAL 15 -8.092 13.989 -25.378 114 HB VAL 15 HB VAL 15 -7.687 13.030 -27.574 115 HG11 VAL 15 1HG1 VAL 15 -5.928 15.477 -27.146 116 HG12 VAL 15 2HG1 VAL 15 -6.695 14.955 -28.661 117 HG13 VAL 15 3HG1 VAL 15 -7.699 15.491 -27.302 118 HG21 VAL 15 3HG2 VAL 15 -5.624 11.739 -27.139 119 HG22 VAL 15 1HG2 VAL 15 -5.450 12.809 -28.535 120 HG23 VAL 15 2HG2 VAL 15 -4.700 13.250 -26.989 121 H SER 16 H SER 16 -9.175 12.077 -26.022 122 HA SER 16 HA SER 16 -8.913 10.158 -23.924 123 HB2 SER 16 2HB SER 16 -10.736 10.550 -26.281 124 HB3 SER 16 3HB SER 16 -10.751 9.025 -25.401 125 HG SER 16 HG SER 16 -11.070 11.609 -24.243 126 H TYR 17 H TYR 17 -8.389 8.064 -23.852 127 HA TYR 17 HA TYR 17 -6.904 6.782 -26.079 128 HB2 TYR 17 2HB TYR 17 -5.977 7.196 -23.218 129 HB3 TYR 17 3HB TYR 17 -5.141 6.187 -24.368 130 HD1 TYR 17 HD2 TYR 17 -5.028 7.729 -26.850 131 HD2 TYR 17 HD1 TYR 17 -4.514 8.990 -22.751 132 HE1 TYR 17 HE2 TYR 17 -3.569 9.576 -27.608 133 HE2 TYR 17 HE1 TYR 17 -3.039 10.837 -23.512 134 HH TYR 17 HH TYR 17 -2.044 11.874 -25.303 135 H GLU 18 H GLU 18 -7.918 3.630 -25.019 136 HA GLU 18 HA GLU 18 -5.249 4.390 -25.451 137 HB2 GLU 18 2HB GLU 18 -6.947 2.253 -26.761 138 HB3 GLU 18 3HB GLU 18 -5.199 2.398 -26.966 139 HG2 GLU 18 2HG GLU 18 -4.857 2.087 -24.539 140 HG3 GLU 18 3HG GLU 18 -6.602 1.953 -24.300 141 H THR 19 H THR 19 -7.931 4.708 -27.507 142 HA THR 19 HA THR 19 -6.641 6.792 -29.092 143 HB THR 19 HB THR 19 -7.468 5.914 -31.298 144 HG1 THR 19 HG1 THR 19 -7.531 3.456 -29.884 145 HG21 THR 19 1HG2 THR 19 -5.054 5.837 -30.649 146 HG22 THR 19 2HG2 THR 19 -5.292 4.154 -30.126 147 HG23 THR 19 3HG2 THR 19 -5.551 4.603 -31.824 148 H ASP 20 H ASP 20 -8.184 8.028 -30.399 149 HA ASP 20 HA ASP 20 -11.053 7.587 -29.970 150 HB2 ASP 20 2HB ASP 20 -10.331 8.818 -27.949 151 HB3 ASP 20 3HB ASP 20 -9.648 10.096 -28.960 152 H ARG 21 H ARG 21 -12.357 8.746 -31.434 153 HA ARG 21 HA ARG 21 -10.953 10.019 -33.751 154 HB2 ARG 21 2HB ARG 21 -12.377 8.841 -35.277 155 HB3 ARG 21 3HB ARG 21 -11.547 7.696 -34.231 156 HG2 ARG 21 2HG ARG 21 -13.589 7.421 -32.855 157 HG3 ARG 21 3HG ARG 21 -14.452 8.594 -33.859 158 HD2 ARG 21 2HD ARG 21 -13.256 5.979 -34.864 159 HD3 ARG 21 3HD ARG 21 -14.950 6.204 -34.397 160 HE ARG 21 HE ARG 21 -14.398 8.199 -36.301 161 HH11 ARG 21 1HH2 ARG 21 -14.545 4.699 -36.310 162 HH12 ARG 21 2HH2 ARG 21 -14.968 4.629 -37.999 163 HH21 ARG 21 1HH1 ARG 21 -14.931 8.039 -38.452 164 HH22 ARG 21 2HH1 ARG 21 -15.183 6.477 -39.173 165 H ASN 22 H ASN 22 -12.679 11.123 -31.386 166 HA ASN 22 HA ASN 22 -14.301 12.972 -33.093 167 HB2 ASN 22 2HB ASN 22 -16.060 12.989 -31.405 168 HB3 ASN 22 3HB ASN 22 -15.821 11.369 -32.046 169 HD21 ASN 22 2HD2 ASN 22 -15.073 9.729 -30.640 170 HD22 ASN 22 1HD2 ASN 22 -14.516 10.054 -29.012 171 H HIS 23 H HIS 23 -12.022 12.696 -30.437 172 HA HIS 23 HA HIS 23 -12.187 15.413 -29.488 173 HB2 HIS 23 2HB HIS 23 -10.057 13.259 -29.457 174 HB3 HIS 23 3HB HIS 23 -9.668 14.905 -28.980 175 HD2 HIS 23 HD2 HIS 23 -12.767 12.694 -28.002 176 HE1 HIS 23 HE1 HIS 23 -11.060 14.293 -24.439 177 HE2 HIS 23 HE2 HIS 23 -12.955 12.870 -25.387 178 H ASP 24 H ASP 24 -11.779 17.243 -30.514 179 HA ASP 24 HA ASP 24 -9.568 17.587 -32.377 180 HB2 ASP 24 2HB ASP 24 -11.767 16.671 -33.616 181 HB3 ASP 24 3HB ASP 24 -12.289 18.345 -33.461 182 H LEU 25 H LEU 25 -9.658 19.878 -33.303 183 HA LEU 25 HA LEU 25 -10.781 21.844 -31.352 184 HB2 LEU 25 2HB LEU 25 -8.173 22.013 -32.902 185 HB3 LEU 25 3HB LEU 25 -8.885 23.352 -32.008 186 HG LEU 25 HG LEU 25 -7.961 20.724 -30.757 187 HD11 LEU 25 1HD1 LEU 25 -6.118 22.068 -29.846 188 HD12 LEU 25 2HD1 LEU 25 -6.100 22.100 -31.616 189 HD13 LEU 25 3HD1 LEU 25 -6.712 23.503 -30.713 190 HD21 LEU 25 3HD2 LEU 25 -8.931 23.326 -29.485 191 HD22 LEU 25 1HD2 LEU 25 -9.743 21.743 -29.404 192 HD23 LEU 25 2HD2 LEU 25 -8.186 21.970 -28.609 193 H ALA 26 H ALA 26 -11.697 23.685 -32.150 194 HA ALA 26 HA ALA 26 -12.067 24.033 -35.063 195 HB1 ALA 26 3HB ALA 26 -14.342 23.714 -33.049 196 HB2 ALA 26 1HB ALA 26 -14.532 24.115 -34.768 197 HB3 ALA 26 2HB ALA 26 -13.884 22.534 -34.298 198 HA PRO 27 HA PRO 27 -11.901 28.381 -34.240 199 HB2 PRO 27 2HB PRO 27 -14.485 28.689 -35.779 200 HB3 PRO 27 3HB PRO 27 -12.964 29.627 -35.920 201 HG2 PRO 27 2HG PRO 27 -13.511 27.682 -37.711 202 HG3 PRO 27 3HG PRO 27 -11.862 27.781 -37.003 203 HD2 PRO 27 2HD PRO 27 -14.166 26.002 -36.145 204 HD3 PRO 27 3HD PRO 27 -12.456 25.556 -36.473 205 H ARG 28 H ARG 28 -12.242 29.231 -32.409 206 HA ARG 28 HA ARG 28 -14.906 29.363 -31.095 207 HB2 ARG 28 2HB ARG 28 -14.050 28.384 -29.054 208 HB3 ARG 28 3HB ARG 28 -13.819 27.290 -30.416 209 HG2 ARG 28 2HG ARG 28 -11.421 27.954 -30.553 210 HG3 ARG 28 3HG ARG 28 -11.657 29.035 -29.167 211 HD2 ARG 28 2HD ARG 28 -12.312 27.100 -27.770 212 HD3 ARG 28 3HD ARG 28 -12.106 26.021 -29.168 213 HE ARG 28 HE ARG 28 -9.682 27.465 -28.775 214 HH11 ARG 28 1HH2 ARG 28 -11.465 24.904 -27.182 215 HH12 ARG 28 2HH2 ARG 28 -10.028 24.225 -26.468 216 HH21 ARG 28 1HH1 ARG 28 -7.892 26.550 -27.829 217 HH22 ARG 28 2HH1 ARG 28 -8.062 25.138 -26.830 218 H GLN 29 H GLN 29 -14.895 30.488 -29.041 219 HA GLN 29 HA GLN 29 -13.362 33.056 -29.028 220 HB2 GLN 29 2HB GLN 29 -16.363 32.737 -28.644 221 HB3 GLN 29 3HB GLN 29 -15.452 34.243 -28.618 222 HG2 GLN 29 2HG GLN 29 -15.664 34.501 -30.851 223 HG3 GLN 29 3HG GLN 29 -15.051 32.877 -31.173 224 HE21 GLN 29 1HE2 GLN 29 -16.783 31.165 -30.122 225 HE22 GLN 29 2HE2 GLN 29 -18.372 31.353 -30.866 226 H ILE 30 H ILE 30 -12.222 32.570 -27.161 227 HA ILE 30 HA ILE 30 -13.519 31.708 -24.700 228 HB ILE 30 HB ILE 30 -10.738 32.801 -25.247 229 HG12 ILE 30 2HG1 ILE 30 -9.966 30.554 -24.837 230 HG13 ILE 30 3HG1 ILE 30 -11.597 29.994 -24.468 231 HG21 ILE 30 1HG2 ILE 30 -11.995 31.656 -22.707 232 HG22 ILE 30 2HG2 ILE 30 -10.250 31.927 -22.921 233 HG23 ILE 30 3HG2 ILE 30 -11.349 33.301 -22.907 234 HD11 ILE 30 3HD1 ILE 30 -10.719 30.893 -27.229 235 HD12 ILE 30 1HD1 ILE 30 -10.649 29.219 -26.645 236 HD13 ILE 30 2HD1 ILE 30 -12.215 30.016 -26.780 237 H ALA 31 H ALA 31 -14.968 32.969 -23.866 238 HA ALA 31 HA ALA 31 -14.377 35.856 -23.352 239 HB1 ALA 31 3HB ALA 31 -16.932 34.223 -23.109 240 HB2 ALA 31 1HB ALA 31 -16.756 35.906 -22.559 241 HB3 ALA 31 2HB ALA 31 -16.565 35.516 -24.277 242 H ARG 32 H ARG 32 -14.550 36.614 -21.187 243 HA ARG 32 HA ARG 32 -14.171 34.554 -19.043 244 HB2 ARG 32 2HB ARG 32 -12.687 37.071 -19.552 245 HB3 ARG 32 3HB ARG 32 -13.337 36.949 -17.916 246 HG2 ARG 32 2HG ARG 32 -12.336 34.764 -17.593 247 HG3 ARG 32 3HG ARG 32 -11.672 34.795 -19.240 248 HD2 ARG 32 2HD ARG 32 -10.146 36.528 -18.686 249 HD3 ARG 32 3HD ARG 32 -11.004 36.917 -17.180 250 HE ARG 32 HE ARG 32 -9.656 34.269 -17.586 251 HH11 ARG 32 2HH2 ARG 32 -10.051 37.067 -15.406 252 HH12 ARG 32 1HH2 ARG 32 -8.901 36.373 -14.304 253 HH21 ARG 32 2HH1 ARG 32 -8.616 33.377 -15.945 254 HH22 ARG 32 1HH1 ARG 32 -8.150 34.337 -14.557 255 H TYR 33 H TYR 33 -15.244 34.798 -17.123 256 HA TYR 33 HA TYR 33 -17.324 36.906 -16.949 257 HB2 TYR 33 2HB TYR 33 -17.901 33.971 -16.553 258 HB3 TYR 33 3HB TYR 33 -18.966 35.284 -16.142 259 HD1 TYR 33 HD2 TYR 33 -17.271 33.615 -19.023 260 HD2 TYR 33 HD1 TYR 33 -20.422 36.226 -17.708 261 HE1 TYR 33 HE2 TYR 33 -18.349 33.464 -21.264 262 HE2 TYR 33 HE1 TYR 33 -21.485 36.086 -19.961 263 HH TYR 33 HH TYR 33 -21.453 35.134 -21.958 264 H ARG 34 H ARG 34 -17.583 37.735 -14.973 265 HA ARG 34 HA ARG 34 -15.975 36.653 -12.712 266 HB2 ARG 34 2HB ARG 34 -15.454 38.933 -13.466 267 HB3 ARG 34 3HB ARG 34 -17.114 39.442 -13.166 268 HG2 ARG 34 2HG ARG 34 -16.848 39.302 -10.816 269 HG3 ARG 34 3HG ARG 34 -15.489 38.175 -10.948 270 HD2 ARG 34 2HD ARG 34 -14.679 40.352 -10.237 271 HD3 ARG 34 3HD ARG 34 -14.043 39.907 -11.813 272 HE ARG 34 HE ARG 34 -16.365 41.778 -11.484 273 HH11 ARG 34 2HH2 ARG 34 -13.224 41.173 -13.052 274 HH12 ARG 34 1HH2 ARG 34 -13.239 42.761 -13.761 275 HH21 ARG 34 2HH1 ARG 34 -16.293 43.708 -12.535 276 HH22 ARG 34 1HH1 ARG 34 -14.932 44.114 -13.535 277 H THR 35 H THR 35 -16.897 35.778 -11.030 278 HA THR 35 HA THR 35 -19.799 35.505 -10.802 279 HB THR 35 HB THR 35 -19.341 34.081 -8.875 280 HG1 THR 35 HG1 THR 35 -16.634 34.537 -9.378 281 HG21 THR 35 1HG2 THR 35 -18.019 32.342 -9.930 282 HG22 THR 35 2HG2 THR 35 -19.236 33.025 -11.033 283 HG23 THR 35 3HG2 THR 35 -17.524 33.453 -11.221 284 H ASP 36 H ASP 36 -20.605 35.590 -8.363 285 HA ASP 36 HA ASP 36 -20.560 38.374 -7.720 286 HB2 ASP 36 2HB ASP 36 -22.566 36.855 -7.580 287 HB3 ASP 36 3HB ASP 36 -21.823 36.048 -6.200 288 H ASN 37 H ASN 37 -18.509 35.794 -6.605 289 HA ASN 37 HA ASN 37 -17.720 37.400 -4.222 290 HB2 ASN 37 2HB ASN 37 -16.282 34.936 -5.026 291 HB3 ASN 37 3HB ASN 37 -16.461 35.663 -3.466 292 HD21 ASN 37 1HD2 ASN 37 -16.940 32.947 -4.568 293 HD22 ASN 37 2HD2 ASN 37 -18.553 32.537 -3.938 294 H GLY 38 H GLY 38 -17.161 37.794 -7.414 295 HA2 GLY 38 HA2 GLY 38 -15.537 39.032 -8.542 296 HA3 GLY 38 HA3 GLY 38 -14.432 38.912 -7.173 297 H GLU 39 H GLU 39 -15.631 35.820 -7.860 298 HA GLU 39 HA GLU 39 -12.963 34.983 -8.695 299 HB2 GLU 39 2HB GLU 39 -15.354 33.151 -8.812 300 HB3 GLU 39 3HB GLU 39 -13.685 32.786 -8.478 301 HG2 GLU 39 2HG GLU 39 -14.239 34.398 -6.341 302 HG3 GLU 39 3HG GLU 39 -15.880 33.868 -6.764 303 H GLU 40 H GLU 40 -12.266 35.158 -10.751 304 HA GLU 40 HA GLU 40 -14.221 35.228 -12.988 305 HB2 GLU 40 2HB GLU 40 -11.349 36.124 -12.701 306 HB3 GLU 40 3HB GLU 40 -12.081 35.842 -14.292 307 HG2 GLU 40 2HG GLU 40 -13.897 37.385 -13.784 308 HG3 GLU 40 3HG GLU 40 -13.210 37.716 -12.193 309 H PHE 41 H PHE 41 -14.490 33.768 -14.440 310 HA PHE 41 HA PHE 41 -12.508 31.559 -14.852 311 HB2 PHE 41 2HB PHE 41 -15.529 31.369 -14.709 312 HB3 PHE 41 3HB PHE 41 -14.472 30.077 -15.191 313 HD1 PHE 41 HD2 PHE 41 -15.592 32.120 -12.240 314 HD2 PHE 41 HD1 PHE 41 -13.100 28.854 -13.595 315 HE1 PHE 41 HE2 PHE 41 -15.253 31.394 -9.941 316 HE2 PHE 41 HE1 PHE 41 -12.715 28.177 -11.245 317 HZ PHE 41 HZ PHE 41 -13.781 29.457 -9.399 318 H GLU 42 H GLU 42 -12.745 30.454 -16.913 319 HA GLU 42 HA GLU 42 -13.417 32.359 -19.095 320 HB2 GLU 42 2HB GLU 42 -11.464 30.051 -19.353 321 HB3 GLU 42 3HB GLU 42 -11.716 31.443 -20.385 322 HG2 GLU 42 2HG GLU 42 -9.813 32.134 -19.364 323 HG3 GLU 42 3HG GLU 42 -11.018 32.835 -18.284 324 H VAL 43 H VAL 43 -14.828 31.806 -20.608 325 HA VAL 43 HA VAL 43 -15.807 28.975 -20.755 326 HB VAL 43 HB VAL 43 -17.466 31.431 -21.283 327 HG11 VAL 43 1HG1 VAL 43 -18.229 28.498 -21.012 328 HG12 VAL 43 2HG1 VAL 43 -19.314 29.869 -21.348 329 HG13 VAL 43 3HG1 VAL 43 -18.124 29.386 -22.548 330 HG21 VAL 43 3HG2 VAL 43 -16.894 31.201 -18.837 331 HG22 VAL 43 1HG2 VAL 43 -18.591 31.036 -19.225 332 HG23 VAL 43 2HG2 VAL 43 -17.618 29.580 -18.879 333 HA PRO 44 HA PRO 44 -14.405 29.732 -25.032 334 HB2 PRO 44 2HB PRO 44 -13.948 27.135 -25.743 335 HB3 PRO 44 3HB PRO 44 -12.806 28.096 -24.766 336 HG2 PRO 44 2HG PRO 44 -14.808 26.053 -23.811 337 HG3 PRO 44 3HG PRO 44 -13.116 26.292 -23.282 338 HD2 PRO 44 2HD PRO 44 -15.333 27.259 -21.937 339 HD3 PRO 44 3HD PRO 44 -13.731 28.050 -21.841 340 H PHE 45 H PHE 45 -16.027 30.285 -26.334 341 HA PHE 45 HA PHE 45 -18.406 28.535 -26.790 342 HB2 PHE 45 2HB PHE 45 -17.773 31.442 -27.343 343 HB3 PHE 45 3HB PHE 45 -19.129 30.659 -28.091 344 HD1 PHE 45 HD2 PHE 45 -17.658 31.753 -24.859 345 HD2 PHE 45 HD1 PHE 45 -21.147 30.117 -26.799 346 HE1 PHE 45 HE2 PHE 45 -19.019 32.225 -22.843 347 HE2 PHE 45 HE1 PHE 45 -22.493 30.572 -24.755 348 HZ PHE 45 HZ PHE 45 -21.410 31.625 -22.766 349 H ALA 46 H ALA 46 -18.920 27.786 -28.834 350 HA ALA 46 HA ALA 46 -16.733 27.644 -30.825 351 HB1 ALA 46 3HB ALA 46 -18.208 26.039 -31.961 352 HB2 ALA 46 1HB ALA 46 -18.001 25.601 -30.255 353 HB3 ALA 46 2HB ALA 46 -19.507 26.378 -30.797 354 H ASP 47 H ASP 47 -17.088 28.260 -33.064 355 HA ASP 47 HA ASP 47 -18.123 30.839 -33.488 356 HB2 ASP 47 2HB ASP 47 -16.373 29.749 -34.814 357 HB3 ASP 47 3HB ASP 47 -17.547 28.609 -35.475 358 H ASP 48 H ASP 48 -19.884 27.856 -33.492 359 HA ASP 48 HA ASP 48 -22.218 28.732 -35.003 360 HB2 ASP 48 2HB ASP 48 -21.482 26.361 -34.654 361 HB3 ASP 48 3HB ASP 48 -21.892 26.518 -32.949 362 H ALA 49 H ALA 49 -21.027 29.552 -31.920 363 HA ALA 49 HA ALA 49 -23.682 30.512 -30.928 364 HB1 ALA 49 3HB ALA 49 -22.856 30.075 -28.665 365 HB2 ALA 49 1HB ALA 49 -22.816 28.587 -29.629 366 HB3 ALA 49 2HB ALA 49 -21.312 29.487 -29.316 367 H GLU 50 H GLU 50 -23.593 32.397 -29.531 368 HA GLU 50 HA GLU 50 -21.201 34.156 -29.790 369 HB2 GLU 50 2HB GLU 50 -24.080 34.918 -30.396 370 HB3 GLU 50 3HB GLU 50 -22.840 36.104 -29.964 371 HG2 GLU 50 2HG GLU 50 -21.449 35.440 -31.861 372 HG3 GLU 50 3HG GLU 50 -22.597 34.178 -32.298 373 H ILE 51 H ILE 51 -20.719 35.306 -28.085 374 HA ILE 51 HA ILE 51 -21.201 34.405 -25.536 375 HB ILE 51 HB ILE 51 -20.254 37.222 -26.075 376 HG12 ILE 51 2HG1 ILE 51 -19.055 35.844 -27.688 377 HG13 ILE 51 3HG1 ILE 51 -17.987 36.432 -26.420 378 HG21 ILE 51 1HG2 ILE 51 -20.536 36.537 -23.685 379 HG22 ILE 51 2HG2 ILE 51 -19.447 35.177 -23.969 380 HG23 ILE 51 3HG2 ILE 51 -18.844 36.828 -24.104 381 HD11 ILE 51 3HD1 ILE 51 -18.048 34.158 -25.374 382 HD12 ILE 51 1HD1 ILE 51 -19.107 33.616 -26.698 383 HD13 ILE 51 2HD1 ILE 51 -17.446 34.141 -27.031 384 HA PRO 52 HA PRO 52 -24.993 36.741 -24.516 385 HB2 PRO 52 2HB PRO 52 -25.699 35.216 -22.377 386 HB3 PRO 52 3HB PRO 52 -26.010 34.707 -24.067 387 HG2 PRO 52 2HG PRO 52 -23.775 33.864 -22.215 388 HG3 PRO 52 3HG PRO 52 -24.761 32.847 -23.324 389 HD2 PRO 52 2HD PRO 52 -22.223 33.844 -23.902 390 HD3 PRO 52 3HD PRO 52 -23.401 33.431 -25.150 391 H GLY 53 H GLY 53 -25.297 38.260 -22.909 392 HA2 GLY 53 HA2 GLY 53 -23.219 39.604 -21.725 393 HA3 GLY 53 HA3 GLY 53 -24.888 39.690 -21.155 394 H THR 54 H THR 54 -24.927 36.860 -20.190 395 HA THR 54 HA THR 54 -22.720 36.742 -18.269 396 HB THR 54 HB THR 54 -24.292 36.159 -16.395 397 HG1 THR 54 HG1 THR 54 -26.534 36.544 -16.724 398 HG21 THR 54 1HG2 THR 54 -25.259 38.790 -17.577 399 HG22 THR 54 2HG2 THR 54 -25.277 38.283 -15.872 400 HG23 THR 54 3HG2 THR 54 -23.746 38.585 -16.689 401 H TRP 55 H TRP 55 -22.516 34.612 -17.184 402 HA TRP 55 HA TRP 55 -23.868 32.291 -18.349 403 HB2 TRP 55 2HB TRP 55 -22.116 32.978 -20.043 404 HB3 TRP 55 3HB TRP 55 -20.893 32.658 -18.822 405 HD1 TRP 55 HD1 TRP 55 -20.332 30.145 -18.309 406 HE1 TRP 55 HE1 TRP 55 -20.668 27.989 -19.624 407 HE3 TRP 55 HE3 TRP 55 -23.970 31.743 -21.481 408 HZ2 TRP 55 HZ2 TRP 55 -22.459 27.002 -21.693 409 HZ3 TRP 55 HZ3 TRP 55 -25.019 30.169 -23.115 410 HH2 TRP 55 HH2 TRP 55 -24.262 27.804 -23.229 411 H LEU 56 H LEU 56 -23.470 30.350 -17.164 412 HA LEU 56 HA LEU 56 -22.778 30.757 -14.397 413 HB2 LEU 56 2HB LEU 56 -24.337 28.954 -15.833 414 HB3 LEU 56 3HB LEU 56 -22.958 27.972 -15.331 415 HG LEU 56 HG LEU 56 -24.645 29.652 -13.434 416 HD11 LEU 56 1HD1 LEU 56 -25.686 27.519 -12.764 417 HD12 LEU 56 2HD1 LEU 56 -25.995 27.868 -14.472 418 HD13 LEU 56 3HD1 LEU 56 -24.767 26.663 -14.023 419 HD21 LEU 56 3HD2 LEU 56 -22.406 29.133 -12.540 420 HD22 LEU 56 1HD2 LEU 56 -23.637 28.193 -11.694 421 HD23 LEU 56 2HD2 LEU 56 -22.622 27.419 -12.932 422 H CYS 57 H CYS 57 -20.895 30.540 -13.384 423 HA CYS 57 HA CYS 57 -18.496 29.687 -14.903 424 HB2 CYS 57 2HB CYS 57 -18.938 31.247 -12.334 425 HB3 CYS 57 3HB CYS 57 -17.342 30.736 -12.893 426 HG CYS 57 HG CYS 57 -19.565 32.367 -14.713 427 H ARG 58 H ARG 58 -16.795 28.512 -13.747 428 HA ARG 58 HA ARG 58 -17.756 25.965 -12.957 429 HB2 ARG 58 2HB ARG 58 -14.933 26.955 -12.426 430 HB3 ARG 58 3HB ARG 58 -15.455 25.304 -12.742 431 HG2 ARG 58 2HG ARG 58 -15.999 25.951 -15.105 432 HG3 ARG 58 3HG ARG 58 -15.426 27.593 -14.756 433 HD2 ARG 58 2HD ARG 58 -13.223 26.442 -13.995 434 HD3 ARG 58 3HD ARG 58 -13.811 25.040 -14.897 435 HE ARG 58 HE ARG 58 -14.049 26.690 -16.867 436 HH11 ARG 58 1HH2 ARG 58 -11.391 27.043 -14.556 437 HH12 ARG 58 2HH2 ARG 58 -10.570 28.159 -15.629 438 HH21 ARG 58 1HH1 ARG 58 -12.885 28.161 -18.081 439 HH22 ARG 58 2HH1 ARG 58 -11.321 28.698 -17.473 440 H ASN 59 H ASN 59 -17.085 28.708 -10.981 441 HA ASN 59 HA ASN 59 -16.797 27.439 -8.450 442 HB2 ASN 59 2HB ASN 59 -16.169 29.712 -8.871 443 HB3 ASN 59 3HB ASN 59 -17.825 30.160 -9.302 444 HD21 ASN 59 1HD2 ASN 59 -17.817 31.861 -7.766 445 HD22 ASN 59 2HD2 ASN 59 -17.777 31.529 -6.047 446 H GLY 60 H GLY 60 -19.560 27.760 -10.504 447 HA2 GLY 60 HA2 GLY 60 -21.676 26.769 -10.232 448 HA3 GLY 60 HA3 GLY 60 -21.447 26.676 -8.483 449 H MET 61 H MET 61 -20.616 29.734 -9.872 450 HA MET 61 HA MET 61 -23.213 30.944 -9.057 451 HB2 MET 61 2HB MET 61 -21.205 31.438 -7.616 452 HB3 MET 61 3HB MET 61 -20.437 32.192 -8.989 453 HG2 MET 61 2HG MET 61 -21.473 33.846 -7.499 454 HG3 MET 61 3HG MET 61 -22.150 33.901 -9.121 455 HE1 MET 61 3HE MET 61 -22.723 33.177 -5.348 456 HE2 MET 61 1HE MET 61 -24.334 32.428 -5.308 457 HE3 MET 61 2HE MET 61 -22.958 31.528 -5.978 458 H GLU 62 H GLU 62 -24.088 32.567 -10.363 459 HA GLU 62 HA GLU 62 -23.531 32.436 -13.202 460 HB2 GLU 62 2HB GLU 62 -25.784 32.816 -12.266 461 HB3 GLU 62 3HB GLU 62 -25.271 34.402 -11.672 462 HG2 GLU 62 2HG GLU 62 -24.780 35.114 -14.004 463 HG3 GLU 62 3HG GLU 62 -25.210 33.510 -14.595 464 H GLY 63 H GLY 63 -21.782 33.272 -14.085 465 HA2 GLY 63 HA2 GLY 63 -20.356 35.558 -12.934 466 HA3 GLY 63 HA3 GLY 63 -19.822 34.559 -14.257 467 H THR 64 H THR 64 -20.024 37.537 -14.042 468 HA THR 64 HA THR 64 -21.744 38.013 -16.437 469 HB THR 64 HB THR 64 -20.617 40.046 -14.469 470 HG1 THR 64 HG1 THR 64 -22.280 38.826 -13.584 471 HG21 THR 64 1HG2 THR 64 -22.308 41.586 -15.568 472 HG22 THR 64 2HG2 THR 64 -20.923 41.173 -16.582 473 HG23 THR 64 3HG2 THR 64 -22.486 40.381 -16.864 474 H LEU 65 H LEU 65 -20.971 38.858 -18.278 475 HA LEU 65 HA LEU 65 -18.425 38.040 -19.080 476 HB2 LEU 65 2HB LEU 65 -20.539 38.255 -20.371 477 HB3 LEU 65 3HB LEU 65 -20.369 39.992 -20.357 478 HG LEU 65 HG LEU 65 -18.781 37.888 -21.866 479 HD11 LEU 65 1HD1 LEU 65 -20.354 40.354 -22.744 480 HD12 LEU 65 2HD1 LEU 65 -19.627 39.140 -23.815 481 HD13 LEU 65 3HD1 LEU 65 -20.968 38.689 -22.750 482 HD21 LEU 65 3HD2 LEU 65 -17.023 39.411 -21.337 483 HD22 LEU 65 1HD2 LEU 65 -17.529 39.774 -22.975 484 HD23 LEU 65 2HD2 LEU 65 -18.059 40.836 -21.651 485 H ILE 66 H ILE 66 -16.473 38.895 -18.813 486 HA ILE 66 HA ILE 66 -16.076 41.832 -19.032 487 HB ILE 66 HB ILE 66 -14.208 41.788 -17.533 488 HG12 ILE 66 2HG1 ILE 66 -13.521 39.392 -17.750 489 HG13 ILE 66 3HG1 ILE 66 -13.531 40.022 -16.121 490 HG21 ILE 66 1HG2 ILE 66 -16.764 40.798 -16.214 491 HG22 ILE 66 2HG2 ILE 66 -15.420 41.599 -15.392 492 HG23 ILE 66 3HG2 ILE 66 -16.343 42.467 -16.635 493 HD11 ILE 66 3HD1 ILE 66 -15.645 38.232 -17.222 494 HD12 ILE 66 1HD1 ILE 66 -14.367 37.788 -16.085 495 HD13 ILE 66 2HD1 ILE 66 -15.636 38.932 -15.615 496 H GLU 67 H GLU 67 -14.083 42.489 -19.965 497 HA GLU 67 HA GLU 67 -13.340 40.846 -22.236 498 HB2 GLU 67 2HB GLU 67 -11.814 42.808 -22.724 499 HB3 GLU 67 3HB GLU 67 -13.549 43.092 -22.717 500 HG2 GLU 67 2HG GLU 67 -13.454 44.178 -20.539 501 HG3 GLU 67 3HG GLU 67 -11.752 43.775 -20.351 502 H GLY 68 H GLY 68 -12.316 38.997 -21.582 503 HA2 GLY 68 HA2 GLY 68 -9.902 38.981 -19.942 504 HA3 GLY 68 HA3 GLY 68 -10.583 37.639 -20.867 505 H ASP 69 H ASP 69 -10.561 39.172 -23.414 506 HA ASP 69 HA ASP 69 -7.875 39.954 -24.081 507 HB2 ASP 69 2HB ASP 69 -7.608 37.475 -24.119 508 HB3 ASP 69 3HB ASP 69 -8.997 37.339 -25.198 509 H LEU 70 H LEU 70 -7.914 41.112 -25.977 510 HA LEU 70 HA LEU 70 -10.509 41.422 -27.446 511 HB2 LEU 70 2HB LEU 70 -8.353 43.483 -26.974 512 HB3 LEU 70 3HB LEU 70 -9.749 43.671 -28.027 513 HG LEU 70 HG LEU 70 -10.168 44.946 -26.156 514 HD11 LEU 70 1HD1 LEU 70 -11.793 42.410 -25.780 515 HD12 LEU 70 2HD1 LEU 70 -12.242 44.061 -25.296 516 HD13 LEU 70 3HD1 LEU 70 -12.080 43.660 -27.018 517 HD21 LEU 70 3HD2 LEU 70 -8.562 43.869 -24.610 518 HD22 LEU 70 1HD2 LEU 70 -10.121 44.283 -23.877 519 HD23 LEU 70 2HD2 LEU 70 -9.768 42.595 -24.289 520 HA PRO 71 HA PRO 71 -7.858 40.486 -31.053 521 HB2 PRO 71 2HB PRO 71 -9.795 40.368 -32.959 522 HB3 PRO 71 3HB PRO 71 -9.506 39.039 -31.796 523 HG2 PRO 71 2HG PRO 71 -11.620 41.206 -31.664 524 HG3 PRO 71 3HG PRO 71 -11.811 39.449 -31.388 525 HD2 PRO 71 2HD PRO 71 -11.493 41.277 -29.353 526 HD3 PRO 71 3HD PRO 71 -10.909 39.591 -29.232 527 H GLU 72 H GLU 72 -10.425 42.949 -30.810 528 HA GLU 72 HA GLU 72 -8.725 44.994 -32.146 529 HB2 GLU 72 2HB GLU 72 -11.649 44.434 -32.812 530 HB3 GLU 72 3HB GLU 72 -10.655 45.760 -33.433 531 HG2 GLU 72 2HG GLU 72 -9.095 43.969 -34.371 532 HG3 GLU 72 3HG GLU 72 -10.342 42.786 -33.983 533 HA PRO 73 HA PRO 73 -10.290 46.777 -28.096 534 HB2 PRO 73 2HB PRO 73 -7.717 48.203 -28.838 535 HB3 PRO 73 3HB PRO 73 -8.383 47.875 -27.207 536 HG2 PRO 73 2HG PRO 73 -6.453 46.296 -28.263 537 HG3 PRO 73 3HG PRO 73 -7.814 45.591 -27.348 538 HD2 PRO 73 2HD PRO 73 -7.358 45.633 -30.316 539 HD3 PRO 73 3HD PRO 73 -8.144 44.390 -29.324 540 H LYS 74 H LYS 74 -11.468 48.577 -27.936 541 HA LYS 74 HA LYS 74 -11.459 50.632 -30.112 542 HB2 LYS 74 2HB LYS 74 -13.395 48.947 -30.017 543 HB3 LYS 74 3HB LYS 74 -13.914 49.791 -28.556 544 HG2 LYS 74 2HG LYS 74 -14.065 51.916 -29.917 545 HG3 LYS 74 3HG LYS 74 -13.576 51.006 -31.349 546 HD2 LYS 74 2HD LYS 74 -15.576 49.628 -31.218 547 HD3 LYS 74 3HD LYS 74 -16.034 50.327 -29.662 548 HE2 LYS 74 2HE LYS 74 -15.826 51.894 -32.274 549 HE3 LYS 74 3HE LYS 74 -17.321 51.206 -31.627 550 HZ1 LYS 74 HZ1 LYS 74 -16.926 52.593 -29.598 551 HZ2 LYS 74 HZ2 LYS 74 -15.690 53.352 -30.371 552 HZ3 LYS 74 HZ3 LYS 74 -17.217 53.475 -30.935 553 H LYS 75 H LYS 75 -9.980 50.640 -27.526 554 HA LYS 75 HA LYS 75 -11.227 52.300 -25.573 555 HB2 LYS 75 2HB LYS 75 -8.254 52.073 -26.171 556 HB3 LYS 75 3HB LYS 75 -8.967 52.657 -24.672 557 HG2 LYS 75 2HG LYS 75 -9.282 49.808 -25.755 558 HG3 LYS 75 3HG LYS 75 -8.072 50.323 -24.586 559 HD2 LYS 75 2HD LYS 75 -9.831 50.971 -22.977 560 HD3 LYS 75 3HD LYS 75 -11.081 50.477 -24.142 561 HE2 LYS 75 2HE LYS 75 -10.123 48.170 -24.165 562 HE3 LYS 75 3HE LYS 75 -8.936 48.662 -22.952 563 HZ1 LYS 75 HZ1 LYS 75 -10.869 47.553 -21.972 564 HZ2 LYS 75 HZ2 LYS 75 -10.770 49.095 -21.419 565 HZ3 LYS 75 HZ3 LYS 75 -11.881 48.684 -22.555 566 H VAL 76 H VAL 76 -11.950 54.251 -25.770 567 HA VAL 76 HA VAL 76 -12.584 56.177 -26.675 568 HB VAL 76 HB VAL 76 -11.078 58.023 -26.530 569 HG11 VAL 76 1HG1 VAL 76 -10.636 56.071 -24.246 570 HG12 VAL 76 2HG1 VAL 76 -10.520 57.840 -24.182 571 HG13 VAL 76 3HG1 VAL 76 -12.085 57.073 -24.494 572 HG21 VAL 76 3HG2 VAL 76 -8.979 56.991 -27.452 573 HG22 VAL 76 1HG2 VAL 76 -8.746 57.859 -25.927 574 HG23 VAL 76 2HG2 VAL 76 -8.804 56.089 -25.932 575 H LYS 77 H LYS 77 -12.223 54.243 -28.719 576 HA LYS 77 HA LYS 77 -11.417 55.887 -31.078 577 HB2 LYS 77 2HB LYS 77 -11.700 52.909 -30.648 578 HB3 LYS 77 3HB LYS 77 -11.634 53.604 -32.267 579 HG2 LYS 77 2HG LYS 77 -9.444 54.485 -31.953 580 HG3 LYS 77 3HG LYS 77 -9.492 54.233 -30.211 581 HD2 LYS 77 2HD LYS 77 -8.048 52.582 -31.256 582 HD3 LYS 77 3HD LYS 77 -9.438 51.803 -30.499 583 HE2 LYS 77 2HE LYS 77 -10.547 51.664 -32.750 584 HE3 LYS 77 3HE LYS 77 -9.115 52.406 -33.479 585 HZ1 LYS 77 HZ1 LYS 77 -7.819 50.488 -32.699 586 HZ2 LYS 77 HZ2 LYS 77 -9.149 49.813 -32.016 587 HZ3 LYS 77 HZ3 LYS 77 -9.052 49.979 -33.641 588 HA PRO 78 HA PRO 78 -15.647 56.452 -32.232 589 HB2 PRO 78 2HB PRO 78 -15.444 57.058 -34.893 590 HB3 PRO 78 3HB PRO 78 -14.812 58.127 -33.605 591 HG2 PRO 78 2HG PRO 78 -13.277 56.044 -35.204 592 HG3 PRO 78 3HG PRO 78 -12.857 57.772 -34.957 593 HD2 PRO 78 2HD PRO 78 -11.789 55.820 -33.408 594 HD3 PRO 78 3HD PRO 78 -12.256 57.397 -32.702 595 HA PRO 79 HA PRO 79 -17.432 52.744 -33.900 596 HB2 PRO 79 2HB PRO 79 -19.171 54.398 -35.720 597 HB3 PRO 79 3HB PRO 79 -19.644 53.119 -34.560 598 HG2 PRO 79 2HG PRO 79 -20.016 55.722 -33.931 599 HG3 PRO 79 3HG PRO 79 -19.344 54.601 -32.700 600 HD2 PRO 79 2HD PRO 79 -17.843 56.520 -34.510 601 HD3 PRO 79 3HD PRO 79 -17.688 56.281 -32.745 602 H ARG 80 H ARG 80 -16.294 55.042 -36.309 603 HA ARG 80 HA ARG 80 -15.339 52.890 -38.090 604 HB2 ARG 80 2HB ARG 80 -17.629 53.493 -38.887 605 HB3 ARG 80 3HB ARG 80 -17.106 55.170 -39.089 606 HG2 ARG 80 2HG ARG 80 -15.424 54.456 -40.764 607 HG3 ARG 80 3HG ARG 80 -15.893 52.765 -40.542 608 HD2 ARG 80 2HD ARG 80 -17.732 54.989 -41.522 609 HD3 ARG 80 3HD ARG 80 -16.876 53.848 -42.572 610 HE ARG 80 HE ARG 80 -18.298 52.246 -40.792 611 HH11 ARG 80 2HH1 ARG 80 -19.195 54.612 -43.213 612 HH12 ARG 80 1HH1 ARG 80 -20.750 53.873 -43.488 613 HH21 ARG 80 1HH2 ARG 80 -20.292 51.363 -41.186 614 HH22 ARG 80 2HH2 ARG 80 -21.345 52.081 -42.371 Start of MODEL 32 1 H1 SER 1 1H SER 1 -8.046 2.659 -25.767 2 H2 SER 1 2H SER 1 -8.930 1.500 -26.518 3 H3 SER 1 3H SER 1 -9.513 2.236 -25.171 4 HA SER 1 HA SER 1 -10.617 3.051 -27.140 5 HB2 SER 1 2HB SER 1 -8.865 5.140 -25.784 6 HB3 SER 1 3HB SER 1 -10.383 5.431 -26.658 7 HG SER 1 HG SER 1 -10.715 5.264 -24.392 8 H MET 2 H MET 2 -10.518 4.184 -29.142 9 HA MET 2 HA MET 2 -8.205 3.592 -30.759 10 HB2 MET 2 2HB MET 2 -10.500 3.529 -31.605 11 HB3 MET 2 3HB MET 2 -10.690 5.263 -31.311 12 HG2 MET 2 2HG MET 2 -8.950 5.758 -32.982 13 HG3 MET 2 3HG MET 2 -8.647 4.032 -33.194 14 HE1 MET 2 3HE MET 2 -12.344 6.368 -34.727 15 HE2 MET 2 1HE MET 2 -12.148 6.066 -32.990 16 HE3 MET 2 2HE MET 2 -10.957 7.059 -33.859 17 H ALA 3 H ALA 3 -9.569 6.688 -29.619 18 HA ALA 3 HA ALA 3 -7.017 7.846 -29.075 19 HB1 ALA 3 3HB ALA 3 -7.242 9.805 -30.602 20 HB2 ALA 3 1HB ALA 3 -7.040 8.300 -31.508 21 HB3 ALA 3 2HB ALA 3 -8.648 9.039 -31.367 22 H ASP 4 H ASP 4 -9.166 10.199 -27.204 23 HA ASP 4 HA ASP 4 -6.758 10.772 -28.558 24 HB2 ASP 4 2HB ASP 4 -7.811 12.332 -27.094 25 HB3 ASP 4 3HB ASP 4 -7.819 11.190 -25.753 26 H ARG 5 H ARG 5 -4.586 10.595 -27.744 27 HA ARG 5 HA ARG 5 -3.884 8.103 -26.249 28 HB2 ARG 5 2HB ARG 5 -2.480 8.982 -28.792 29 HB3 ARG 5 3HB ARG 5 -2.069 7.614 -27.749 30 HG2 ARG 5 2HG ARG 5 -4.308 6.595 -28.270 31 HG3 ARG 5 3HG ARG 5 -4.616 7.933 -29.398 32 HD2 ARG 5 2HD ARG 5 -2.580 7.296 -30.683 33 HD3 ARG 5 3HD ARG 5 -2.348 5.917 -29.584 34 HE ARG 5 HE ARG 5 -5.021 5.933 -30.688 35 HH11 ARG 5 2HH2 ARG 5 -1.768 5.025 -31.647 36 HH12 ARG 5 1HH2 ARG 5 -2.359 3.862 -32.803 37 HH21 ARG 5 2HH1 ARG 5 -5.681 4.524 -32.100 38 HH22 ARG 5 1HH1 ARG 5 -4.567 3.565 -33.058 39 H VAL 6 H VAL 6 -3.841 9.646 -24.597 40 HA VAL 6 HA VAL 6 -2.919 11.022 -23.066 41 HB VAL 6 HB VAL 6 -0.196 10.173 -24.082 42 HG11 VAL 6 1HG1 VAL 6 -0.198 11.924 -22.298 43 HG12 VAL 6 2HG1 VAL 6 -1.250 10.899 -21.301 44 HG13 VAL 6 3HG1 VAL 6 0.405 10.384 -21.689 45 HG21 VAL 6 3HG2 VAL 6 -1.523 8.128 -23.799 46 HG22 VAL 6 1HG2 VAL 6 -0.392 8.291 -22.458 47 HG23 VAL 6 2HG2 VAL 6 -2.106 8.694 -22.216 48 H LEU 7 H LEU 7 -3.947 12.627 -24.484 49 HA LEU 7 HA LEU 7 -4.127 14.747 -25.133 50 HB2 LEU 7 2HB LEU 7 -1.586 15.181 -23.537 51 HB3 LEU 7 3HB LEU 7 -2.744 16.421 -24.007 52 HG LEU 7 HG LEU 7 -3.304 14.099 -22.105 53 HD11 LEU 7 1HD1 LEU 7 -2.986 17.085 -21.595 54 HD12 LEU 7 2HD1 LEU 7 -3.389 15.844 -20.386 55 HD13 LEU 7 3HD1 LEU 7 -1.805 15.823 -21.178 56 HD21 LEU 7 3HD2 LEU 7 -5.412 15.320 -21.600 57 HD22 LEU 7 1HD2 LEU 7 -5.066 16.453 -22.927 58 HD23 LEU 7 2HD2 LEU 7 -5.375 14.732 -23.262 59 H ARG 8 H ARG 8 -3.606 13.629 -27.275 60 HA ARG 8 HA ARG 8 -1.268 14.546 -28.765 61 HB2 ARG 8 2HB ARG 8 -4.015 13.601 -29.676 62 HB3 ARG 8 3HB ARG 8 -2.696 14.040 -30.768 63 HG2 ARG 8 2HG ARG 8 -1.260 12.271 -29.740 64 HG3 ARG 8 3HG ARG 8 -2.611 11.804 -28.697 65 HD2 ARG 8 2HD ARG 8 -2.488 10.289 -30.616 66 HD3 ARG 8 3HD ARG 8 -3.972 11.235 -30.671 67 HE ARG 8 HE ARG 8 -3.199 12.413 -32.553 68 HH11 ARG 8 1HH1 ARG 8 -0.503 10.404 -31.469 69 HH12 ARG 8 2HH1 ARG 8 0.335 10.670 -32.985 70 HH21 ARG 8 1HH2 ARG 8 -2.046 12.599 -34.431 71 HH22 ARG 8 2HH2 ARG 8 -0.461 11.863 -34.514 72 H GLY 9 H GLY 9 -1.915 17.746 -29.764 73 HA2 GLY 9 HA2 GLY 9 0.108 16.210 -28.508 74 HA3 GLY 9 HA3 GLY 9 0.062 15.820 -30.236 75 H SER 10 H SER 10 2.169 17.143 -28.675 76 HA SER 10 HA SER 10 2.175 19.973 -29.433 77 HB2 SER 10 2HB SER 10 4.343 19.981 -28.231 78 HB3 SER 10 3HB SER 10 3.007 19.332 -27.265 79 HG SER 10 HG SER 10 4.902 18.026 -27.126 80 H ARG 11 H ARG 11 3.229 17.095 -30.959 81 HA ARG 11 HA ARG 11 5.528 18.018 -32.399 82 HB2 ARG 11 2HB ARG 11 4.947 15.643 -32.056 83 HB3 ARG 11 3HB ARG 11 3.490 15.842 -33.009 84 HG2 ARG 11 2HG ARG 11 5.042 14.709 -34.358 85 HG3 ARG 11 3HG ARG 11 4.940 16.322 -35.039 86 HD2 ARG 11 2HD ARG 11 7.120 15.525 -33.069 87 HD3 ARG 11 3HD ARG 11 7.249 15.148 -34.782 88 HE ARG 11 HE ARG 11 7.030 17.610 -35.256 89 HH11 ARG 11 1HH2 ARG 11 8.554 16.575 -32.260 90 HH12 ARG 11 2HH2 ARG 11 9.507 18.030 -32.170 91 HH21 ARG 11 1HH1 ARG 11 8.207 19.378 -35.068 92 HH22 ARG 11 2HH1 ARG 11 9.327 19.589 -33.736 93 H LEU 12 H LEU 12 5.751 19.233 -34.119 94 HA LEU 12 HA LEU 12 3.602 19.578 -36.141 95 HB2 LEU 12 2HB LEU 12 5.244 21.798 -34.847 96 HB3 LEU 12 3HB LEU 12 4.338 22.007 -36.339 97 HG LEU 12 HG LEU 12 3.085 21.305 -33.648 98 HD11 LEU 12 1HD1 LEU 12 4.040 23.574 -33.694 99 HD12 LEU 12 2HD1 LEU 12 3.153 23.927 -35.194 100 HD13 LEU 12 3HD1 LEU 12 2.270 23.620 -33.682 101 HD21 LEU 12 3HD2 LEU 12 1.832 22.076 -36.328 102 HD22 LEU 12 1HD2 LEU 12 1.691 20.498 -35.517 103 HD23 LEU 12 2HD2 LEU 12 0.959 21.924 -34.787 104 H GLY 13 H GLY 13 4.448 20.262 -38.239 105 HA2 GLY 13 HA2 GLY 13 5.935 20.309 -39.985 106 HA3 GLY 13 HA3 GLY 13 7.248 20.411 -38.815 107 H ALA 14 H ALA 14 5.717 17.599 -38.013 108 HA ALA 14 HA ALA 14 6.783 15.815 -40.083 109 HB1 ALA 14 3HB ALA 14 7.796 15.749 -37.199 110 HB2 ALA 14 1HB ALA 14 8.151 14.539 -38.450 111 HB3 ALA 14 2HB ALA 14 8.753 16.197 -38.629 112 H VAL 15 H VAL 15 5.906 13.678 -39.921 113 HA VAL 15 HA VAL 15 3.240 13.592 -38.890 114 HB VAL 15 HB VAL 15 3.238 11.200 -39.576 115 HG11 VAL 15 1HG1 VAL 15 3.353 11.672 -41.969 116 HG12 VAL 15 2HG1 VAL 15 2.592 13.019 -41.109 117 HG13 VAL 15 3HG1 VAL 15 4.273 13.159 -41.666 118 HG21 VAL 15 3HG2 VAL 15 5.637 10.646 -39.233 119 HG22 VAL 15 1HG2 VAL 15 5.083 10.282 -40.871 120 HG23 VAL 15 2HG2 VAL 15 6.072 11.723 -40.580 121 H SER 16 H SER 16 3.366 11.814 -35.795 122 HA SER 16 HA SER 16 1.671 12.286 -38.171 123 HB2 SER 16 2HB SER 16 -0.110 11.366 -36.715 124 HB3 SER 16 3HB SER 16 1.247 10.274 -36.998 125 HG SER 16 HG SER 16 1.863 10.424 -34.960 126 H TYR 17 H TYR 17 2.951 14.374 -36.040 127 HA TYR 17 HA TYR 17 2.399 16.248 -34.949 128 HB2 TYR 17 2HB TYR 17 1.512 18.024 -36.357 129 HB3 TYR 17 3HB TYR 17 2.759 17.077 -37.090 130 HD1 TYR 17 HD1 TYR 17 2.351 15.670 -39.042 131 HD2 TYR 17 HD2 TYR 17 -0.775 18.078 -37.302 132 HE1 TYR 17 HE1 TYR 17 0.994 15.413 -41.120 133 HE2 TYR 17 HE2 TYR 17 -2.108 17.853 -39.383 134 HH TYR 17 HH TYR 17 -2.225 16.956 -41.485 135 H GLU 18 H GLU 18 0.122 17.994 -35.090 136 HA GLU 18 HA GLU 18 -1.198 17.044 -32.763 137 HB2 GLU 18 2HB GLU 18 -2.346 19.191 -32.795 138 HB3 GLU 18 3HB GLU 18 -0.624 19.370 -33.109 139 HG2 GLU 18 2HG GLU 18 -0.966 19.816 -35.434 140 HG3 GLU 18 3HG GLU 18 -2.633 19.246 -35.386 141 H THR 19 H THR 19 -1.882 15.416 -35.255 142 HA THR 19 HA THR 19 -4.719 15.811 -35.795 143 HB THR 19 HB THR 19 -4.570 13.616 -36.929 144 HG1 THR 19 HG1 THR 19 -1.826 13.548 -36.680 145 HG21 THR 19 1HG2 THR 19 -3.026 14.235 -38.709 146 HG22 THR 19 2HG2 THR 19 -3.937 15.660 -38.175 147 HG23 THR 19 3HG2 THR 19 -2.251 15.440 -37.660 148 H ASP 20 H ASP 20 -6.426 14.294 -35.324 149 HA ASP 20 HA ASP 20 -5.930 12.263 -33.244 150 HB2 ASP 20 2HB ASP 20 -6.774 14.405 -32.138 151 HB3 ASP 20 3HB ASP 20 -8.293 14.160 -33.003 152 H ARG 21 H ARG 21 -7.277 10.455 -33.412 153 HA ARG 21 HA ARG 21 -8.525 10.105 -36.071 154 HB2 ARG 21 2HB ARG 21 -6.758 8.580 -35.072 155 HB3 ARG 21 3HB ARG 21 -7.985 8.003 -33.939 156 HG2 ARG 21 2HG ARG 21 -9.368 7.195 -35.814 157 HG3 ARG 21 3HG ARG 21 -8.237 7.877 -36.987 158 HD2 ARG 21 2HD ARG 21 -7.541 5.703 -34.967 159 HD3 ARG 21 3HD ARG 21 -8.057 5.404 -36.635 160 HE ARG 21 HE ARG 21 -5.829 7.212 -36.629 161 HH11 ARG 21 1HH1 ARG 21 -6.496 3.798 -36.210 162 HH12 ARG 21 2HH1 ARG 21 -4.895 3.330 -36.715 163 HH21 ARG 21 2HH2 ARG 21 -3.800 6.548 -37.242 164 HH22 ARG 21 1HH2 ARG 21 -3.410 4.854 -37.272 165 H ASN 22 H ASN 22 -9.639 10.603 -32.838 166 HA ASN 22 HA ASN 22 -12.365 9.519 -33.498 167 HB2 ASN 22 2HB ASN 22 -11.121 8.370 -31.657 168 HB3 ASN 22 3HB ASN 22 -11.020 9.903 -30.789 169 HD21 ASN 22 2HD2 ASN 22 -12.986 10.779 -29.822 170 HD22 ASN 22 1HD2 ASN 22 -14.405 9.749 -29.668 171 H HIS 23 H HIS 23 -10.599 12.241 -32.021 172 HA HIS 23 HA HIS 23 -13.079 13.769 -31.552 173 HB2 HIS 23 2HB HIS 23 -10.177 14.417 -30.939 174 HB3 HIS 23 3HB HIS 23 -11.580 15.324 -30.388 175 HD2 HIS 23 HD2 HIS 23 -9.521 14.144 -28.318 176 HE1 HIS 23 HE1 HIS 23 -12.600 11.382 -27.282 177 HE2 HIS 23 HE2 HIS 23 -10.450 12.489 -26.490 178 H ASP 24 H ASP 24 -13.220 16.043 -32.126 179 HA ASP 24 HA ASP 24 -11.805 16.892 -34.610 180 HB2 ASP 24 2HB ASP 24 -14.806 16.942 -34.114 181 HB3 ASP 24 3HB ASP 24 -14.009 17.922 -35.336 182 H LEU 25 H LEU 25 -11.788 19.163 -34.957 183 HA LEU 25 HA LEU 25 -12.327 20.899 -32.596 184 HB2 LEU 25 2HB LEU 25 -9.810 20.843 -34.305 185 HB3 LEU 25 3HB LEU 25 -10.195 22.112 -33.148 186 HG LEU 25 HG LEU 25 -9.764 19.179 -32.408 187 HD11 LEU 25 1HD1 LEU 25 -7.619 19.950 -31.495 188 HD12 LEU 25 2HD1 LEU 25 -7.708 20.257 -33.237 189 HD13 LEU 25 3HD1 LEU 25 -7.937 21.596 -32.089 190 HD21 LEU 25 3HD2 LEU 25 -10.035 21.680 -30.672 191 HD22 LEU 25 1HD2 LEU 25 -11.194 20.333 -30.760 192 HD23 LEU 25 2HD2 LEU 25 -9.585 20.060 -30.092 193 H ALA 26 H ALA 26 -12.834 23.009 -33.024 194 HA ALA 26 HA ALA 26 -13.178 23.947 -35.802 195 HB1 ALA 26 3HB ALA 26 -15.299 22.807 -35.215 196 HB2 ALA 26 1HB ALA 26 -15.439 23.806 -33.750 197 HB3 ALA 26 2HB ALA 26 -15.546 24.554 -35.356 198 HA PRO 27 HA PRO 27 -11.971 27.847 -34.105 199 HB2 PRO 27 2HB PRO 27 -14.201 29.229 -35.565 200 HB3 PRO 27 3HB PRO 27 -12.444 29.564 -35.599 201 HG2 PRO 27 2HG PRO 27 -13.632 28.274 -37.668 202 HG3 PRO 27 3HG PRO 27 -12.045 27.699 -37.050 203 HD2 PRO 27 2HD PRO 27 -14.811 26.691 -36.304 204 HD3 PRO 27 3HD PRO 27 -13.398 25.742 -36.891 205 H ARG 28 H ARG 28 -12.318 29.082 -32.422 206 HA ARG 28 HA ARG 28 -14.957 29.245 -31.076 207 HB2 ARG 28 2HB ARG 28 -14.114 28.290 -29.026 208 HB3 ARG 28 3HB ARG 28 -13.892 27.170 -30.372 209 HG2 ARG 28 2HG ARG 28 -11.496 27.744 -30.507 210 HG3 ARG 28 3HG ARG 28 -11.701 28.922 -29.196 211 HD2 ARG 28 2HD ARG 28 -12.419 27.104 -27.676 212 HD3 ARG 28 3HD ARG 28 -12.212 25.926 -28.991 213 HE ARG 28 HE ARG 28 -9.760 27.292 -28.735 214 HH11 ARG 28 1HH2 ARG 28 -11.638 25.090 -26.759 215 HH12 ARG 28 2HH2 ARG 28 -10.233 24.518 -25.902 216 HH21 ARG 28 1HH1 ARG 28 -8.011 26.511 -27.609 217 HH22 ARG 28 2HH1 ARG 28 -8.236 25.301 -26.381 218 H GLN 29 H GLN 29 -14.926 30.412 -29.050 219 HA GLN 29 HA GLN 29 -13.355 32.957 -29.093 220 HB2 GLN 29 2HB GLN 29 -16.357 32.690 -28.680 221 HB3 GLN 29 3HB GLN 29 -15.428 34.183 -28.686 222 HG2 GLN 29 2HG GLN 29 -15.653 34.410 -30.917 223 HG3 GLN 29 3HG GLN 29 -15.056 32.777 -31.223 224 HE21 GLN 29 1HE2 GLN 29 -16.808 31.098 -30.127 225 HE22 GLN 29 2HE2 GLN 29 -18.400 31.300 -30.859 226 H ILE 30 H ILE 30 -12.209 32.505 -27.228 227 HA ILE 30 HA ILE 30 -13.484 31.658 -24.750 228 HB ILE 30 HB ILE 30 -10.710 32.740 -25.342 229 HG12 ILE 30 2HG1 ILE 30 -9.931 30.494 -24.943 230 HG13 ILE 30 3HG1 ILE 30 -11.554 29.932 -24.544 231 HG21 ILE 30 1HG2 ILE 30 -11.913 31.588 -22.782 232 HG22 ILE 30 2HG2 ILE 30 -10.176 31.871 -23.034 233 HG23 ILE 30 3HG2 ILE 30 -11.285 33.237 -22.999 234 HD11 ILE 30 3HD1 ILE 30 -10.642 29.159 -26.734 235 HD12 ILE 30 1HD1 ILE 30 -12.216 29.949 -26.842 236 HD13 ILE 30 2HD1 ILE 30 -10.730 30.829 -27.321 237 H ALA 31 H ALA 31 -14.936 32.939 -23.928 238 HA ALA 31 HA ALA 31 -14.351 35.833 -23.460 239 HB1 ALA 31 3HB ALA 31 -16.735 35.911 -22.717 240 HB2 ALA 31 1HB ALA 31 -16.530 35.436 -24.411 241 HB3 ALA 31 2HB ALA 31 -16.904 34.202 -23.184 242 H ARG 32 H ARG 32 -14.717 36.629 -21.282 243 HA ARG 32 HA ARG 32 -14.214 34.630 -19.109 244 HB2 ARG 32 2HB ARG 32 -12.854 37.227 -19.706 245 HB3 ARG 32 3HB ARG 32 -13.319 36.979 -18.018 246 HG2 ARG 32 2HG ARG 32 -12.193 34.844 -17.938 247 HG3 ARG 32 3HG ARG 32 -11.718 34.978 -19.648 248 HD2 ARG 32 2HD ARG 32 -10.309 36.878 -19.153 249 HD3 ARG 32 3HD ARG 32 -10.911 36.958 -17.478 250 HE ARG 32 HE ARG 32 -9.909 34.415 -17.594 251 HH11 ARG 32 1HH1 ARG 32 -8.429 37.464 -18.366 252 HH12 ARG 32 2HH1 ARG 32 -6.828 36.946 -17.922 253 HH21 ARG 32 1HH2 ARG 32 -7.933 33.724 -17.099 254 HH22 ARG 32 2HH2 ARG 32 -6.554 34.818 -17.204 255 H TYR 33 H TYR 33 -15.232 34.924 -17.146 256 HA TYR 33 HA TYR 33 -17.326 37.002 -16.970 257 HB2 TYR 33 2HB TYR 33 -17.902 34.061 -16.563 258 HB3 TYR 33 3HB TYR 33 -18.979 35.375 -16.183 259 HD1 TYR 33 HD1 TYR 33 -17.224 33.677 -19.008 260 HD2 TYR 33 HD2 TYR 33 -20.434 36.265 -17.788 261 HE1 TYR 33 HE1 TYR 33 -18.255 33.470 -21.258 262 HE2 TYR 33 HE2 TYR 33 -21.461 36.066 -20.054 263 HH TYR 33 HH TYR 33 -20.142 33.841 -22.507 264 H ARG 34 H ARG 34 -17.734 37.695 -14.953 265 HA ARG 34 HA ARG 34 -16.021 36.738 -12.702 266 HB2 ARG 34 2HB ARG 34 -15.656 39.040 -13.620 267 HB3 ARG 34 3HB ARG 34 -17.324 39.448 -13.240 268 HG2 ARG 34 2HG ARG 34 -16.897 39.160 -10.838 269 HG3 ARG 34 3HG ARG 34 -15.248 38.593 -11.165 270 HD2 ARG 34 2HD ARG 34 -14.701 40.783 -12.197 271 HD3 ARG 34 3HD ARG 34 -16.361 41.312 -11.935 272 HE ARG 34 HE ARG 34 -15.999 41.502 -9.618 273 HH11 ARG 34 1HH1 ARG 34 -12.932 40.588 -11.178 274 HH12 ARG 34 2HH1 ARG 34 -12.044 41.014 -9.743 275 HH21 ARG 34 1HH2 ARG 34 -14.736 42.038 -7.898 276 HH22 ARG 34 2HH2 ARG 34 -13.015 41.822 -7.975 277 H THR 35 H THR 35 -16.924 35.891 -10.973 278 HA THR 35 HA THR 35 -19.824 35.508 -10.812 279 HB THR 35 HB THR 35 -19.352 34.056 -8.902 280 HG1 THR 35 HG1 THR 35 -16.654 34.555 -9.388 281 HG21 THR 35 1HG2 THR 35 -19.224 33.044 -11.072 282 HG22 THR 35 2HG2 THR 35 -17.524 33.521 -11.261 283 HG23 THR 35 3HG2 THR 35 -17.985 32.372 -9.988 284 H ASP 36 H ASP 36 -20.649 35.514 -8.358 285 HA ASP 36 HA ASP 36 -20.700 38.281 -7.650 286 HB2 ASP 36 2HB ASP 36 -22.645 36.681 -7.528 287 HB3 ASP 36 3HB ASP 36 -21.860 35.878 -6.169 288 H ASN 37 H ASN 37 -18.553 35.748 -6.596 289 HA ASN 37 HA ASN 37 -17.786 37.358 -4.206 290 HB2 ASN 37 2HB ASN 37 -16.305 34.930 -5.038 291 HB3 ASN 37 3HB ASN 37 -16.471 35.650 -3.475 292 HD21 ASN 37 1HD2 ASN 37 -16.919 32.927 -4.586 293 HD22 ASN 37 2HD2 ASN 37 -18.510 32.482 -3.928 294 H GLY 38 H GLY 38 -17.289 37.795 -7.394 295 HA2 GLY 38 HA2 GLY 38 -15.719 39.004 -8.588 296 HA3 GLY 38 HA3 GLY 38 -14.606 39.007 -7.213 297 H GLU 39 H GLU 39 -15.717 35.836 -7.893 298 HA GLU 39 HA GLU 39 -13.005 35.077 -8.689 299 HB2 GLU 39 2HB GLU 39 -15.354 33.193 -8.836 300 HB3 GLU 39 3HB GLU 39 -13.676 32.857 -8.508 301 HG2 GLU 39 2HG GLU 39 -14.258 34.437 -6.355 302 HG3 GLU 39 3HG GLU 39 -15.890 33.875 -6.781 303 H GLU 40 H GLU 40 -12.293 35.287 -10.726 304 HA GLU 40 HA GLU 40 -14.209 35.394 -12.991 305 HB2 GLU 40 2HB GLU 40 -11.333 36.284 -12.658 306 HB3 GLU 40 3HB GLU 40 -12.134 36.191 -14.240 307 HG2 GLU 40 2HG GLU 40 -13.888 37.694 -13.518 308 HG3 GLU 40 3HG GLU 40 -13.227 37.758 -11.880 309 H PHE 41 H PHE 41 -14.458 33.905 -14.455 310 HA PHE 41 HA PHE 41 -12.405 31.756 -14.865 311 HB2 PHE 41 2HB PHE 41 -15.424 31.498 -14.758 312 HB3 PHE 41 3HB PHE 41 -14.332 30.229 -15.234 313 HD1 PHE 41 HD2 PHE 41 -15.554 32.212 -12.285 314 HD2 PHE 41 HD1 PHE 41 -12.938 29.038 -13.634 315 HE1 PHE 41 HE2 PHE 41 -15.222 31.472 -9.990 316 HE2 PHE 41 HE1 PHE 41 -12.570 28.346 -11.286 317 HZ PHE 41 HZ PHE 41 -13.702 29.574 -9.445 318 H GLU 42 H GLU 42 -12.617 30.628 -16.942 319 HA GLU 42 HA GLU 42 -13.375 32.491 -19.125 320 HB2 GLU 42 2HB GLU 42 -11.373 30.220 -19.392 321 HB3 GLU 42 3HB GLU 42 -11.705 31.565 -20.462 322 HG2 GLU 42 2HG GLU 42 -9.800 32.369 -19.544 323 HG3 GLU 42 3HG GLU 42 -10.994 33.038 -18.430 324 H VAL 43 H VAL 43 -14.788 31.885 -20.604 325 HA VAL 43 HA VAL 43 -15.729 29.040 -20.694 326 HB VAL 43 HB VAL 43 -17.412 31.475 -21.221 327 HG11 VAL 43 1HG1 VAL 43 -18.167 28.538 -20.940 328 HG12 VAL 43 2HG1 VAL 43 -19.253 29.906 -21.286 329 HG13 VAL 43 3HG1 VAL 43 -18.067 29.415 -22.481 330 HG21 VAL 43 3HG2 VAL 43 -16.827 31.242 -18.776 331 HG22 VAL 43 1HG2 VAL 43 -18.526 31.068 -19.157 332 HG23 VAL 43 2HG2 VAL 43 -17.551 29.615 -18.822 333 HA PRO 44 HA PRO 44 -14.420 29.719 -25.023 334 HB2 PRO 44 2HB PRO 44 -14.012 27.102 -25.692 335 HB3 PRO 44 3HB PRO 44 -12.830 28.078 -24.780 336 HG2 PRO 44 2HG PRO 44 -14.812 26.072 -23.711 337 HG3 PRO 44 3HG PRO 44 -13.102 26.315 -23.239 338 HD2 PRO 44 2HD PRO 44 -15.272 27.319 -21.851 339 HD3 PRO 44 3HD PRO 44 -13.668 28.112 -21.817 340 H PHE 45 H PHE 45 -16.015 30.245 -26.343 341 HA PHE 45 HA PHE 45 -18.439 28.538 -26.736 342 HB2 PHE 45 2HB PHE 45 -17.759 31.427 -27.336 343 HB3 PHE 45 3HB PHE 45 -19.127 30.655 -28.078 344 HD1 PHE 45 HD1 PHE 45 -17.626 31.665 -24.823 345 HD2 PHE 45 HD2 PHE 45 -21.172 30.259 -26.831 346 HE1 PHE 45 HE1 PHE 45 -18.965 32.116 -22.792 347 HE2 PHE 45 HE2 PHE 45 -22.520 30.757 -24.797 348 HZ PHE 45 HZ PHE 45 -21.405 31.680 -22.768 349 H ALA 46 H ALA 46 -19.000 27.787 -28.775 350 HA ALA 46 HA ALA 46 -16.817 27.549 -30.763 351 HB1 ALA 46 3HB ALA 46 -18.328 25.952 -31.861 352 HB2 ALA 46 1HB ALA 46 -18.131 25.548 -30.147 353 HB3 ALA 46 2HB ALA 46 -19.619 26.346 -30.706 354 H ASP 47 H ASP 47 -17.151 28.119 -33.011 355 HA ASP 47 HA ASP 47 -18.136 30.704 -33.511 356 HB2 ASP 47 2HB ASP 47 -16.402 29.521 -34.797 357 HB3 ASP 47 3HB ASP 47 -17.611 28.411 -35.442 358 H ASP 48 H ASP 48 -19.953 27.754 -33.442 359 HA ASP 48 HA ASP 48 -22.257 28.633 -34.997 360 HB2 ASP 48 2HB ASP 48 -21.571 26.258 -34.588 361 HB3 ASP 48 3HB ASP 48 -21.990 26.464 -32.889 362 H ALA 49 H ALA 49 -21.075 29.496 -31.920 363 HA ALA 49 HA ALA 49 -23.727 30.487 -30.952 364 HB1 ALA 49 3HB ALA 49 -21.348 29.502 -29.324 365 HB2 ALA 49 1HB ALA 49 -22.899 30.084 -28.683 366 HB3 ALA 49 2HB ALA 49 -22.843 28.582 -29.626 367 H GLU 50 H GLU 50 -23.629 32.378 -29.556 368 HA GLU 50 HA GLU 50 -21.243 34.136 -29.830 369 HB2 GLU 50 2HB GLU 50 -24.121 34.908 -30.422 370 HB3 GLU 50 3HB GLU 50 -22.875 36.089 -29.995 371 HG2 GLU 50 2HG GLU 50 -21.494 35.409 -31.900 372 HG3 GLU 50 3HG GLU 50 -22.667 34.169 -32.339 373 H ILE 51 H ILE 51 -20.792 35.348 -28.141 374 HA ILE 51 HA ILE 51 -21.251 34.411 -25.595 375 HB ILE 51 HB ILE 51 -20.282 37.220 -26.094 376 HG12 ILE 51 2HG1 ILE 51 -19.116 35.852 -27.761 377 HG13 ILE 51 3HG1 ILE 51 -18.022 36.399 -26.496 378 HG21 ILE 51 1HG2 ILE 51 -19.437 35.121 -24.060 379 HG22 ILE 51 2HG2 ILE 51 -18.844 36.776 -24.161 380 HG23 ILE 51 3HG2 ILE 51 -20.528 36.469 -23.718 381 HD11 ILE 51 3HD1 ILE 51 -18.078 34.113 -25.501 382 HD12 ILE 51 1HD1 ILE 51 -19.201 33.605 -26.785 383 HD13 ILE 51 2HD1 ILE 51 -17.548 34.104 -27.182 384 HA PRO 52 HA PRO 52 -25.047 36.758 -24.566 385 HB2 PRO 52 2HB PRO 52 -25.656 35.288 -22.337 386 HB3 PRO 52 3HB PRO 52 -26.049 34.756 -24.002 387 HG2 PRO 52 2HG PRO 52 -23.759 33.908 -22.229 388 HG3 PRO 52 3HG PRO 52 -24.777 32.903 -23.317 389 HD2 PRO 52 2HD PRO 52 -22.245 33.904 -23.934 390 HD3 PRO 52 3HD PRO 52 -23.436 33.460 -25.159 391 H GLY 53 H GLY 53 -25.359 38.317 -22.959 392 HA2 GLY 53 HA2 GLY 53 -23.289 39.696 -21.783 393 HA3 GLY 53 HA3 GLY 53 -24.949 39.737 -21.183 394 H THR 54 H THR 54 -24.915 36.886 -20.284 395 HA THR 54 HA THR 54 -22.718 36.778 -18.345 396 HB THR 54 HB THR 54 -24.318 36.177 -16.491 397 HG1 THR 54 HG1 THR 54 -26.546 36.507 -16.839 398 HG21 THR 54 1HG2 THR 54 -25.272 38.305 -15.973 399 HG22 THR 54 2HG2 THR 54 -23.766 38.613 -16.841 400 HG23 THR 54 3HG2 THR 54 -25.304 38.794 -17.686 401 H TRP 55 H TRP 55 -22.507 34.658 -17.245 402 HA TRP 55 HA TRP 55 -23.842 32.317 -18.385 403 HB2 TRP 55 2HB TRP 55 -22.093 33.011 -20.088 404 HB3 TRP 55 3HB TRP 55 -20.869 32.697 -18.866 405 HD1 TRP 55 HD1 TRP 55 -20.304 30.193 -18.331 406 HE1 TRP 55 HE1 TRP 55 -20.623 28.030 -19.634 407 HE3 TRP 55 HE3 TRP 55 -23.959 31.755 -21.512 408 HZ2 TRP 55 HZ2 TRP 55 -22.404 27.025 -21.712 409 HZ3 TRP 55 HZ3 TRP 55 -24.985 30.173 -23.145 410 HH2 TRP 55 HH2 TRP 55 -24.209 27.812 -23.254 411 H LEU 56 H LEU 56 -23.431 30.385 -17.190 412 HA LEU 56 HA LEU 56 -22.706 30.799 -14.433 413 HB2 LEU 56 2HB LEU 56 -24.291 29.006 -15.849 414 HB3 LEU 56 3HB LEU 56 -22.912 28.014 -15.374 415 HG LEU 56 HG LEU 56 -24.530 29.706 -13.430 416 HD11 LEU 56 1HD1 LEU 56 -25.628 27.599 -12.768 417 HD12 LEU 56 2HD1 LEU 56 -25.963 27.986 -14.463 418 HD13 LEU 56 3HD1 LEU 56 -24.767 26.733 -14.062 419 HD21 LEU 56 3HD2 LEU 56 -23.537 28.196 -11.733 420 HD22 LEU 56 1HD2 LEU 56 -22.579 27.397 -13.003 421 HD23 LEU 56 2HD2 LEU 56 -22.288 29.096 -12.598 422 H CYS 57 H CYS 57 -20.823 30.563 -13.429 423 HA CYS 57 HA CYS 57 -18.428 29.759 -14.980 424 HB2 CYS 57 2HB CYS 57 -18.868 31.285 -12.388 425 HB3 CYS 57 3HB CYS 57 -17.269 30.803 -12.969 426 HG CYS 57 HG CYS 57 -19.530 32.423 -14.749 427 H ARG 58 H ARG 58 -16.693 28.613 -13.837 428 HA ARG 58 HA ARG 58 -17.591 26.037 -13.083 429 HB2 ARG 58 2HB ARG 58 -14.800 27.096 -12.507 430 HB3 ARG 58 3HB ARG 58 -15.272 25.436 -12.849 431 HG2 ARG 58 2HG ARG 58 -15.805 26.101 -15.213 432 HG3 ARG 58 3HG ARG 58 -15.276 27.752 -14.832 433 HD2 ARG 58 2HD ARG 58 -13.061 26.634 -14.047 434 HD3 ARG 58 3HD ARG 58 -13.600 25.240 -14.988 435 HE ARG 58 HE ARG 58 -13.852 26.962 -16.915 436 HH11 ARG 58 1HH1 ARG 58 -11.200 27.182 -14.589 437 HH12 ARG 58 2HH1 ARG 58 -10.340 28.305 -15.620 438 HH21 ARG 58 1HH2 ARG 58 -12.659 28.412 -18.088 439 HH22 ARG 58 2HH2 ARG 58 -11.097 28.945 -17.464 440 H ASN 59 H ASN 59 -16.977 28.766 -11.059 441 HA ASN 59 HA ASN 59 -16.665 27.465 -8.550 442 HB2 ASN 59 2HB ASN 59 -16.087 29.757 -8.935 443 HB3 ASN 59 3HB ASN 59 -17.753 30.178 -9.356 444 HD21 ASN 59 1HD2 ASN 59 -17.787 31.847 -7.795 445 HD22 ASN 59 2HD2 ASN 59 -17.736 31.490 -6.079 446 H GLY 60 H GLY 60 -19.439 27.749 -10.594 447 HA2 GLY 60 HA2 GLY 60 -21.537 26.721 -10.323 448 HA3 GLY 60 HA3 GLY 60 -21.300 26.612 -8.577 449 H MET 61 H MET 61 -20.539 29.694 -9.968 450 HA MET 61 HA MET 61 -23.149 30.851 -9.118 451 HB2 MET 61 2HB MET 61 -21.152 31.355 -7.665 452 HB3 MET 61 3HB MET 61 -20.393 32.140 -9.025 453 HG2 MET 61 2HG MET 61 -21.459 33.751 -7.503 454 HG3 MET 61 3HG MET 61 -22.127 33.828 -9.129 455 HE1 MET 61 3HE MET 61 -22.922 31.380 -6.039 456 HE2 MET 61 1HE MET 61 -22.712 33.020 -5.375 457 HE3 MET 61 2HE MET 61 -24.313 32.248 -5.359 458 H GLU 62 H GLU 62 -24.043 32.488 -10.383 459 HA GLU 62 HA GLU 62 -23.533 32.421 -13.236 460 HB2 GLU 62 2HB GLU 62 -25.289 34.211 -11.520 461 HB3 GLU 62 3HB GLU 62 -25.211 34.271 -13.288 462 HG2 GLU 62 2HG GLU 62 -25.909 31.894 -13.412 463 HG3 GLU 62 3HG GLU 62 -26.022 31.827 -11.653 464 H GLY 63 H GLY 63 -21.794 33.282 -14.128 465 HA2 GLY 63 HA2 GLY 63 -20.419 35.586 -12.958 466 HA3 GLY 63 HA3 GLY 63 -19.829 34.606 -14.273 467 H THR 64 H THR 64 -20.137 37.583 -14.038 468 HA THR 64 HA THR 64 -21.803 38.035 -16.475 469 HB THR 64 HB THR 64 -20.713 40.053 -14.481 470 HG1 THR 64 HG1 THR 64 -22.850 40.206 -13.827 471 HG21 THR 64 1HG2 THR 64 -22.534 40.411 -16.912 472 HG22 THR 64 2HG2 THR 64 -22.385 41.612 -15.609 473 HG23 THR 64 3HG2 THR 64 -20.978 41.200 -16.592 474 H LEU 65 H LEU 65 -20.997 38.907 -18.322 475 HA LEU 65 HA LEU 65 -18.401 38.135 -19.027 476 HB2 LEU 65 2HB LEU 65 -20.480 38.291 -20.392 477 HB3 LEU 65 3HB LEU 65 -20.322 40.027 -20.411 478 HG LEU 65 HG LEU 65 -18.653 37.888 -21.785 479 HD11 LEU 65 1HD1 LEU 65 -20.771 38.676 -22.813 480 HD12 LEU 65 2HD1 LEU 65 -20.153 40.339 -22.810 481 HD13 LEU 65 3HD1 LEU 65 -19.368 39.099 -23.807 482 HD21 LEU 65 3HD2 LEU 65 -17.307 39.718 -22.853 483 HD22 LEU 65 1HD2 LEU 65 -17.911 40.833 -21.607 484 HD23 LEU 65 2HD2 LEU 65 -16.913 39.412 -21.173 485 H ILE 66 H ILE 66 -16.470 39.045 -18.663 486 HA ILE 66 HA ILE 66 -16.097 41.984 -18.791 487 HB ILE 66 HB ILE 66 -14.538 42.042 -17.006 488 HG12 ILE 66 2HG1 ILE 66 -13.426 39.935 -16.993 489 HG13 ILE 66 3HG1 ILE 66 -14.145 40.168 -15.410 490 HG21 ILE 66 1HG2 ILE 66 -15.957 41.766 -15.066 491 HG22 ILE 66 2HG2 ILE 66 -16.878 42.424 -16.429 492 HG23 ILE 66 3HG2 ILE 66 -17.065 40.724 -15.973 493 HD11 ILE 66 3HD1 ILE 66 -14.433 37.917 -15.942 494 HD12 ILE 66 1HD1 ILE 66 -16.026 38.703 -16.086 495 HD13 ILE 66 2HD1 ILE 66 -15.085 38.325 -17.533 496 H GLU 67 H GLU 67 -13.970 42.664 -19.434 497 HA GLU 67 HA GLU 67 -12.350 40.600 -20.886 498 HB2 GLU 67 2HB GLU 67 -12.336 43.636 -21.028 499 HB3 GLU 67 3HB GLU 67 -11.183 42.571 -21.848 500 HG2 GLU 67 2HG GLU 67 -13.046 41.485 -23.075 501 HG3 GLU 67 3HG GLU 67 -14.203 42.558 -22.284 502 H GLY 68 H GLY 68 -11.298 39.585 -19.205 503 HA2 GLY 68 HA2 GLY 68 -10.079 41.037 -16.995 504 HA3 GLY 68 HA3 GLY 68 -10.006 39.306 -17.299 505 H ASP 69 H ASP 69 -8.875 40.079 -20.116 506 HA ASP 69 HA ASP 69 -6.286 41.256 -19.652 507 HB2 ASP 69 2HB ASP 69 -6.579 38.289 -20.285 508 HB3 ASP 69 3HB ASP 69 -5.224 39.215 -20.908 509 H LEU 70 H LEU 70 -5.428 41.938 -21.590 510 HA LEU 70 HA LEU 70 -7.231 42.335 -23.831 511 HB2 LEU 70 2HB LEU 70 -4.357 43.110 -23.251 512 HB3 LEU 70 3HB LEU 70 -5.040 43.290 -24.857 513 HG LEU 70 HG LEU 70 -6.824 44.754 -24.010 514 HD11 LEU 70 1HD1 LEU 70 -6.560 45.811 -21.763 515 HD12 LEU 70 2HD1 LEU 70 -7.024 44.114 -21.663 516 HD13 LEU 70 3HD1 LEU 70 -5.333 44.592 -21.354 517 HD21 LEU 70 3HD2 LEU 70 -5.373 46.705 -23.635 518 HD22 LEU 70 1HD2 LEU 70 -4.000 45.633 -23.277 519 HD23 LEU 70 2HD2 LEU 70 -4.712 45.666 -24.906 520 HA PRO 71 HA PRO 71 -6.083 38.715 -26.135 521 HB2 PRO 71 2HB PRO 71 -7.179 39.206 -28.558 522 HB3 PRO 71 3HB PRO 71 -8.176 39.161 -27.078 523 HG2 PRO 71 2HG PRO 71 -6.989 41.626 -28.414 524 HG3 PRO 71 3HG PRO 71 -8.704 41.333 -27.977 525 HD2 PRO 71 2HD PRO 71 -6.998 42.691 -26.326 526 HD3 PRO 71 3HD PRO 71 -8.273 41.612 -25.686 527 H GLU 72 H GLU 72 -3.824 40.150 -25.701 528 HA GLU 72 HA GLU 72 -1.926 41.228 -26.446 529 HB2 GLU 72 2HB GLU 72 -2.032 38.527 -27.780 530 HB3 GLU 72 3HB GLU 72 -0.556 39.521 -27.715 531 HG2 GLU 72 2HG GLU 72 -0.703 39.545 -25.234 532 HG3 GLU 72 3HG GLU 72 -2.116 38.491 -25.309 533 HA PRO 73 HA PRO 73 -3.703 42.855 -30.449 534 HB2 PRO 73 2HB PRO 73 -3.055 45.464 -29.075 535 HB3 PRO 73 3HB PRO 73 -4.443 45.056 -30.134 536 HG2 PRO 73 2HG PRO 73 -4.771 45.133 -27.454 537 HG3 PRO 73 3HG PRO 73 -5.483 43.778 -28.393 538 HD2 PRO 73 2HD PRO 73 -2.881 43.813 -26.830 539 HD3 PRO 73 3HD PRO 73 -4.198 42.609 -26.815 540 H LYS 74 H LYS 74 -2.612 43.453 -32.230 541 HA LYS 74 HA LYS 74 0.219 44.383 -32.087 542 HB2 LYS 74 2HB LYS 74 0.954 42.631 -33.593 543 HB3 LYS 74 3HB LYS 74 0.264 41.958 -32.121 544 HG2 LYS 74 2HG LYS 74 -1.862 41.464 -33.336 545 HG3 LYS 74 3HG LYS 74 -1.146 42.117 -34.824 546 HD2 LYS 74 2HD LYS 74 0.631 40.391 -34.729 547 HD3 LYS 74 3HD LYS 74 -0.082 39.741 -33.235 548 HE2 LYS 74 2HE LYS 74 -2.202 39.282 -34.454 549 HE3 LYS 74 3HE LYS 74 -1.488 39.923 -35.940 550 HZ1 LYS 74 HZ1 LYS 74 -1.333 37.500 -35.857 551 HZ2 LYS 74 HZ2 LYS 74 0.169 38.134 -35.834 552 HZ3 LYS 74 HZ3 LYS 74 -0.492 37.543 -34.461 553 H LYS 75 H LYS 75 -2.133 45.842 -32.794 554 HA LYS 75 HA LYS 75 -3.040 47.249 -34.339 555 HB2 LYS 75 2HB LYS 75 -0.693 48.111 -33.862 556 HB3 LYS 75 3HB LYS 75 -0.228 47.493 -35.449 557 HG2 LYS 75 2HG LYS 75 -1.988 48.960 -36.488 558 HG3 LYS 75 3HG LYS 75 -2.425 49.537 -34.871 559 HD2 LYS 75 2HD LYS 75 -0.127 50.460 -34.582 560 HD3 LYS 75 3HD LYS 75 0.322 49.819 -36.165 561 HE2 LYS 75 2HE LYS 75 -0.104 52.138 -36.470 562 HE3 LYS 75 3HE LYS 75 -1.430 51.257 -37.230 563 HZ1 LYS 75 HZ1 LYS 75 -1.543 52.535 -34.542 564 HZ2 LYS 75 HZ2 LYS 75 -2.221 53.139 -35.896 565 HZ3 LYS 75 HZ3 LYS 75 -2.790 51.752 -35.258 566 H VAL 76 H VAL 76 -3.876 44.970 -35.032 567 HA VAL 76 HA VAL 76 -3.286 44.085 -37.728 568 HB VAL 76 HB VAL 76 -5.280 42.680 -37.520 569 HG11 VAL 76 1HG1 VAL 76 -4.494 41.254 -35.729 570 HG12 VAL 76 2HG1 VAL 76 -3.105 41.944 -36.584 571 HG13 VAL 76 3HG1 VAL 76 -3.585 42.589 -34.996 572 HG21 VAL 76 3HG2 VAL 76 -5.704 43.952 -34.776 573 HG22 VAL 76 1HG2 VAL 76 -6.763 44.154 -36.190 574 HG23 VAL 76 2HG2 VAL 76 -6.577 42.562 -35.447 575 H LYS 77 H LYS 77 -4.782 44.051 -39.529 576 HA LYS 77 HA LYS 77 -5.793 46.620 -40.261 577 HB2 LYS 77 2HB LYS 77 -4.931 44.818 -41.808 578 HB3 LYS 77 3HB LYS 77 -6.401 43.905 -41.493 579 HG2 LYS 77 2HG LYS 77 -6.710 44.978 -43.574 580 HG3 LYS 77 3HG LYS 77 -7.724 45.865 -42.438 581 HD2 LYS 77 2HD LYS 77 -5.945 47.638 -42.287 582 HD3 LYS 77 3HD LYS 77 -4.958 46.708 -43.432 583 HE2 LYS 77 2HE LYS 77 -6.780 46.879 -45.121 584 HE3 LYS 77 3HE LYS 77 -7.748 47.821 -43.982 585 HZ1 LYS 77 HZ1 LYS 77 -6.548 49.259 -45.528 586 HZ2 LYS 77 HZ2 LYS 77 -6.001 49.528 -44.015 587 HZ3 LYS 77 HZ3 LYS 77 -5.107 48.652 -45.068 588 HA PRO 78 HA PRO 78 -9.806 46.419 -38.269 589 HB2 PRO 78 2HB PRO 78 -10.661 48.263 -40.504 590 HB3 PRO 78 3HB PRO 78 -10.974 48.405 -38.745 591 HG2 PRO 78 2HG PRO 78 -9.028 49.892 -39.878 592 HG3 PRO 78 3HG PRO 78 -8.705 49.057 -38.321 593 HD2 PRO 78 2HD PRO 78 -7.944 48.172 -41.120 594 HD3 PRO 78 3HD PRO 78 -6.942 48.231 -39.635 595 HA PRO 79 HA PRO 79 -12.167 43.475 -40.667 596 HB2 PRO 79 2HB PRO 79 -14.612 43.501 -39.434 597 HB3 PRO 79 3HB PRO 79 -13.134 42.865 -38.651 598 HG2 PRO 79 2HG PRO 79 -14.347 45.638 -38.367 599 HG3 PRO 79 3HG PRO 79 -13.842 44.514 -37.061 600 HD2 PRO 79 2HD PRO 79 -12.220 46.512 -37.939 601 HD3 PRO 79 3HD PRO 79 -11.551 44.919 -37.475 602 H ARG 80 H ARG 80 -14.644 44.837 -42.951 603 HA ARG 80 HA ARG 80 -13.866 42.325 -41.527 604 HB2 ARG 80 2HB ARG 80 -15.862 42.865 -43.750 605 HB3 ARG 80 3HB ARG 80 -15.451 41.270 -43.108 606 HG2 ARG 80 2HG ARG 80 -16.239 41.954 -40.852 607 HG3 ARG 80 3HG ARG 80 -16.646 43.557 -41.478 608 HD2 ARG 80 2HD ARG 80 -18.660 42.265 -41.343 609 HD3 ARG 80 3HD ARG 80 -18.286 42.537 -43.039 610 HE ARG 80 HE ARG 80 -17.974 39.979 -41.506 611 HH11 ARG 80 1HH2 ARG 80 -18.156 41.484 -44.669 612 HH12 ARG 80 2HH2 ARG 80 -18.247 39.946 -45.484 613 HH21 ARG 80 1HH1 ARG 80 -18.092 38.075 -42.610 614 HH22 ARG 80 2HH1 ARG 80 -18.213 38.077 -44.346 Start of MODEL 33 1 H1 SER 1 1H SER 1 -4.206 12.217 -13.190 2 H2 SER 1 2H SER 1 -5.240 12.549 -11.946 3 H3 SER 1 3H SER 1 -5.431 11.183 -12.851 4 HA SER 1 HA SER 1 -3.288 10.374 -12.093 5 HB2 SER 1 2HB SER 1 -2.337 11.492 -10.046 6 HB3 SER 1 3HB SER 1 -2.201 12.431 -11.541 7 HG SER 1 HG SER 1 -2.956 13.691 -9.765 8 H MET 2 H MET 2 -4.810 8.671 -9.311 9 HA MET 2 HA MET 2 -2.117 9.183 -10.230 10 HB2 MET 2 2HB MET 2 -3.499 6.638 -9.297 11 HB3 MET 2 3HB MET 2 -1.765 6.800 -9.598 12 HG2 MET 2 2HG MET 2 -1.617 8.582 -7.892 13 HG3 MET 2 3HG MET 2 -3.342 8.405 -7.553 14 HE1 MET 2 3HE MET 2 -1.670 6.979 -4.317 15 HE2 MET 2 1HE MET 2 -1.091 8.328 -5.318 16 HE3 MET 2 2HE MET 2 -2.829 8.149 -4.984 17 H ALA 3 H ALA 3 -4.868 7.466 -11.672 18 HA ALA 3 HA ALA 3 -3.350 7.007 -14.189 19 HB1 ALA 3 3HB ALA 3 -4.853 5.208 -13.434 20 HB2 ALA 3 1HB ALA 3 -6.224 6.341 -13.427 21 HB3 ALA 3 2HB ALA 3 -5.421 5.922 -14.955 22 H ASP 4 H ASP 4 -3.733 8.224 -16.033 23 HA ASP 4 HA ASP 4 -5.353 10.724 -15.705 24 HB2 ASP 4 2HB ASP 4 -3.005 10.118 -17.521 25 HB3 ASP 4 3HB ASP 4 -3.903 11.636 -17.488 26 H ARG 5 H ARG 5 -5.530 7.763 -17.284 27 HA ARG 5 HA ARG 5 -6.975 6.868 -18.827 28 HB2 ARG 5 2HB ARG 5 -8.752 9.033 -17.669 29 HB3 ARG 5 3HB ARG 5 -9.289 7.531 -18.435 30 HG2 ARG 5 2HG ARG 5 -8.221 6.196 -16.656 31 HG3 ARG 5 3HG ARG 5 -7.666 7.680 -15.857 32 HD2 ARG 5 2HD ARG 5 -10.030 8.422 -15.599 33 HD3 ARG 5 3HD ARG 5 -10.569 6.937 -16.379 34 HE ARG 5 HE ARG 5 -10.176 5.736 -14.444 35 HH11 ARG 5 2HH2 ARG 5 -8.641 8.860 -13.982 36 HH12 ARG 5 1HH2 ARG 5 -8.391 8.580 -12.284 37 HH21 ARG 5 1HH1 ARG 5 -9.814 5.450 -12.280 38 HH22 ARG 5 2HH1 ARG 5 -9.044 6.700 -11.349 39 H VAL 6 H VAL 6 -5.360 8.920 -20.044 40 HA VAL 6 HA VAL 6 -5.127 10.263 -21.857 41 HB VAL 6 HB VAL 6 -7.259 8.668 -23.281 42 HG11 VAL 6 1HG1 VAL 6 -4.544 9.778 -24.168 43 HG12 VAL 6 2HG1 VAL 6 -5.700 8.905 -25.196 44 HG13 VAL 6 3HG1 VAL 6 -6.113 10.498 -24.572 45 HG21 VAL 6 3HG2 VAL 6 -5.488 7.002 -23.847 46 HG22 VAL 6 1HG2 VAL 6 -4.419 7.762 -22.647 47 HG23 VAL 6 2HG2 VAL 6 -5.930 6.966 -22.145 48 H LEU 7 H LEU 7 -6.806 11.260 -19.872 49 HA LEU 7 HA LEU 7 -8.214 12.896 -19.333 50 HB2 LEU 7 2HB LEU 7 -7.677 14.026 -22.090 51 HB3 LEU 7 3HB LEU 7 -8.200 14.911 -20.663 52 HG LEU 7 HG LEU 7 -5.491 13.555 -21.026 53 HD11 LEU 7 1HD1 LEU 7 -4.625 15.849 -21.069 54 HD12 LEU 7 2HD1 LEU 7 -5.787 15.585 -22.379 55 HD13 LEU 7 3HD1 LEU 7 -6.275 16.493 -20.934 56 HD21 LEU 7 3HD2 LEU 7 -4.855 14.732 -18.935 57 HD22 LEU 7 1HD2 LEU 7 -6.543 15.238 -18.711 58 HD23 LEU 7 2HD2 LEU 7 -6.103 13.517 -18.648 59 H ARG 8 H ARG 8 -9.486 10.540 -20.566 60 HA ARG 8 HA ARG 8 -12.179 11.729 -21.013 61 HB2 ARG 8 2HB ARG 8 -12.663 10.229 -22.838 62 HB3 ARG 8 3HB ARG 8 -11.303 11.282 -23.224 63 HG2 ARG 8 2HG ARG 8 -9.721 9.431 -22.729 64 HG3 ARG 8 3HG ARG 8 -11.077 8.356 -22.366 65 HD2 ARG 8 2HD ARG 8 -10.549 9.725 -25.041 66 HD3 ARG 8 3HD ARG 8 -10.118 8.073 -24.632 67 HE ARG 8 HE ARG 8 -12.425 7.436 -24.526 68 HH11 ARG 8 2HH2 ARG 8 -12.057 10.664 -25.856 69 HH12 ARG 8 1HH2 ARG 8 -13.641 10.634 -26.581 70 HH21 ARG 8 1HH1 ARG 8 -14.419 7.475 -25.478 71 HH22 ARG 8 2HH1 ARG 8 -14.933 8.876 -26.370 72 H GLY 9 H GLY 9 -13.966 10.269 -20.680 73 HA2 GLY 9 HA2 GLY 9 -13.917 7.668 -19.704 74 HA3 GLY 9 HA3 GLY 9 -13.687 8.676 -18.274 75 H SER 10 H SER 10 -15.868 7.029 -18.439 76 HA SER 10 HA SER 10 -18.254 8.068 -19.512 77 HB2 SER 10 2HB SER 10 -17.891 6.458 -16.955 78 HB3 SER 10 3HB SER 10 -19.404 6.660 -17.862 79 HG SER 10 HG SER 10 -18.317 4.702 -18.405 80 H ARG 11 H ARG 11 -19.437 9.767 -19.080 81 HA ARG 11 HA ARG 11 -19.982 11.826 -18.351 82 HB2 ARG 11 2HB ARG 11 -21.252 11.927 -16.342 83 HB3 ARG 11 3HB ARG 11 -21.584 10.436 -17.203 84 HG2 ARG 11 2HG ARG 11 -20.302 9.123 -15.629 85 HG3 ARG 11 3HG ARG 11 -19.688 10.567 -14.811 86 HD2 ARG 11 2HD ARG 11 -22.623 9.770 -14.960 87 HD3 ARG 11 3HD ARG 11 -21.540 9.382 -13.610 88 HE ARG 11 HE ARG 11 -21.350 12.160 -13.977 89 HH11 ARG 11 2HH2 ARG 11 -23.875 9.932 -13.010 90 HH12 ARG 11 1HH2 ARG 11 -24.704 11.137 -12.061 91 HH21 ARG 11 1HH1 ARG 11 -22.457 13.650 -12.754 92 HH22 ARG 11 2HH1 ARG 11 -23.912 13.185 -11.922 93 H LEU 12 H LEU 12 -17.114 11.433 -18.167 94 HA LEU 12 HA LEU 12 -16.157 12.833 -15.833 95 HB2 LEU 12 2HB LEU 12 -14.872 11.170 -17.179 96 HB3 LEU 12 3HB LEU 12 -14.836 12.307 -18.526 97 HG LEU 12 HG LEU 12 -13.478 13.887 -17.147 98 HD11 LEU 12 1HD1 LEU 12 -14.181 13.254 -14.873 99 HD12 LEU 12 2HD1 LEU 12 -13.503 11.624 -15.097 100 HD13 LEU 12 3HD1 LEU 12 -12.439 13.047 -15.047 101 HD21 LEU 12 3HD2 LEU 12 -11.413 12.551 -17.158 102 HD22 LEU 12 1HD2 LEU 12 -12.369 11.061 -17.329 103 HD23 LEU 12 2HD2 LEU 12 -12.374 12.291 -18.618 104 H GLY 13 H GLY 13 -17.360 13.956 -18.928 105 HA2 GLY 13 HA2 GLY 13 -17.800 16.122 -19.692 106 HA3 GLY 13 HA3 GLY 13 -17.180 16.776 -18.177 107 H ALA 14 H ALA 14 -15.897 18.359 -19.089 108 HA ALA 14 HA ALA 14 -13.413 17.491 -20.473 109 HB1 ALA 14 3HB ALA 14 -15.000 18.255 -22.211 110 HB2 ALA 14 1HB ALA 14 -15.191 19.805 -21.357 111 HB3 ALA 14 2HB ALA 14 -13.621 19.358 -22.060 112 H VAL 15 H VAL 15 -11.720 19.094 -20.422 113 HA VAL 15 HA VAL 15 -10.193 20.178 -19.162 114 HB VAL 15 HB VAL 15 -12.330 22.285 -18.677 115 HG11 VAL 15 1HG1 VAL 15 -10.062 22.731 -17.703 116 HG12 VAL 15 2HG1 VAL 15 -9.343 22.467 -19.297 117 HG13 VAL 15 3HG1 VAL 15 -10.434 23.841 -19.023 118 HG21 VAL 15 3HG2 VAL 15 -12.547 21.676 -21.041 119 HG22 VAL 15 1HG2 VAL 15 -11.719 23.224 -20.906 120 HG23 VAL 15 2HG2 VAL 15 -10.782 21.754 -21.252 121 H SER 16 H SER 16 -10.641 18.251 -17.862 122 HA SER 16 HA SER 16 -10.644 18.963 -14.994 123 HB2 SER 16 2HB SER 16 -10.012 16.528 -14.842 124 HB3 SER 16 3HB SER 16 -11.642 16.869 -15.444 125 HG SER 16 HG SER 16 -10.532 15.262 -16.681 126 H TYR 17 H TYR 17 -8.718 19.915 -17.229 127 HA TYR 17 HA TYR 17 -6.068 19.301 -16.046 128 HB2 TYR 17 2HB TYR 17 -5.339 18.855 -18.474 129 HB3 TYR 17 3HB TYR 17 -6.246 17.601 -17.655 130 HD1 TYR 17 HD2 TYR 17 -6.555 20.334 -20.211 131 HD2 TYR 17 HD1 TYR 17 -8.364 16.838 -18.441 132 HE1 TYR 17 HE2 TYR 17 -8.284 20.322 -21.993 133 HE2 TYR 17 HE1 TYR 17 -10.108 16.840 -20.216 134 HH TYR 17 HH TYR 17 -10.171 19.297 -22.823 135 H GLU 18 H GLU 18 -4.350 20.666 -16.982 136 HA GLU 18 HA GLU 18 -5.289 23.454 -17.365 137 HB2 GLU 18 2HB GLU 18 -2.532 22.284 -16.844 138 HB3 GLU 18 3HB GLU 18 -2.889 24.005 -17.061 139 HG2 GLU 18 2HG GLU 18 -4.436 23.928 -15.114 140 HG3 GLU 18 3HG GLU 18 -4.036 22.227 -14.864 141 H THR 19 H THR 19 -6.001 23.642 -19.443 142 HA THR 19 HA THR 19 -4.599 22.601 -21.721 143 HB THR 19 HB THR 19 -6.767 24.684 -21.959 144 HG1 THR 19 HG1 THR 19 -8.279 23.115 -21.596 145 HG21 THR 19 1HG2 THR 19 -7.507 23.206 -23.799 146 HG22 THR 19 2HG2 THR 19 -5.812 23.651 -24.029 147 HG23 THR 19 3HG2 THR 19 -6.222 22.040 -23.404 148 H ASP 20 H ASP 20 -2.718 24.100 -20.464 149 HA ASP 20 HA ASP 20 -2.184 26.372 -22.330 150 HB2 ASP 20 2HB ASP 20 -3.003 27.349 -20.253 151 HB3 ASP 20 3HB ASP 20 -1.850 26.390 -19.317 152 H ARG 21 H ARG 21 0.965 25.030 -22.824 153 HA ARG 21 HA ARG 21 -0.889 26.901 -23.967 154 HB2 ARG 21 2HB ARG 21 1.050 24.919 -25.214 155 HB3 ARG 21 3HB ARG 21 0.232 26.186 -26.108 156 HG2 ARG 21 2HG ARG 21 2.139 26.775 -23.791 157 HG3 ARG 21 3HG ARG 21 2.630 26.603 -25.466 158 HD2 ARG 21 2HD ARG 21 2.464 28.883 -25.216 159 HD3 ARG 21 3HD ARG 21 0.971 28.454 -26.059 160 HE ARG 21 HE ARG 21 0.391 28.486 -23.264 161 HH11 ARG 21 1HH2 ARG 21 1.394 30.905 -25.636 162 HH12 ARG 21 2HH2 ARG 21 0.646 32.194 -24.706 163 HH21 ARG 21 1HH1 ARG 21 -0.478 30.081 -22.237 164 HH22 ARG 21 2HH1 ARG 21 -0.364 31.766 -22.813 165 H ASN 22 H ASN 22 -2.161 26.460 -25.939 166 HA ASN 22 HA ASN 22 -4.290 24.705 -25.336 167 HB2 ASN 22 2HB ASN 22 -5.252 25.422 -27.439 168 HB3 ASN 22 3HB ASN 22 -4.523 26.798 -26.625 169 HD21 ASN 22 1HD2 ASN 22 -4.591 24.966 -29.571 170 HD22 ASN 22 2HD2 ASN 22 -3.225 25.787 -30.315 171 H HIS 23 H HIS 23 -5.045 22.788 -26.186 172 HA HIS 23 HA HIS 23 -3.028 20.882 -27.086 173 HB2 HIS 23 2HB HIS 23 -4.769 20.350 -25.417 174 HB3 HIS 23 3HB HIS 23 -6.024 20.604 -26.630 175 HD2 HIS 23 HD2 HIS 23 -2.969 18.249 -25.995 176 HE1 HIS 23 HE1 HIS 23 -5.803 16.077 -28.331 177 HE2 HIS 23 HE2 HIS 23 -3.574 15.936 -27.109 178 H ASP 24 H ASP 24 -5.747 22.553 -28.633 179 HA ASP 24 HA ASP 24 -4.710 21.886 -31.294 180 HB2 ASP 24 2HB ASP 24 -6.492 20.111 -30.385 181 HB3 ASP 24 3HB ASP 24 -7.652 21.361 -30.823 182 H LEU 25 H LEU 25 -6.181 22.935 -32.990 183 HA LEU 25 HA LEU 25 -7.149 25.622 -32.090 184 HB2 LEU 25 2HB LEU 25 -5.868 24.813 -34.723 185 HB3 LEU 25 3HB LEU 25 -6.606 26.381 -34.415 186 HG LEU 25 HG LEU 25 -4.191 25.281 -32.902 187 HD11 LEU 25 1HD1 LEU 25 -4.370 27.400 -35.085 188 HD12 LEU 25 2HD1 LEU 25 -2.905 26.927 -34.191 189 HD13 LEU 25 3HD1 LEU 25 -3.694 25.766 -35.271 190 HD21 LEU 25 3HD2 LEU 25 -5.484 28.048 -32.902 191 HD22 LEU 25 1HD2 LEU 25 -5.439 26.910 -31.536 192 HD23 LEU 25 2HD2 LEU 25 -3.941 27.634 -32.126 193 H ALA 26 H ALA 26 -9.091 26.330 -32.764 194 HA ALA 26 HA ALA 26 -10.751 24.855 -34.685 195 HB1 ALA 26 3HB ALA 26 -11.488 25.121 -31.727 196 HB2 ALA 26 1HB ALA 26 -12.552 24.480 -32.988 197 HB3 ALA 26 2HB ALA 26 -11.073 23.608 -32.560 198 HA PRO 27 HA PRO 27 -12.537 29.018 -34.990 199 HB2 PRO 27 2HB PRO 27 -15.006 28.567 -36.034 200 HB3 PRO 27 3HB PRO 27 -13.506 28.282 -36.955 201 HG2 PRO 27 2HG PRO 27 -15.164 26.235 -35.445 202 HG3 PRO 27 3HG PRO 27 -14.550 26.142 -37.124 203 HD2 PRO 27 2HD PRO 27 -13.243 24.983 -35.030 204 HD3 PRO 27 3HD PRO 27 -12.357 25.704 -36.402 205 H ARG 28 H ARG 28 -12.446 29.463 -32.781 206 HA ARG 28 HA ARG 28 -14.974 29.266 -31.224 207 HB2 ARG 28 2HB ARG 28 -13.861 28.310 -29.322 208 HB3 ARG 28 3HB ARG 28 -13.541 27.298 -30.729 209 HG2 ARG 28 2HG ARG 28 -11.304 28.467 -30.978 210 HG3 ARG 28 3HG ARG 28 -11.645 29.324 -29.476 211 HD2 ARG 28 2HD ARG 28 -11.680 27.215 -28.234 212 HD3 ARG 28 3HD ARG 28 -11.525 26.300 -29.741 213 HE ARG 28 HE ARG 28 -9.418 28.271 -28.942 214 HH11 ARG 28 1HH1 ARG 28 -10.112 24.866 -29.542 215 HH12 ARG 28 2HH1 ARG 28 -8.407 24.511 -29.731 216 HH21 ARG 28 1HH2 ARG 28 -7.294 27.661 -29.193 217 HH22 ARG 28 2HH2 ARG 28 -6.936 25.983 -29.563 218 H GLN 29 H GLN 29 -14.867 30.393 -29.152 219 HA GLN 29 HA GLN 29 -13.391 32.987 -29.131 220 HB2 GLN 29 2HB GLN 29 -16.387 32.710 -28.658 221 HB3 GLN 29 3HB GLN 29 -15.441 34.191 -28.632 222 HG2 GLN 29 2HG GLN 29 -15.871 34.527 -30.805 223 HG3 GLN 29 3HG GLN 29 -15.108 32.996 -31.231 224 HE21 GLN 29 1HE2 GLN 29 -16.725 31.078 -30.173 225 HE22 GLN 29 2HE2 GLN 29 -18.329 31.190 -30.895 226 H ILE 30 H ILE 30 -12.228 32.550 -27.237 227 HA ILE 30 HA ILE 30 -13.593 31.599 -24.825 228 HB ILE 30 HB ILE 30 -10.742 32.551 -25.271 229 HG12 ILE 30 2HG1 ILE 30 -10.155 30.198 -24.911 230 HG13 ILE 30 3HG1 ILE 30 -11.864 29.769 -24.784 231 HG21 ILE 30 1HG2 ILE 30 -12.160 31.352 -22.837 232 HG22 ILE 30 2HG2 ILE 30 -10.400 31.464 -22.996 233 HG23 ILE 30 3HG2 ILE 30 -11.365 32.941 -22.934 234 HD11 ILE 30 3HD1 ILE 30 -12.193 29.994 -27.118 235 HD12 ILE 30 1HD1 ILE 30 -10.634 30.853 -27.331 236 HD13 ILE 30 2HD1 ILE 30 -10.671 29.129 -26.908 237 H ALA 31 H ALA 31 -14.972 32.919 -23.936 238 HA ALA 31 HA ALA 31 -14.239 35.765 -23.400 239 HB1 ALA 31 3HB ALA 31 -16.845 34.213 -23.177 240 HB2 ALA 31 1HB ALA 31 -16.606 35.857 -22.549 241 HB3 ALA 31 2HB ALA 31 -16.449 35.550 -24.286 242 H ARG 32 H ARG 32 -14.529 36.539 -21.232 243 HA ARG 32 HA ARG 32 -14.080 34.518 -19.066 244 HB2 ARG 32 2HB ARG 32 -12.652 37.086 -19.637 245 HB3 ARG 32 3HB ARG 32 -13.131 36.838 -17.953 246 HG2 ARG 32 2HG ARG 32 -12.018 34.723 -17.825 247 HG3 ARG 32 3HG ARG 32 -11.632 34.743 -19.560 248 HD2 ARG 32 2HD ARG 32 -10.145 36.632 -19.244 249 HD3 ARG 32 3HD ARG 32 -10.622 36.788 -17.542 250 HE ARG 32 HE ARG 32 -9.626 34.159 -17.857 251 HH11 ARG 32 2HH1 ARG 32 -8.334 37.390 -18.034 252 HH12 ARG 32 1HH1 ARG 32 -6.727 36.904 -17.565 253 HH21 ARG 32 1HH2 ARG 32 -7.638 33.537 -17.331 254 HH22 ARG 32 2HH2 ARG 32 -6.343 34.720 -17.134 255 H TYR 33 H TYR 33 -15.149 34.840 -17.115 256 HA TYR 33 HA TYR 33 -17.167 36.994 -16.985 257 HB2 TYR 33 2HB TYR 33 -17.821 34.067 -16.555 258 HB3 TYR 33 3HB TYR 33 -18.869 35.406 -16.186 259 HD1 TYR 33 HD1 TYR 33 -17.100 33.720 -19.030 260 HD2 TYR 33 HD2 TYR 33 -20.353 36.235 -17.776 261 HE1 TYR 33 HE1 TYR 33 -18.142 33.505 -21.278 262 HE2 TYR 33 HE2 TYR 33 -21.373 36.061 -20.039 263 HH TYR 33 HH TYR 33 -20.033 33.879 -22.528 264 H ARG 34 H ARG 34 -17.591 37.691 -14.961 265 HA ARG 34 HA ARG 34 -15.941 36.644 -12.694 266 HB2 ARG 34 2HB ARG 34 -15.418 38.908 -13.534 267 HB3 ARG 34 3HB ARG 34 -17.080 39.418 -13.234 268 HG2 ARG 34 2HG ARG 34 -16.821 39.119 -10.841 269 HG3 ARG 34 3HG ARG 34 -15.241 38.351 -11.042 270 HD2 ARG 34 2HD ARG 34 -15.337 40.957 -12.368 271 HD3 ARG 34 3HD ARG 34 -15.828 41.109 -10.689 272 HE ARG 34 HE ARG 34 -13.200 39.994 -11.661 273 HH11 ARG 34 1HH2 ARG 34 -14.861 41.660 -9.038 274 HH12 ARG 34 2HH2 ARG 34 -13.371 41.824 -8.151 275 HH21 ARG 34 1HH1 ARG 34 -11.503 40.224 -10.587 276 HH22 ARG 34 2HH1 ARG 34 -11.454 41.008 -9.004 277 H THR 35 H THR 35 -16.878 35.835 -10.990 278 HA THR 35 HA THR 35 -19.798 35.571 -10.824 279 HB THR 35 HB THR 35 -19.407 34.138 -8.883 280 HG1 THR 35 HG1 THR 35 -16.683 34.547 -9.347 281 HG21 THR 35 1HG2 THR 35 -19.282 33.087 -11.046 282 HG22 THR 35 2HG2 THR 35 -17.552 33.474 -11.189 283 HG23 THR 35 3HG2 THR 35 -18.113 32.377 -9.911 284 H ASP 36 H ASP 36 -20.642 35.683 -8.384 285 HA ASP 36 HA ASP 36 -20.560 38.484 -7.768 286 HB2 ASP 36 2HB ASP 36 -22.595 37.023 -7.644 287 HB3 ASP 36 3HB ASP 36 -21.889 36.199 -6.252 288 H ASN 37 H ASN 37 -18.582 35.863 -6.609 289 HA ASN 37 HA ASN 37 -17.781 37.467 -4.227 290 HB2 ASN 37 2HB ASN 37 -16.373 34.989 -5.042 291 HB3 ASN 37 3HB ASN 37 -16.518 35.721 -3.482 292 HD21 ASN 37 1HD2 ASN 37 -17.023 33.007 -4.510 293 HD22 ASN 37 2HD2 ASN 37 -18.639 32.618 -3.873 294 H GLY 38 H GLY 38 -17.202 37.837 -7.429 295 HA2 GLY 38 HA2 GLY 38 -15.554 39.008 -8.585 296 HA3 GLY 38 HA3 GLY 38 -14.476 38.954 -7.188 297 H GLU 39 H GLU 39 -15.691 35.828 -7.841 298 HA GLU 39 HA GLU 39 -13.013 34.957 -8.613 299 HB2 GLU 39 2HB GLU 39 -15.419 33.149 -8.774 300 HB3 GLU 39 3HB GLU 39 -13.757 32.770 -8.416 301 HG2 GLU 39 2HG GLU 39 -14.323 34.387 -6.290 302 HG3 GLU 39 3HG GLU 39 -15.965 33.870 -6.736 303 H GLU 40 H GLU 40 -12.271 35.124 -10.639 304 HA GLU 40 HA GLU 40 -14.148 35.328 -12.925 305 HB2 GLU 40 2HB GLU 40 -11.243 36.034 -12.498 306 HB3 GLU 40 3HB GLU 40 -11.946 35.938 -14.121 307 HG2 GLU 40 2HG GLU 40 -13.585 37.606 -13.638 308 HG3 GLU 40 3HG GLU 40 -13.194 37.609 -11.918 309 H PHE 41 H PHE 41 -14.446 33.818 -14.390 310 HA PHE 41 HA PHE 41 -12.520 31.552 -14.754 311 HB2 PHE 41 2HB PHE 41 -15.551 31.461 -14.704 312 HB3 PHE 41 3HB PHE 41 -14.527 30.134 -15.199 313 HD1 PHE 41 HD2 PHE 41 -15.577 32.183 -12.225 314 HD2 PHE 41 HD1 PHE 41 -13.349 28.745 -13.628 315 HE1 PHE 41 HE2 PHE 41 -15.272 31.412 -9.932 316 HE2 PHE 41 HE1 PHE 41 -13.021 28.008 -11.291 317 HZ PHE 41 HZ PHE 41 -13.959 29.354 -9.424 318 H GLU 42 H GLU 42 -12.813 30.431 -16.863 319 HA GLU 42 HA GLU 42 -13.427 32.374 -19.042 320 HB2 GLU 42 2HB GLU 42 -11.442 30.095 -19.099 321 HB3 GLU 42 3HB GLU 42 -11.845 31.193 -20.427 322 HG2 GLU 42 2HG GLU 42 -10.429 32.770 -19.754 323 HG3 GLU 42 3HG GLU 42 -11.035 32.732 -18.113 324 H VAL 43 H VAL 43 -14.783 31.783 -20.581 325 HA VAL 43 HA VAL 43 -15.841 28.977 -20.621 326 HB VAL 43 HB VAL 43 -17.438 31.451 -21.216 327 HG11 VAL 43 1HG1 VAL 43 -19.324 29.947 -21.287 328 HG12 VAL 43 2HG1 VAL 43 -18.134 29.388 -22.449 329 HG13 VAL 43 3HG1 VAL 43 -18.293 28.550 -20.891 330 HG21 VAL 43 3HG2 VAL 43 -17.670 29.647 -18.784 331 HG22 VAL 43 1HG2 VAL 43 -16.893 31.245 -18.759 332 HG23 VAL 43 2HG2 VAL 43 -18.591 31.127 -19.162 333 HA PRO 44 HA PRO 44 -14.438 29.523 -24.941 334 HB2 PRO 44 2HB PRO 44 -14.155 26.885 -25.575 335 HB3 PRO 44 3HB PRO 44 -12.946 27.792 -24.622 336 HG2 PRO 44 2HG PRO 44 -15.098 25.934 -23.607 337 HG3 PRO 44 3HG PRO 44 -13.385 26.042 -23.099 338 HD2 PRO 44 2HD PRO 44 -15.479 27.222 -21.747 339 HD3 PRO 44 3HD PRO 44 -13.824 27.904 -21.720 340 H PHE 45 H PHE 45 -15.914 30.056 -26.364 341 HA PHE 45 HA PHE 45 -18.411 28.458 -26.798 342 HB2 PHE 45 2HB PHE 45 -17.659 31.344 -27.344 343 HB3 PHE 45 3HB PHE 45 -19.043 30.609 -28.090 344 HD1 PHE 45 HD2 PHE 45 -17.541 31.712 -24.871 345 HD2 PHE 45 HD1 PHE 45 -21.072 30.134 -26.790 346 HE1 PHE 45 HE2 PHE 45 -18.863 32.178 -22.843 347 HE2 PHE 45 HE1 PHE 45 -22.401 30.639 -24.747 348 HZ PHE 45 HZ PHE 45 -21.287 31.653 -22.760 349 H ALA 46 H ALA 46 -18.933 27.762 -28.867 350 HA ALA 46 HA ALA 46 -16.732 27.633 -30.867 351 HB1 ALA 46 3HB ALA 46 -17.937 25.551 -30.300 352 HB2 ALA 46 1HB ALA 46 -19.472 26.294 -30.810 353 HB3 ALA 46 2HB ALA 46 -18.182 26.002 -31.997 354 H ASP 47 H ASP 47 -17.150 28.260 -33.108 355 HA ASP 47 HA ASP 47 -18.279 30.822 -33.454 356 HB2 ASP 47 2HB ASP 47 -16.508 29.852 -34.823 357 HB3 ASP 47 3HB ASP 47 -17.631 28.664 -35.495 358 H ASP 48 H ASP 48 -19.920 27.772 -33.508 359 HA ASP 48 HA ASP 48 -22.313 28.597 -34.951 360 HB2 ASP 48 2HB ASP 48 -21.484 26.249 -34.665 361 HB3 ASP 48 3HB ASP 48 -21.872 26.356 -32.950 362 H ALA 49 H ALA 49 -21.097 29.400 -31.876 363 HA ALA 49 HA ALA 49 -23.759 30.285 -30.837 364 HB1 ALA 49 3HB ALA 49 -22.853 29.944 -28.591 365 HB2 ALA 49 1HB ALA 49 -22.770 28.433 -29.516 366 HB3 ALA 49 2HB ALA 49 -21.301 29.408 -29.269 367 H GLU 50 H GLU 50 -23.670 32.206 -29.454 368 HA GLU 50 HA GLU 50 -21.357 34.038 -29.862 369 HB2 GLU 50 2HB GLU 50 -24.277 34.696 -30.385 370 HB3 GLU 50 3HB GLU 50 -23.066 35.931 -30.015 371 HG2 GLU 50 2HG GLU 50 -21.712 35.270 -31.942 372 HG3 GLU 50 3HG GLU 50 -22.837 33.968 -32.320 373 H ILE 51 H ILE 51 -20.839 35.230 -28.199 374 HA ILE 51 HA ILE 51 -21.248 34.389 -25.619 375 HB ILE 51 HB ILE 51 -20.319 37.187 -26.239 376 HG12 ILE 51 2HG1 ILE 51 -19.152 35.737 -27.848 377 HG13 ILE 51 3HG1 ILE 51 -18.065 36.403 -26.636 378 HG21 ILE 51 1HG2 ILE 51 -19.438 35.186 -24.119 379 HG22 ILE 51 2HG2 ILE 51 -18.863 36.836 -24.326 380 HG23 ILE 51 3HG2 ILE 51 -20.534 36.541 -23.823 381 HD11 ILE 51 3HD1 ILE 51 -17.987 34.215 -25.488 382 HD12 ILE 51 1HD1 ILE 51 -19.155 33.564 -26.671 383 HD13 ILE 51 2HD1 ILE 51 -17.537 34.075 -27.184 384 HA PRO 52 HA PRO 52 -25.014 36.768 -24.551 385 HB2 PRO 52 2HB PRO 52 -25.590 35.336 -22.293 386 HB3 PRO 52 3HB PRO 52 -26.020 34.783 -23.941 387 HG2 PRO 52 2HG PRO 52 -23.703 33.938 -22.201 388 HG3 PRO 52 3HG PRO 52 -24.753 32.931 -23.258 389 HD2 PRO 52 2HD PRO 52 -22.218 33.905 -23.929 390 HD3 PRO 52 3HD PRO 52 -23.435 33.436 -25.121 391 H GLY 53 H GLY 53 -25.280 38.346 -22.955 392 HA2 GLY 53 HA2 GLY 53 -23.183 39.704 -21.785 393 HA3 GLY 53 HA3 GLY 53 -24.845 39.763 -21.187 394 H THR 54 H THR 54 -24.851 36.904 -20.307 395 HA THR 54 HA THR 54 -22.659 36.761 -18.369 396 HB THR 54 HB THR 54 -24.275 36.180 -16.512 397 HG1 THR 54 HG1 THR 54 -26.495 36.529 -16.866 398 HG21 THR 54 1HG2 THR 54 -25.212 38.317 -15.993 399 HG22 THR 54 2HG2 THR 54 -23.695 38.612 -16.846 400 HG23 THR 54 3HG2 THR 54 -25.222 38.813 -17.704 401 H TRP 55 H TRP 55 -22.480 34.658 -17.245 402 HA TRP 55 HA TRP 55 -23.828 32.334 -18.400 403 HB2 TRP 55 2HB TRP 55 -22.024 33.023 -20.063 404 HB3 TRP 55 3HB TRP 55 -20.839 32.670 -18.817 405 HD1 TRP 55 HD1 TRP 55 -20.327 30.155 -18.291 406 HE1 TRP 55 HE1 TRP 55 -20.655 28.006 -19.615 407 HE3 TRP 55 HE3 TRP 55 -23.927 31.779 -21.502 408 HZ2 TRP 55 HZ2 TRP 55 -22.418 27.037 -21.720 409 HZ3 TRP 55 HZ3 TRP 55 -24.950 30.221 -23.160 410 HH2 TRP 55 HH2 TRP 55 -24.195 27.854 -23.279 411 H LEU 56 H LEU 56 -23.500 30.413 -17.175 412 HA LEU 56 HA LEU 56 -22.790 30.827 -14.427 413 HB2 LEU 56 2HB LEU 56 -24.412 29.073 -15.829 414 HB3 LEU 56 3HB LEU 56 -23.062 28.041 -15.350 415 HG LEU 56 HG LEU 56 -24.635 29.783 -13.413 416 HD11 LEU 56 1HD1 LEU 56 -26.110 28.096 -14.439 417 HD12 LEU 56 2HD1 LEU 56 -24.947 26.813 -14.037 418 HD13 LEU 56 3HD1 LEU 56 -25.788 27.703 -12.745 419 HD21 LEU 56 3HD2 LEU 56 -22.417 29.125 -12.566 420 HD22 LEU 56 1HD2 LEU 56 -23.685 28.249 -11.707 421 HD23 LEU 56 2HD2 LEU 56 -22.739 27.431 -12.972 422 H CYS 57 H CYS 57 -20.940 30.579 -13.412 423 HA CYS 57 HA CYS 57 -18.547 29.627 -14.890 424 HB2 CYS 57 2HB CYS 57 -18.957 31.325 -12.404 425 HB3 CYS 57 3HB CYS 57 -17.369 30.770 -12.951 426 HG CYS 57 HG CYS 57 -19.603 32.331 -14.829 427 H ARG 58 H ARG 58 -16.863 28.454 -13.700 428 HA ARG 58 HA ARG 58 -17.953 25.984 -12.744 429 HB2 ARG 58 2HB ARG 58 -15.033 26.835 -12.682 430 HB3 ARG 58 3HB ARG 58 -15.671 25.195 -12.632 431 HG2 ARG 58 2HG ARG 58 -16.669 25.596 -14.946 432 HG3 ARG 58 3HG ARG 58 -15.815 27.146 -14.970 433 HD2 ARG 58 2HD ARG 58 -14.442 25.656 -16.161 434 HD3 ARG 58 3HD ARG 58 -13.654 25.886 -14.590 435 HE ARG 58 HE ARG 58 -15.369 23.597 -14.450 436 HH11 ARG 58 1HH2 ARG 58 -12.325 24.475 -15.989 437 HH12 ARG 58 2HH2 ARG 58 -11.849 22.785 -16.112 438 HH21 ARG 58 1HH1 ARG 58 -14.616 21.481 -14.688 439 HH22 ARG 58 2HH1 ARG 58 -13.063 21.229 -15.462 440 H ASN 59 H ASN 59 -17.170 28.768 -10.928 441 HA ASN 59 HA ASN 59 -16.819 27.535 -8.358 442 HB2 ASN 59 2HB ASN 59 -16.218 29.822 -8.789 443 HB3 ASN 59 3HB ASN 59 -17.879 30.237 -9.237 444 HD21 ASN 59 1HD2 ASN 59 -17.908 31.947 -7.705 445 HD22 ASN 59 2HD2 ASN 59 -17.888 31.617 -5.984 446 H GLY 60 H GLY 60 -19.567 27.815 -10.438 447 HA2 GLY 60 HA2 GLY 60 -21.664 26.784 -10.173 448 HA3 GLY 60 HA3 GLY 60 -21.461 26.737 -8.419 449 H MET 61 H MET 61 -20.663 29.785 -9.895 450 HA MET 61 HA MET 61 -23.318 30.919 -9.169 451 HB2 MET 61 2HB MET 61 -21.361 31.514 -7.658 452 HB3 MET 61 3HB MET 61 -20.625 32.334 -9.012 453 HG2 MET 61 2HG MET 61 -21.840 33.877 -7.513 454 HG3 MET 61 3HG MET 61 -22.452 33.919 -9.163 455 HE1 MET 61 3HE MET 61 -24.091 35.256 -6.750 456 HE2 MET 61 1HE MET 61 -24.559 35.231 -8.469 457 HE3 MET 61 2HE MET 61 -25.716 34.724 -7.220 458 H GLU 62 H GLU 62 -24.182 32.533 -10.476 459 HA GLU 62 HA GLU 62 -23.601 32.520 -13.306 460 HB2 GLU 62 2HB GLU 62 -25.255 34.350 -11.533 461 HB3 GLU 62 3HB GLU 62 -25.151 34.547 -13.277 462 HG2 GLU 62 2HG GLU 62 -26.140 32.015 -11.892 463 HG3 GLU 62 3HG GLU 62 -27.179 33.324 -12.441 464 H GLY 63 H GLY 63 -21.797 33.289 -14.141 465 HA2 GLY 63 HA2 GLY 63 -20.355 35.562 -12.960 466 HA3 GLY 63 HA3 GLY 63 -19.791 34.567 -14.285 467 H THR 64 H THR 64 -20.073 37.543 -14.025 468 HA THR 64 HA THR 64 -21.752 38.014 -16.452 469 HB THR 64 HB THR 64 -20.593 40.037 -14.503 470 HG1 THR 64 HG1 THR 64 -22.298 38.853 -13.615 471 HG21 THR 64 1HG2 THR 64 -22.435 40.386 -16.914 472 HG22 THR 64 2HG2 THR 64 -22.272 41.600 -15.624 473 HG23 THR 64 3HG2 THR 64 -20.872 41.166 -16.608 474 H LEU 65 H LEU 65 -20.934 38.863 -18.293 475 HA LEU 65 HA LEU 65 -18.292 38.187 -18.996 476 HB2 LEU 65 2HB LEU 65 -20.361 38.313 -20.431 477 HB3 LEU 65 3HB LEU 65 -20.300 40.061 -20.321 478 HG LEU 65 HG LEU 65 -17.943 39.857 -21.440 479 HD11 LEU 65 1HD1 LEU 65 -17.567 37.861 -22.740 480 HD12 LEU 65 2HD1 LEU 65 -17.578 37.488 -21.016 481 HD13 LEU 65 3HD1 LEU 65 -18.990 37.078 -21.988 482 HD21 LEU 65 3HD2 LEU 65 -19.966 40.612 -22.650 483 HD22 LEU 65 1HD2 LEU 65 -18.946 39.600 -23.685 484 HD23 LEU 65 2HD2 LEU 65 -20.419 38.921 -22.956 485 H ILE 66 H ILE 66 -16.406 39.183 -18.652 486 HA ILE 66 HA ILE 66 -16.272 42.152 -18.435 487 HB ILE 66 HB ILE 66 -14.648 42.110 -16.720 488 HG12 ILE 66 2HG1 ILE 66 -13.363 40.129 -16.977 489 HG13 ILE 66 3HG1 ILE 66 -14.078 40.077 -15.370 490 HG21 ILE 66 1HG2 ILE 66 -15.960 41.491 -14.813 491 HG22 ILE 66 2HG2 ILE 66 -17.022 42.161 -16.067 492 HG23 ILE 66 3HG2 ILE 66 -16.965 40.411 -15.787 493 HD11 ILE 66 3HD1 ILE 66 -14.749 38.468 -17.760 494 HD12 ILE 66 1HD1 ILE 66 -14.194 37.916 -16.169 495 HD13 ILE 66 2HD1 ILE 66 -15.841 38.561 -16.351 496 H GLU 67 H GLU 67 -14.321 43.147 -19.006 497 HA GLU 67 HA GLU 67 -12.301 41.536 -20.477 498 HB2 GLU 67 2HB GLU 67 -13.685 44.052 -21.492 499 HB3 GLU 67 3HB GLU 67 -12.179 43.405 -22.146 500 HG2 GLU 67 2HG GLU 67 -13.331 41.280 -22.725 501 HG3 GLU 67 3HG GLU 67 -14.852 41.940 -22.113 502 H GLY 68 H GLY 68 -10.293 42.060 -19.950 503 HA2 GLY 68 HA2 GLY 68 -9.197 44.613 -19.547 504 HA3 GLY 68 HA3 GLY 68 -9.607 44.013 -17.934 505 H ASP 69 H ASP 69 -9.068 41.228 -18.504 506 HA ASP 69 HA ASP 69 -6.345 40.990 -19.576 507 HB2 ASP 69 2HB ASP 69 -6.082 41.246 -17.091 508 HB3 ASP 69 3HB ASP 69 -7.148 39.860 -16.852 509 H LEU 70 H LEU 70 -6.358 39.285 -20.943 510 HA LEU 70 HA LEU 70 -8.525 37.232 -20.788 511 HB2 LEU 70 2HB LEU 70 -7.553 38.766 -23.222 512 HB3 LEU 70 3HB LEU 70 -8.641 37.386 -23.296 513 HG LEU 70 HG LEU 70 -9.314 39.975 -21.834 514 HD11 LEU 70 1HD1 LEU 70 -10.728 40.493 -23.760 515 HD12 LEU 70 2HD1 LEU 70 -9.030 40.360 -24.247 516 HD13 LEU 70 3HD1 LEU 70 -10.160 39.032 -24.597 517 HD21 LEU 70 3HD2 LEU 70 -11.642 39.114 -21.985 518 HD22 LEU 70 1HD2 LEU 70 -11.032 37.594 -22.674 519 HD23 LEU 70 2HD2 LEU 70 -10.617 38.063 -21.008 520 HA PRO 71 HA PRO 71 -5.260 34.304 -21.410 521 HB2 PRO 71 2HB PRO 71 -6.557 32.074 -22.234 522 HB3 PRO 71 3HB PRO 71 -6.858 32.813 -20.634 523 HG2 PRO 71 2HG PRO 71 -8.463 33.237 -23.183 524 HG3 PRO 71 3HG PRO 71 -9.061 32.753 -21.564 525 HD2 PRO 71 2HD PRO 71 -9.089 35.345 -22.396 526 HD3 PRO 71 3HD PRO 71 -8.752 34.912 -20.694 527 H GLU 72 H GLU 72 -4.548 35.872 -23.060 528 HA GLU 72 HA GLU 72 -3.823 36.605 -25.103 529 HB2 GLU 72 2HB GLU 72 -3.015 33.718 -24.855 530 HB3 GLU 72 3HB GLU 72 -2.271 34.818 -26.035 531 HG2 GLU 72 2HG GLU 72 -1.293 36.161 -24.342 532 HG3 GLU 72 3HG GLU 72 -2.278 35.445 -23.065 533 HA PRO 73 HA PRO 73 -6.612 35.071 -28.412 534 HB2 PRO 73 2HB PRO 73 -8.854 36.505 -28.283 535 HB3 PRO 73 3HB PRO 73 -8.585 35.154 -27.141 536 HG2 PRO 73 2HG PRO 73 -8.131 38.122 -26.634 537 HG3 PRO 73 3HG PRO 73 -9.020 36.945 -25.621 538 HD2 PRO 73 2HD PRO 73 -6.335 37.625 -25.251 539 HD3 PRO 73 3HD PRO 73 -7.073 36.073 -24.755 540 H LYS 74 H LYS 74 -4.449 36.363 -28.661 541 HA LYS 74 HA LYS 74 -4.718 38.371 -30.727 542 HB2 LYS 74 2HB LYS 74 -5.082 39.662 -28.477 543 HB3 LYS 74 3HB LYS 74 -3.375 39.373 -28.165 544 HG2 LYS 74 2HG LYS 74 -2.756 40.677 -30.142 545 HG3 LYS 74 3HG LYS 74 -4.444 40.727 -30.682 546 HD2 LYS 74 2HD LYS 74 -5.024 42.081 -28.671 547 HD3 LYS 74 3HD LYS 74 -3.310 42.075 -28.191 548 HE2 LYS 74 2HE LYS 74 -2.693 43.180 -30.313 549 HE3 LYS 74 3HE LYS 74 -4.369 43.096 -30.869 550 HZ1 LYS 74 HZ1 LYS 74 -3.894 45.286 -29.996 551 HZ2 LYS 74 HZ2 LYS 74 -4.975 44.573 -29.008 552 HZ3 LYS 74 HZ3 LYS 74 -3.400 44.702 -28.557 553 H LYS 75 H LYS 75 -2.622 38.989 -31.607 554 HA LYS 75 HA LYS 75 -0.352 37.178 -31.289 555 HB2 LYS 75 2HB LYS 75 0.782 38.651 -32.827 556 HB3 LYS 75 3HB LYS 75 -0.850 38.349 -33.407 557 HG2 LYS 75 2HG LYS 75 -1.567 40.584 -32.533 558 HG3 LYS 75 3HG LYS 75 0.091 40.878 -31.971 559 HD2 LYS 75 2HD LYS 75 0.919 40.680 -34.302 560 HD3 LYS 75 3HD LYS 75 -0.739 40.379 -34.864 561 HE2 LYS 75 2HE LYS 75 -1.430 42.605 -33.978 562 HE3 LYS 75 3HE LYS 75 0.235 42.907 -33.455 563 HZ1 LYS 75 HZ1 LYS 75 -0.618 42.480 -36.273 564 HZ2 LYS 75 HZ2 LYS 75 -0.213 43.919 -35.621 565 HZ3 LYS 75 HZ3 LYS 75 0.920 42.758 -35.795 566 H VAL 76 H VAL 76 1.864 38.334 -30.890 567 HA VAL 76 HA VAL 76 1.903 39.101 -28.092 568 HB VAL 76 HB VAL 76 4.388 39.105 -28.378 569 HG11 VAL 76 1HG1 VAL 76 4.534 36.675 -28.548 570 HG12 VAL 76 2HG1 VAL 76 3.123 37.151 -27.592 571 HG13 VAL 76 3HG1 VAL 76 2.912 36.595 -29.267 572 HG21 VAL 76 3HG2 VAL 76 5.389 38.139 -30.363 573 HG22 VAL 76 1HG2 VAL 76 3.817 37.964 -31.158 574 HG23 VAL 76 2HG2 VAL 76 4.492 39.579 -30.857 575 H LYS 77 H LYS 77 0.515 41.000 -28.697 576 HA LYS 77 HA LYS 77 2.145 43.482 -28.780 577 HB2 LYS 77 2HB LYS 77 1.204 42.907 -31.069 578 HB3 LYS 77 3HB LYS 77 -0.408 42.988 -30.375 579 HG2 LYS 77 2HG LYS 77 -0.054 45.022 -31.522 580 HG3 LYS 77 3HG LYS 77 0.046 45.426 -29.811 581 HD2 LYS 77 2HD LYS 77 2.574 45.364 -30.004 582 HD3 LYS 77 3HD LYS 77 2.395 44.992 -31.727 583 HE2 LYS 77 2HE LYS 77 1.146 47.122 -32.050 584 HE3 LYS 77 3HE LYS 77 1.336 47.497 -30.334 585 HZ1 LYS 77 HZ1 LYS 77 3.575 47.183 -32.268 586 HZ2 LYS 77 HZ2 LYS 77 3.032 48.602 -31.676 587 HZ3 LYS 77 HZ3 LYS 77 3.756 47.530 -30.681 588 HA PRO 78 HA PRO 78 -0.049 44.366 -25.096 589 HB2 PRO 78 2HB PRO 78 -0.364 47.170 -26.191 590 HB3 PRO 78 3HB PRO 78 0.034 46.656 -24.516 591 HG2 PRO 78 2HG PRO 78 2.033 47.361 -26.177 592 HG3 PRO 78 3HG PRO 78 2.200 45.861 -25.204 593 HD2 PRO 78 2HD PRO 78 1.416 46.154 -28.105 594 HD3 PRO 78 3HD PRO 78 2.535 44.977 -27.347 595 HA PRO 79 HA PRO 79 -1.551 44.938 -23.402 596 HB2 PRO 79 2HB PRO 79 -3.583 43.781 -22.043 597 HB3 PRO 79 3HB PRO 79 -3.736 45.415 -22.753 598 HG2 PRO 79 2HG PRO 79 -4.641 42.779 -23.975 599 HG3 PRO 79 3HG PRO 79 -5.614 44.266 -23.725 600 HD2 PRO 79 2HD PRO 79 -4.367 43.723 -26.099 601 HD3 PRO 79 3HD PRO 79 -4.520 45.392 -25.477 602 H ARG 80 H ARG 80 -1.510 42.445 -25.550 603 HA ARG 80 HA ARG 80 -0.558 40.386 -23.584 604 HB2 ARG 80 2HB ARG 80 -1.594 39.948 -26.400 605 HB3 ARG 80 3HB ARG 80 -1.123 38.698 -25.257 606 HG2 ARG 80 2HG ARG 80 -3.533 40.551 -24.902 607 HG3 ARG 80 3HG ARG 80 -3.568 38.935 -25.578 608 HD2 ARG 80 2HD ARG 80 -4.290 38.715 -23.347 609 HD3 ARG 80 3HD ARG 80 -2.655 38.033 -23.403 610 HE ARG 80 HE ARG 80 -2.278 40.681 -22.666 611 HH11 ARG 80 2HH2 ARG 80 -4.116 38.056 -21.123 612 HH12 ARG 80 1HH2 ARG 80 -3.859 38.834 -19.559 613 HH21 ARG 80 1HH1 ARG 80 -2.153 41.500 -20.665 614 HH22 ARG 80 2HH1 ARG 80 -2.953 40.643 -19.327 Start of MODEL 34 1 H1 SER 1 1H SER 1 22.321 36.490 -24.343 2 H2 SER 1 2H SER 1 22.753 34.907 -24.418 3 H3 SER 1 3H SER 1 22.622 35.654 -22.965 4 HA SER 1 HA SER 1 20.402 35.179 -24.836 5 HB2 SER 1 2HB SER 1 21.008 33.733 -22.229 6 HB3 SER 1 3HB SER 1 19.629 33.450 -23.312 7 HG SER 1 HG SER 1 21.361 31.975 -23.680 8 H MET 2 H MET 2 18.374 35.853 -24.158 9 HA MET 2 HA MET 2 18.213 37.604 -21.710 10 HB2 MET 2 2HB MET 2 17.060 38.138 -24.478 11 HB3 MET 2 3HB MET 2 16.694 39.075 -23.024 12 HG2 MET 2 2HG MET 2 19.090 39.657 -22.791 13 HG3 MET 2 3HG MET 2 19.446 38.768 -24.277 14 HE1 MET 2 3HE MET 2 19.967 42.505 -25.334 15 HE2 MET 2 1HE MET 2 20.326 41.779 -23.751 16 HE3 MET 2 2HE MET 2 20.694 40.885 -25.244 17 H ALA 3 H ALA 3 16.269 35.675 -24.026 18 HA ALA 3 HA ALA 3 14.187 35.299 -21.917 19 HB1 ALA 3 3HB ALA 3 13.658 37.089 -23.533 20 HB2 ALA 3 1HB ALA 3 13.808 35.908 -24.866 21 HB3 ALA 3 2HB ALA 3 12.523 35.734 -23.649 22 H ASP 4 H ASP 4 14.817 31.921 -23.962 23 HA ASP 4 HA ASP 4 17.069 33.543 -23.236 24 HB2 ASP 4 2HB ASP 4 16.740 31.052 -24.934 25 HB3 ASP 4 3HB ASP 4 18.297 31.768 -24.533 26 H ARG 5 H ARG 5 15.153 33.376 -26.168 27 HA ARG 5 HA ARG 5 17.033 35.227 -27.569 28 HB2 ARG 5 2HB ARG 5 16.899 33.919 -29.612 29 HB3 ARG 5 3HB ARG 5 17.576 32.970 -28.295 30 HG2 ARG 5 2HG ARG 5 15.371 31.845 -27.964 31 HG3 ARG 5 3HG ARG 5 14.701 32.752 -29.323 32 HD2 ARG 5 2HD ARG 5 17.074 30.844 -29.469 33 HD3 ARG 5 3HD ARG 5 15.404 30.425 -29.884 34 HE ARG 5 HE ARG 5 16.054 32.680 -31.439 35 HH11 ARG 5 1HH1 ARG 5 17.135 29.354 -31.252 36 HH12 ARG 5 2HH1 ARG 5 17.604 29.317 -32.930 37 HH21 ARG 5 1HH2 ARG 5 16.680 32.568 -33.570 38 HH22 ARG 5 2HH2 ARG 5 17.345 31.091 -34.201 39 H VAL 6 H VAL 6 16.222 36.419 -29.282 40 HA VAL 6 HA VAL 6 14.842 37.967 -30.153 41 HB VAL 6 HB VAL 6 12.751 35.841 -30.566 42 HG11 VAL 6 1HG1 VAL 6 14.020 37.921 -32.422 43 HG12 VAL 6 2HG1 VAL 6 12.696 36.816 -32.845 44 HG13 VAL 6 3HG1 VAL 6 12.430 38.080 -31.653 45 HG21 VAL 6 3HG2 VAL 6 14.793 34.583 -30.953 46 HG22 VAL 6 1HG2 VAL 6 14.076 34.986 -32.504 47 HG23 VAL 6 2HG2 VAL 6 15.480 35.910 -31.923 48 H LEU 7 H LEU 7 14.535 37.762 -27.270 49 HA LEU 7 HA LEU 7 13.291 38.295 -25.485 50 HB2 LEU 7 2HB LEU 7 11.690 40.041 -27.367 51 HB3 LEU 7 3HB LEU 7 11.761 40.179 -25.617 52 HG LEU 7 HG LEU 7 14.095 40.651 -27.521 53 HD11 LEU 7 1HD1 LEU 7 12.355 42.399 -27.585 54 HD12 LEU 7 2HD1 LEU 7 12.457 42.574 -25.820 55 HD13 LEU 7 3HD1 LEU 7 13.848 42.994 -26.843 56 HD21 LEU 7 3HD2 LEU 7 15.252 41.551 -25.505 57 HD22 LEU 7 1HD2 LEU 7 13.919 40.959 -24.489 58 HD23 LEU 7 2HD2 LEU 7 14.956 39.818 -25.378 59 H ARG 8 H ARG 8 12.143 36.126 -27.465 60 HA ARG 8 HA ARG 8 9.568 35.582 -26.041 61 HB2 ARG 8 2HB ARG 8 9.990 36.007 -29.021 62 HB3 ARG 8 3HB ARG 8 8.622 35.075 -28.425 63 HG2 ARG 8 2HG ARG 8 7.554 36.853 -27.433 64 HG3 ARG 8 3HG ARG 8 9.002 37.841 -27.291 65 HD2 ARG 8 2HD ARG 8 7.751 37.152 -29.967 66 HD3 ARG 8 3HD ARG 8 7.371 38.607 -29.023 67 HE ARG 8 HE ARG 8 10.239 38.227 -29.422 68 HH11 ARG 8 1HH2 ARG 8 7.443 39.648 -31.001 69 HH12 ARG 8 2HH2 ARG 8 8.426 40.830 -31.826 70 HH21 ARG 8 2HH1 ARG 8 11.375 39.692 -30.427 71 HH22 ARG 8 1HH1 ARG 8 10.641 40.851 -31.518 72 H GLY 9 H GLY 9 12.038 34.338 -25.636 73 HA2 GLY 9 HA2 GLY 9 12.105 31.777 -27.072 74 HA3 GLY 9 HA3 GLY 9 13.199 32.319 -25.807 75 H SER 10 H SER 10 10.134 32.741 -24.562 76 HA SER 10 HA SER 10 10.431 30.637 -22.650 77 HB2 SER 10 2HB SER 10 9.392 32.804 -22.157 78 HB3 SER 10 3HB SER 10 8.027 32.407 -23.222 79 HG SER 10 HG SER 10 7.783 31.974 -20.877 80 H ARG 11 H ARG 11 9.035 28.943 -22.123 81 HA ARG 11 HA ARG 11 7.906 27.351 -24.320 82 HB2 ARG 11 2HB ARG 11 9.198 26.440 -22.362 83 HB3 ARG 11 3HB ARG 11 7.855 26.887 -21.305 84 HG2 ARG 11 2HG ARG 11 6.377 25.290 -22.471 85 HG3 ARG 11 3HG ARG 11 7.630 24.985 -23.684 86 HD2 ARG 11 2HD ARG 11 7.595 23.150 -22.131 87 HD3 ARG 11 3HD ARG 11 9.102 24.054 -21.914 88 HE ARG 11 HE ARG 11 7.047 24.986 -20.098 89 HH11 ARG 11 1HH2 ARG 11 9.275 22.306 -20.464 90 HH12 ARG 11 2HH2 ARG 11 9.319 21.990 -18.750 91 HH21 ARG 11 1HH1 ARG 11 7.158 24.536 -17.924 92 HH22 ARG 11 2HH1 ARG 11 8.145 23.221 -17.357 93 H LEU 12 H LEU 12 6.702 29.818 -22.273 94 HA LEU 12 HA LEU 12 3.969 29.108 -21.983 95 HB2 LEU 12 2HB LEU 12 5.150 30.919 -20.764 96 HB3 LEU 12 3HB LEU 12 5.310 31.828 -22.266 97 HG LEU 12 HG LEU 12 2.823 32.056 -22.381 98 HD11 LEU 12 1HD1 LEU 12 2.890 30.762 -19.617 99 HD12 LEU 12 2HD1 LEU 12 1.484 31.559 -20.354 100 HD13 LEU 12 3HD1 LEU 12 2.124 30.075 -21.065 101 HD21 LEU 12 3HD2 LEU 12 4.220 33.800 -21.343 102 HD22 LEU 12 1HD2 LEU 12 2.638 33.683 -20.557 103 HD23 LEU 12 2HD2 LEU 12 4.075 32.990 -19.768 104 H GLY 13 H GLY 13 2.160 29.421 -23.226 105 HA2 GLY 13 HA2 GLY 13 2.370 29.505 -26.095 106 HA3 GLY 13 HA3 GLY 13 0.892 29.407 -25.140 107 H ALA 14 H ALA 14 3.379 31.982 -25.255 108 HA ALA 14 HA ALA 14 1.357 34.081 -25.408 109 HB1 ALA 14 3HB ALA 14 4.397 34.198 -25.295 110 HB2 ALA 14 1HB ALA 14 3.285 35.566 -25.074 111 HB3 ALA 14 2HB ALA 14 3.290 34.237 -23.903 112 H VAL 15 H VAL 15 0.858 32.797 -27.613 113 HA VAL 15 HA VAL 15 2.396 33.562 -29.948 114 HB VAL 15 HB VAL 15 0.645 32.497 -31.250 115 HG11 VAL 15 1HG1 VAL 15 1.291 30.838 -28.774 116 HG12 VAL 15 2HG1 VAL 15 0.892 30.240 -30.391 117 HG13 VAL 15 3HG1 VAL 15 2.401 31.127 -30.129 118 HG21 VAL 15 3HG2 VAL 15 -1.380 33.152 -30.001 119 HG22 VAL 15 1HG2 VAL 15 -1.291 31.399 -30.194 120 HG23 VAL 15 2HG2 VAL 15 -0.883 32.132 -28.633 121 H SER 16 H SER 16 1.682 34.806 -31.752 122 HA SER 16 HA SER 16 -0.283 36.961 -31.193 123 HB2 SER 16 2HB SER 16 2.138 37.549 -30.505 124 HB3 SER 16 3HB SER 16 2.471 37.648 -32.241 125 HG SER 16 HG SER 16 1.845 39.674 -31.316 126 H TYR 17 H TYR 17 -0.511 34.706 -32.895 127 HA TYR 17 HA TYR 17 -1.050 35.860 -35.536 128 HB2 TYR 17 2HB TYR 17 0.388 34.101 -36.655 129 HB3 TYR 17 3HB TYR 17 1.264 35.390 -35.864 130 HD1 TYR 17 HD2 TYR 17 0.417 31.783 -35.710 131 HD2 TYR 17 HD1 TYR 17 2.645 35.007 -33.904 132 HE1 TYR 17 HE2 TYR 17 1.715 30.137 -34.367 133 HE2 TYR 17 HE1 TYR 17 3.890 33.367 -32.503 134 HH TYR 17 HH TYR 17 3.361 29.827 -32.800 135 H GLU 18 H GLU 18 -1.975 34.137 -37.015 136 HA GLU 18 HA GLU 18 -4.135 32.802 -35.645 137 HB2 GLU 18 2HB GLU 18 -4.325 33.881 -37.858 138 HB3 GLU 18 3HB GLU 18 -3.279 32.641 -38.559 139 HG2 GLU 18 2HG GLU 18 -4.942 30.894 -37.923 140 HG3 GLU 18 3HG GLU 18 -5.952 32.130 -37.174 141 H THR 19 H THR 19 -3.655 31.134 -34.371 142 HA THR 19 HA THR 19 -2.799 28.594 -35.552 143 HB THR 19 HB THR 19 -0.675 29.749 -34.861 144 HG1 THR 19 HG1 THR 19 -0.554 27.611 -34.993 145 HG21 THR 19 1HG2 THR 19 -0.047 29.833 -32.523 146 HG22 THR 19 2HG2 THR 19 -1.458 30.868 -32.788 147 HG23 THR 19 3HG2 THR 19 -1.650 29.277 -32.012 148 H ASP 20 H ASP 20 -2.914 26.818 -33.805 149 HA ASP 20 HA ASP 20 -4.723 27.357 -31.568 150 HB2 ASP 20 2HB ASP 20 -6.224 26.917 -33.548 151 HB3 ASP 20 3HB ASP 20 -5.509 25.309 -33.672 152 H ARG 21 H ARG 21 -4.842 25.618 -30.069 153 HA ARG 21 HA ARG 21 -2.507 23.726 -30.106 154 HB2 ARG 21 2HB ARG 21 -1.865 25.956 -29.240 155 HB3 ARG 21 3HB ARG 21 -3.073 25.835 -27.970 156 HG2 ARG 21 2HG ARG 21 -1.017 23.630 -28.175 157 HG3 ARG 21 3HG ARG 21 -0.461 25.223 -27.664 158 HD2 ARG 21 2HD ARG 21 -2.037 25.278 -25.814 159 HD3 ARG 21 3HD ARG 21 -2.720 23.716 -26.293 160 HE ARG 21 HE ARG 21 0.061 23.342 -25.966 161 HH11 ARG 21 1HH1 ARG 21 -2.656 24.088 -23.881 162 HH12 ARG 21 2HH1 ARG 21 -1.918 23.327 -22.498 163 HH21 ARG 21 2HH2 ARG 21 0.947 22.401 -24.161 164 HH22 ARG 21 1HH2 ARG 21 0.070 22.403 -22.658 165 H ASN 22 H ASN 22 -5.783 24.246 -29.070 166 HA ASN 22 HA ASN 22 -5.710 21.703 -27.513 167 HB2 ASN 22 2HB ASN 22 -5.526 23.640 -25.966 168 HB3 ASN 22 3HB ASN 22 -7.014 24.314 -26.635 169 HD21 ASN 22 2HD2 ASN 22 -5.793 21.242 -25.134 170 HD22 ASN 22 1HD2 ASN 22 -7.272 20.979 -24.225 171 H HIS 23 H HIS 23 -7.553 20.471 -27.500 172 HA HIS 23 HA HIS 23 -9.142 19.298 -28.616 173 HB2 HIS 23 2HB HIS 23 -10.472 21.950 -29.235 174 HB3 HIS 23 3HB HIS 23 -11.221 20.361 -29.236 175 HD2 HIS 23 HD2 HIS 23 -10.383 19.184 -26.449 176 HE1 HIS 23 HE1 HIS 23 -12.121 22.691 -24.758 177 HE2 HIS 23 HE2 HIS 23 -11.358 20.310 -24.277 178 H ASP 24 H ASP 24 -10.580 19.567 -30.948 179 HA ASP 24 HA ASP 24 -8.580 19.323 -33.051 180 HB2 ASP 24 2HB ASP 24 -10.462 18.906 -34.505 181 HB3 ASP 24 3HB ASP 24 -10.578 17.929 -33.051 182 H LEU 25 H LEU 25 -8.595 20.590 -35.021 183 HA LEU 25 HA LEU 25 -8.357 23.405 -34.362 184 HB2 LEU 25 2HB LEU 25 -7.764 21.760 -36.844 185 HB3 LEU 25 3HB LEU 25 -7.683 23.517 -36.836 186 HG LEU 25 HG LEU 25 -6.023 23.446 -34.973 187 HD11 LEU 25 1HD1 LEU 25 -5.994 20.450 -35.550 188 HD12 LEU 25 2HD1 LEU 25 -4.732 21.326 -34.655 189 HD13 LEU 25 3HD1 LEU 25 -6.360 21.239 -33.993 190 HD21 LEU 25 3HD2 LEU 25 -5.268 21.938 -37.509 191 HD22 LEU 25 1HD2 LEU 25 -5.364 23.705 -37.335 192 HD23 LEU 25 2HD2 LEU 25 -4.149 22.798 -36.426 193 H ALA 26 H ALA 26 -10.184 24.501 -34.089 194 HA ALA 26 HA ALA 26 -11.865 25.049 -36.424 195 HB1 ALA 26 3HB ALA 26 -13.036 23.998 -33.808 196 HB2 ALA 26 1HB ALA 26 -13.975 24.623 -35.181 197 HB3 ALA 26 2HB ALA 26 -13.019 23.140 -35.366 198 HA PRO 27 HA PRO 27 -11.762 29.078 -34.525 199 HB2 PRO 27 2HB PRO 27 -14.416 29.731 -35.718 200 HB3 PRO 27 3HB PRO 27 -12.836 30.530 -35.954 201 HG2 PRO 27 2HG PRO 27 -13.923 28.949 -37.893 202 HG3 PRO 27 3HG PRO 27 -12.159 28.912 -37.555 203 HD2 PRO 27 2HD PRO 27 -14.302 27.049 -36.467 204 HD3 PRO 27 3HD PRO 27 -12.771 26.633 -37.311 205 H ARG 28 H ARG 28 -12.147 29.621 -32.547 206 HA ARG 28 HA ARG 28 -14.819 29.449 -31.281 207 HB2 ARG 28 2HB ARG 28 -13.992 28.329 -29.324 208 HB3 ARG 28 3HB ARG 28 -13.676 27.383 -30.783 209 HG2 ARG 28 2HG ARG 28 -11.302 28.062 -30.759 210 HG3 ARG 28 3HG ARG 28 -11.613 29.086 -29.351 211 HD2 ARG 28 2HD ARG 28 -10.660 27.062 -28.520 212 HD3 ARG 28 3HD ARG 28 -12.360 27.047 -28.078 213 HE ARG 28 HE ARG 28 -12.728 25.227 -29.492 214 HH11 ARG 28 1HH2 ARG 28 -9.464 26.359 -30.092 215 HH12 ARG 28 2HH2 ARG 28 -9.096 25.052 -31.174 216 HH21 ARG 28 1HH1 ARG 28 -12.201 23.568 -30.866 217 HH22 ARG 28 2HH1 ARG 28 -10.602 23.475 -31.553 218 H GLN 29 H GLN 29 -14.910 30.479 -29.168 219 HA GLN 29 HA GLN 29 -13.451 33.092 -29.069 220 HB2 GLN 29 2HB GLN 29 -16.424 32.650 -28.634 221 HB3 GLN 29 3HB GLN 29 -15.569 34.188 -28.584 222 HG2 GLN 29 2HG GLN 29 -15.853 34.502 -30.794 223 HG3 GLN 29 3HG GLN 29 -15.167 32.921 -31.184 224 HE21 GLN 29 1HE2 GLN 29 -16.813 31.092 -30.172 225 HE22 GLN 29 2HE2 GLN 29 -18.420 31.247 -30.889 226 H ILE 30 H ILE 30 -12.238 32.601 -27.272 227 HA ILE 30 HA ILE 30 -13.436 31.640 -24.792 228 HB ILE 30 HB ILE 30 -10.694 32.755 -25.435 229 HG12 ILE 30 2HG1 ILE 30 -9.896 30.501 -25.098 230 HG13 ILE 30 3HG1 ILE 30 -11.518 29.930 -24.702 231 HG21 ILE 30 1HG2 ILE 30 -10.079 31.846 -23.161 232 HG22 ILE 30 2HG2 ILE 30 -11.199 33.198 -23.058 233 HG23 ILE 30 3HG2 ILE 30 -11.803 31.541 -22.850 234 HD11 ILE 30 3HD1 ILE 30 -10.622 29.236 -26.932 235 HD12 ILE 30 1HD1 ILE 30 -12.200 30.022 -26.988 236 HD13 ILE 30 2HD1 ILE 30 -10.726 30.930 -27.452 237 H ALA 31 H ALA 31 -14.879 32.860 -23.896 238 HA ALA 31 HA ALA 31 -14.367 35.760 -23.391 239 HB1 ALA 31 3HB ALA 31 -16.575 35.213 -24.284 240 HB2 ALA 31 1HB ALA 31 -16.841 34.029 -22.988 241 HB3 ALA 31 2HB ALA 31 -16.721 35.761 -22.604 242 H ARG 32 H ARG 32 -14.718 36.490 -21.165 243 HA ARG 32 HA ARG 32 -14.295 34.414 -19.064 244 HB2 ARG 32 2HB ARG 32 -12.888 37.068 -19.394 245 HB3 ARG 32 3HB ARG 32 -13.182 36.414 -17.775 246 HG2 ARG 32 2HG ARG 32 -11.990 34.419 -18.204 247 HG3 ARG 32 3HG ARG 32 -11.859 34.734 -19.925 248 HD2 ARG 32 2HD ARG 32 -9.774 35.424 -19.352 249 HD3 ARG 32 3HD ARG 32 -10.587 36.954 -19.033 250 HE ARG 32 HE ARG 32 -9.544 34.986 -17.072 251 HH11 ARG 32 2HH2 ARG 32 -11.167 38.120 -17.414 252 HH12 ARG 32 1HH2 ARG 32 -10.919 38.433 -15.690 253 HH21 ARG 32 2HH1 ARG 32 -9.230 35.653 -14.948 254 HH22 ARG 32 1HH1 ARG 32 -9.936 37.197 -14.463 255 H TYR 33 H TYR 33 -15.236 34.810 -17.091 256 HA TYR 33 HA TYR 33 -17.315 36.928 -16.968 257 HB2 TYR 33 2HB TYR 33 -17.924 34.002 -16.529 258 HB3 TYR 33 3HB TYR 33 -18.982 35.328 -16.149 259 HD1 TYR 33 HD2 TYR 33 -17.286 33.591 -18.994 260 HD2 TYR 33 HD1 TYR 33 -20.412 36.257 -17.742 261 HE1 TYR 33 HE2 TYR 33 -18.370 33.397 -21.240 262 HE2 TYR 33 HE1 TYR 33 -21.472 36.082 -19.992 263 HH TYR 33 HH TYR 33 -21.451 35.084 -21.968 264 H ARG 34 H ARG 34 -17.610 37.784 -14.986 265 HA ARG 34 HA ARG 34 -16.037 36.727 -12.688 266 HB2 ARG 34 2HB ARG 34 -15.537 39.000 -13.463 267 HB3 ARG 34 3HB ARG 34 -17.221 39.476 -13.231 268 HG2 ARG 34 2HG ARG 34 -17.074 39.330 -10.864 269 HG3 ARG 34 3HG ARG 34 -15.619 38.323 -10.927 270 HD2 ARG 34 2HD ARG 34 -15.067 40.574 -10.187 271 HD3 ARG 34 3HD ARG 34 -14.290 40.172 -11.707 272 HE ARG 34 HE ARG 34 -16.759 41.871 -11.505 273 HH11 ARG 34 1HH2 ARG 34 -13.620 41.362 -13.088 274 HH12 ARG 34 2HH2 ARG 34 -13.689 42.944 -13.818 275 HH21 ARG 34 1HH1 ARG 34 -16.783 43.779 -12.605 276 HH22 ARG 34 2HH1 ARG 34 -15.447 44.221 -13.625 277 H THR 35 H THR 35 -16.973 35.838 -11.020 278 HA THR 35 HA THR 35 -19.873 35.553 -10.798 279 HB THR 35 HB THR 35 -19.428 34.146 -8.851 280 HG1 THR 35 HG1 THR 35 -16.717 34.613 -9.341 281 HG21 THR 35 1HG2 THR 35 -19.301 33.089 -11.009 282 HG22 THR 35 2HG2 THR 35 -17.579 33.498 -11.164 283 HG23 THR 35 3HG2 THR 35 -18.117 32.402 -9.875 284 H ASP 36 H ASP 36 -20.680 35.662 -8.343 285 HA ASP 36 HA ASP 36 -20.634 38.473 -7.750 286 HB2 ASP 36 2HB ASP 36 -22.657 36.992 -7.624 287 HB3 ASP 36 3HB ASP 36 -21.945 36.185 -6.225 288 H ASN 37 H ASN 37 -18.642 35.869 -6.574 289 HA ASN 37 HA ASN 37 -17.875 37.462 -4.178 290 HB2 ASN 37 2HB ASN 37 -16.427 35.011 -5.011 291 HB3 ASN 37 3HB ASN 37 -16.592 35.723 -3.443 292 HD21 ASN 37 1HD2 ASN 37 -17.055 33.015 -4.509 293 HD22 ASN 37 2HD2 ASN 37 -18.669 32.598 -3.886 294 H GLY 38 H GLY 38 -17.276 37.862 -7.372 295 HA2 GLY 38 HA2 GLY 38 -15.643 39.072 -8.503 296 HA3 GLY 38 HA3 GLY 38 -14.565 39.008 -7.107 297 H GLU 39 H GLU 39 -15.740 35.876 -7.809 298 HA GLU 39 HA GLU 39 -13.045 35.055 -8.600 299 HB2 GLU 39 2HB GLU 39 -15.432 33.219 -8.745 300 HB3 GLU 39 3HB GLU 39 -13.764 32.853 -8.396 301 HG2 GLU 39 2HG GLU 39 -14.347 34.458 -6.261 302 HG3 GLU 39 3HG GLU 39 -15.981 33.917 -6.708 303 H GLU 40 H GLU 40 -12.338 35.264 -10.648 304 HA GLU 40 HA GLU 40 -14.274 35.362 -12.894 305 HB2 GLU 40 2HB GLU 40 -11.329 36.064 -12.867 306 HB3 GLU 40 3HB GLU 40 -12.476 36.296 -14.201 307 HG2 GLU 40 2HG GLU 40 -13.820 37.774 -12.647 308 HG3 GLU 40 3HG GLU 40 -12.479 37.703 -11.505 309 H PHE 41 H PHE 41 -14.510 33.859 -14.377 310 HA PHE 41 HA PHE 41 -12.461 31.706 -14.756 311 HB2 PHE 41 2HB PHE 41 -15.477 31.425 -14.648 312 HB3 PHE 41 3HB PHE 41 -14.367 30.157 -15.092 313 HD1 PHE 41 HD2 PHE 41 -15.617 32.191 -12.187 314 HD2 PHE 41 HD1 PHE 41 -12.967 29.011 -13.475 315 HE1 PHE 41 HE2 PHE 41 -15.304 31.485 -9.884 316 HE2 PHE 41 HE1 PHE 41 -12.621 28.355 -11.113 317 HZ PHE 41 HZ PHE 41 -13.779 29.600 -9.298 318 H GLU 42 H GLU 42 -12.652 30.567 -16.813 319 HA GLU 42 HA GLU 42 -13.339 32.412 -19.017 320 HB2 GLU 42 2HB GLU 42 -11.481 30.041 -19.273 321 HB3 GLU 42 3HB GLU 42 -11.588 31.501 -20.239 322 HG2 GLU 42 2HG GLU 42 -9.733 32.094 -19.107 323 HG3 GLU 42 3HG GLU 42 -10.856 32.623 -17.862 324 H VAL 43 H VAL 43 -14.734 31.818 -20.567 325 HA VAL 43 HA VAL 43 -15.737 28.992 -20.635 326 HB VAL 43 HB VAL 43 -17.424 31.425 -21.170 327 HG11 VAL 43 1HG1 VAL 43 -18.062 29.353 -22.418 328 HG12 VAL 43 2HG1 VAL 43 -18.159 28.486 -20.871 329 HG13 VAL 43 3HG1 VAL 43 -19.253 29.845 -21.225 330 HG21 VAL 43 3HG2 VAL 43 -18.533 31.019 -19.104 331 HG22 VAL 43 1HG2 VAL 43 -17.542 29.576 -18.761 332 HG23 VAL 43 2HG2 VAL 43 -16.836 31.206 -18.726 333 HA PRO 44 HA PRO 44 -14.392 29.675 -24.945 334 HB2 PRO 44 2HB PRO 44 -13.931 27.068 -25.604 335 HB3 PRO 44 3HB PRO 44 -12.785 28.057 -24.658 336 HG2 PRO 44 2HG PRO 44 -14.771 26.030 -23.639 337 HG3 PRO 44 3HG PRO 44 -13.073 26.281 -23.134 338 HD2 PRO 44 2HD PRO 44 -15.271 27.272 -21.782 339 HD3 PRO 44 3HD PRO 44 -13.676 28.081 -21.726 340 H PHE 45 H PHE 45 -15.880 30.107 -26.384 341 HA PHE 45 HA PHE 45 -18.298 28.380 -26.782 342 HB2 PHE 45 2HB PHE 45 -17.716 31.302 -27.299 343 HB3 PHE 45 3HB PHE 45 -19.070 30.507 -28.037 344 HD1 PHE 45 HD1 PHE 45 -17.591 31.601 -24.799 345 HD2 PHE 45 HD2 PHE 45 -21.063 29.932 -26.747 346 HE1 PHE 45 HE1 PHE 45 -18.969 32.100 -22.807 347 HE2 PHE 45 HE2 PHE 45 -22.426 30.416 -24.721 348 HZ PHE 45 HZ PHE 45 -21.364 31.509 -22.745 349 H ALA 46 H ALA 46 -18.817 27.627 -28.787 350 HA ALA 46 HA ALA 46 -16.701 27.543 -30.853 351 HB1 ALA 46 3HB ALA 46 -18.172 25.886 -31.923 352 HB2 ALA 46 1HB ALA 46 -17.899 25.474 -30.220 353 HB3 ALA 46 2HB ALA 46 -19.441 26.209 -30.721 354 H ASP 47 H ASP 47 -17.202 28.044 -33.111 355 HA ASP 47 HA ASP 47 -18.240 30.628 -33.554 356 HB2 ASP 47 2HB ASP 47 -16.565 29.454 -34.936 357 HB3 ASP 47 3HB ASP 47 -17.803 28.338 -35.511 358 H ASP 48 H ASP 48 -19.980 27.638 -33.388 359 HA ASP 48 HA ASP 48 -22.380 28.445 -34.823 360 HB2 ASP 48 2HB ASP 48 -21.604 26.096 -34.422 361 HB3 ASP 48 3HB ASP 48 -21.958 26.306 -32.710 362 H ALA 49 H ALA 49 -21.081 29.385 -31.820 363 HA ALA 49 HA ALA 49 -23.707 30.385 -30.793 364 HB1 ALA 49 3HB ALA 49 -21.342 29.323 -29.194 365 HB2 ALA 49 1HB ALA 49 -22.858 29.971 -28.527 366 HB3 ALA 49 2HB ALA 49 -22.879 28.467 -29.468 367 H GLU 50 H GLU 50 -23.579 32.290 -29.442 368 HA GLU 50 HA GLU 50 -21.186 34.037 -29.792 369 HB2 GLU 50 2HB GLU 50 -24.069 34.734 -30.397 370 HB3 GLU 50 3HB GLU 50 -22.849 35.969 -30.037 371 HG2 GLU 50 2HG GLU 50 -21.479 35.275 -31.910 372 HG3 GLU 50 3HG GLU 50 -22.560 33.930 -32.264 373 H ILE 51 H ILE 51 -20.638 35.126 -28.083 374 HA ILE 51 HA ILE 51 -21.147 34.269 -25.540 375 HB ILE 51 HB ILE 51 -20.175 37.083 -26.091 376 HG12 ILE 51 2HG1 ILE 51 -18.995 35.712 -27.685 377 HG13 ILE 51 3HG1 ILE 51 -17.917 36.244 -26.405 378 HG21 ILE 51 1HG2 ILE 51 -20.458 36.436 -23.690 379 HG22 ILE 51 2HG2 ILE 51 -19.384 35.057 -23.957 380 HG23 ILE 51 3HG2 ILE 51 -18.763 36.698 -24.120 381 HD11 ILE 51 3HD1 ILE 51 -18.100 33.945 -25.385 382 HD12 ILE 51 1HD1 ILE 51 -19.105 33.463 -26.770 383 HD13 ILE 51 2HD1 ILE 51 -17.420 33.957 -27.008 384 HA PRO 52 HA PRO 52 -24.941 36.615 -24.549 385 HB2 PRO 52 2HB PRO 52 -25.642 35.127 -22.383 386 HB3 PRO 52 3HB PRO 52 -25.970 34.612 -24.068 387 HG2 PRO 52 2HG PRO 52 -23.736 33.756 -22.226 388 HG3 PRO 52 3HG PRO 52 -24.733 32.742 -23.330 389 HD2 PRO 52 2HD PRO 52 -22.188 33.701 -23.914 390 HD3 PRO 52 3HD PRO 52 -23.373 33.322 -25.168 391 H GLY 53 H GLY 53 -25.246 38.204 -23.023 392 HA2 GLY 53 HA2 GLY 53 -23.191 39.553 -21.829 393 HA3 GLY 53 HA3 GLY 53 -24.867 39.652 -21.281 394 H THR 54 H THR 54 -24.917 36.846 -20.255 395 HA THR 54 HA THR 54 -22.720 36.754 -18.323 396 HB THR 54 HB THR 54 -24.297 36.196 -16.447 397 HG1 THR 54 HG1 THR 54 -26.540 36.577 -16.787 398 HG21 THR 54 1HG2 THR 54 -23.754 38.618 -16.766 399 HG22 THR 54 2HG2 THR 54 -25.261 38.811 -17.666 400 HG23 THR 54 3HG2 THR 54 -25.290 38.326 -15.954 401 H TRP 55 H TRP 55 -22.520 34.630 -17.223 402 HA TRP 55 HA TRP 55 -23.872 32.293 -18.364 403 HB2 TRP 55 2HB TRP 55 -22.117 32.952 -20.059 404 HB3 TRP 55 3HB TRP 55 -20.897 32.674 -18.823 405 HD1 TRP 55 HD1 TRP 55 -20.313 30.185 -18.241 406 HE1 TRP 55 HE1 TRP 55 -20.617 27.990 -19.495 407 HE3 TRP 55 HE3 TRP 55 -23.943 31.658 -21.480 408 HZ2 TRP 55 HZ2 TRP 55 -22.373 26.931 -21.562 409 HZ3 TRP 55 HZ3 TRP 55 -24.960 30.030 -23.083 410 HH2 TRP 55 HH2 TRP 55 -24.172 27.674 -23.133 411 H LEU 56 H LEU 56 -23.483 30.365 -17.143 412 HA LEU 56 HA LEU 56 -22.786 30.797 -14.385 413 HB2 LEU 56 2HB LEU 56 -24.338 28.979 -15.806 414 HB3 LEU 56 3HB LEU 56 -22.952 28.007 -15.308 415 HG LEU 56 HG LEU 56 -24.621 29.690 -13.398 416 HD11 LEU 56 1HD1 LEU 56 -25.997 27.923 -14.431 417 HD12 LEU 56 2HD1 LEU 56 -24.775 26.705 -13.999 418 HD13 LEU 56 3HD1 LEU 56 -25.675 27.564 -12.727 419 HD21 LEU 56 3HD2 LEU 56 -22.377 29.142 -12.529 420 HD22 LEU 56 1HD2 LEU 56 -23.614 28.214 -11.675 421 HD23 LEU 56 2HD2 LEU 56 -22.617 27.434 -12.926 422 H CYS 57 H CYS 57 -20.911 30.622 -13.385 423 HA CYS 57 HA CYS 57 -18.490 29.811 -14.889 424 HB2 CYS 57 2HB CYS 57 -18.981 31.338 -12.310 425 HB3 CYS 57 3HB CYS 57 -17.368 30.845 -12.838 426 HG CYS 57 HG CYS 57 -19.562 32.467 -14.696 427 H ARG 58 H ARG 58 -16.764 28.705 -13.701 428 HA ARG 58 HA ARG 58 -17.678 26.117 -12.954 429 HB2 ARG 58 2HB ARG 58 -14.848 27.146 -12.547 430 HB3 ARG 58 3HB ARG 58 -15.363 25.490 -12.852 431 HG2 ARG 58 2HG ARG 58 -16.090 26.183 -15.166 432 HG3 ARG 58 3HG ARG 58 -15.467 27.811 -14.835 433 HD2 ARG 58 2HD ARG 58 -13.213 26.734 -14.341 434 HD3 ARG 58 3HD ARG 58 -13.885 25.236 -15.014 435 HE ARG 58 HE ARG 58 -14.281 27.466 -16.822 436 HH11 ARG 58 1HH2 ARG 58 -11.759 25.249 -15.814 437 HH12 ARG 58 2HH2 ARG 58 -10.851 25.483 -17.283 438 HH21 ARG 58 2HH1 ARG 58 -13.057 27.785 -18.598 439 HH22 ARG 58 1HH1 ARG 58 -11.588 26.864 -18.841 440 H ASN 59 H ASN 59 -17.070 28.843 -10.959 441 HA ASN 59 HA ASN 59 -16.787 27.528 -8.428 442 HB2 ASN 59 2HB ASN 59 -16.166 29.815 -8.793 443 HB3 ASN 59 3HB ASN 59 -17.813 30.257 -9.265 444 HD21 ASN 59 1HD2 ASN 59 -17.898 31.932 -7.706 445 HD22 ASN 59 2HD2 ASN 59 -17.902 31.575 -5.992 446 H GLY 60 H GLY 60 -19.509 27.855 -10.538 447 HA2 GLY 60 HA2 GLY 60 -21.611 26.832 -10.316 448 HA3 GLY 60 HA3 GLY 60 -21.406 26.705 -8.568 449 H MET 61 H MET 61 -20.656 29.814 -9.965 450 HA MET 61 HA MET 61 -23.315 30.904 -9.185 451 HB2 MET 61 2HB MET 61 -21.344 31.475 -7.672 452 HB3 MET 61 3HB MET 61 -20.638 32.344 -9.010 453 HG2 MET 61 2HG MET 61 -21.849 33.833 -7.461 454 HG3 MET 61 3HG MET 61 -22.496 33.903 -9.097 455 HE1 MET 61 3HE MET 61 -24.089 35.149 -6.599 456 HE2 MET 61 1HE MET 61 -24.602 35.176 -8.305 457 HE3 MET 61 2HE MET 61 -25.721 34.613 -7.043 458 H GLU 62 H GLU 62 -24.190 32.561 -10.474 459 HA GLU 62 HA GLU 62 -23.566 32.487 -13.294 460 HB2 GLU 62 2HB GLU 62 -25.837 32.841 -12.385 461 HB3 GLU 62 3HB GLU 62 -25.343 34.431 -11.783 462 HG2 GLU 62 2HG GLU 62 -24.818 35.144 -14.108 463 HG3 GLU 62 3HG GLU 62 -25.234 33.538 -14.705 464 H GLY 63 H GLY 63 -21.807 33.336 -14.133 465 HA2 GLY 63 HA2 GLY 63 -20.426 35.640 -12.958 466 HA3 GLY 63 HA3 GLY 63 -19.848 34.638 -14.259 467 H THR 64 H THR 64 -20.061 37.604 -14.086 468 HA THR 64 HA THR 64 -21.751 38.058 -16.506 469 HB THR 64 HB THR 64 -20.625 40.113 -14.564 470 HG1 THR 64 HG1 THR 64 -22.296 38.908 -13.664 471 HG21 THR 64 1HG2 THR 64 -22.312 41.639 -15.691 472 HG22 THR 64 2HG2 THR 64 -20.926 41.205 -16.697 473 HG23 THR 64 3HG2 THR 64 -22.491 40.412 -16.965 474 H LEU 65 H LEU 65 -20.962 38.870 -18.351 475 HA LEU 65 HA LEU 65 -18.435 37.990 -19.124 476 HB2 LEU 65 2HB LEU 65 -20.538 38.226 -20.426 477 HB3 LEU 65 3HB LEU 65 -20.330 39.957 -20.451 478 HG LEU 65 HG LEU 65 -18.796 37.779 -21.909 479 HD11 LEU 65 1HD1 LEU 65 -19.593 39.018 -23.888 480 HD12 LEU 65 2HD1 LEU 65 -20.952 38.625 -22.823 481 HD13 LEU 65 3HD1 LEU 65 -20.290 40.274 -22.844 482 HD21 LEU 65 3HD2 LEU 65 -16.994 39.257 -21.401 483 HD22 LEU 65 1HD2 LEU 65 -17.475 39.590 -23.053 484 HD23 LEU 65 2HD2 LEU 65 -17.980 40.705 -21.764 485 H ILE 66 H ILE 66 -16.465 38.788 -18.831 486 HA ILE 66 HA ILE 66 -15.941 41.671 -19.249 487 HB ILE 66 HB ILE 66 -14.155 41.720 -17.700 488 HG12 ILE 66 2HG1 ILE 66 -13.348 39.388 -17.790 489 HG13 ILE 66 3HG1 ILE 66 -13.502 40.024 -16.162 490 HG21 ILE 66 1HG2 ILE 66 -15.349 41.628 -15.564 491 HG22 ILE 66 2HG2 ILE 66 -16.338 42.354 -16.843 492 HG23 ILE 66 3HG2 ILE 66 -16.656 40.697 -16.303 493 HD11 ILE 66 3HD1 ILE 66 -15.459 38.146 -17.359 494 HD12 ILE 66 1HD1 ILE 66 -14.177 37.731 -16.210 495 HD13 ILE 66 2HD1 ILE 66 -15.505 38.802 -15.725 496 H GLU 67 H GLU 67 -13.826 42.098 -20.226 497 HA GLU 67 HA GLU 67 -13.342 40.213 -22.335 498 HB2 GLU 67 2HB GLU 67 -11.655 41.751 -23.136 499 HB3 GLU 67 3HB GLU 67 -13.176 42.555 -22.760 500 HG2 GLU 67 2HG GLU 67 -12.183 43.345 -20.585 501 HG3 GLU 67 3HG GLU 67 -10.644 42.621 -21.060 502 H GLY 68 H GLY 68 -12.102 38.549 -22.505 503 HA2 GLY 68 HA2 GLY 68 -9.541 38.341 -20.942 504 HA3 GLY 68 HA3 GLY 68 -10.553 36.950 -21.339 505 H ASP 69 H ASP 69 -10.989 36.627 -23.735 506 HA ASP 69 HA ASP 69 -8.627 37.236 -25.451 507 HB2 ASP 69 2HB ASP 69 -9.537 34.501 -24.496 508 HB3 ASP 69 3HB ASP 69 -8.462 34.727 -25.873 509 H LEU 70 H LEU 70 -11.326 38.193 -25.715 510 HA LEU 70 HA LEU 70 -12.906 36.638 -27.482 511 HB2 LEU 70 2HB LEU 70 -12.819 39.625 -26.877 512 HB3 LEU 70 3HB LEU 70 -13.994 38.901 -27.940 513 HG LEU 70 HG LEU 70 -15.015 39.329 -25.860 514 HD11 LEU 70 1HD1 LEU 70 -15.964 37.206 -25.303 515 HD12 LEU 70 2HD1 LEU 70 -15.679 37.249 -27.050 516 HD13 LEU 70 3HD1 LEU 70 -14.586 36.322 -25.995 517 HD21 LEU 70 3HD2 LEU 70 -13.080 37.471 -24.448 518 HD22 LEU 70 1HD2 LEU 70 -12.983 39.256 -24.425 519 HD23 LEU 70 2HD2 LEU 70 -14.400 38.424 -23.742 520 HA PRO 71 HA PRO 71 -10.783 37.844 -31.356 521 HB2 PRO 71 2HB PRO 71 -12.027 36.201 -33.100 522 HB3 PRO 71 3HB PRO 71 -10.953 35.556 -31.828 523 HG2 PRO 71 2HG PRO 71 -13.980 35.808 -31.726 524 HG3 PRO 71 3HG PRO 71 -12.987 34.346 -31.415 525 HD2 PRO 71 2HD PRO 71 -13.859 36.001 -29.405 526 HD3 PRO 71 3HD PRO 71 -12.287 35.153 -29.322 527 H GLU 72 H GLU 72 -12.486 39.684 -30.269 528 HA GLU 72 HA GLU 72 -14.362 41.016 -30.351 529 HB2 GLU 72 2HB GLU 72 -12.866 41.393 -32.938 530 HB3 GLU 72 3HB GLU 72 -14.123 42.520 -32.369 531 HG2 GLU 72 2HG GLU 72 -12.831 42.876 -30.277 532 HG3 GLU 72 3HG GLU 72 -11.554 41.821 -30.885 533 HA PRO 73 HA PRO 73 -17.223 38.395 -32.955 534 HB2 PRO 73 2HB PRO 73 -18.705 37.160 -31.041 535 HB3 PRO 73 3HB PRO 73 -17.094 36.559 -31.541 536 HG2 PRO 73 2HG PRO 73 -17.769 38.304 -29.148 537 HG3 PRO 73 3HG PRO 73 -16.769 36.816 -29.190 538 HD2 PRO 73 2HD PRO 73 -15.693 39.343 -29.295 539 HD3 PRO 73 3HD PRO 73 -14.950 37.951 -30.129 540 H LYS 74 H LYS 74 -19.477 38.751 -33.322 541 HA LYS 74 HA LYS 74 -20.491 41.378 -32.651 542 HB2 LYS 74 2HB LYS 74 -20.969 40.283 -34.793 543 HB3 LYS 74 3HB LYS 74 -21.819 38.971 -33.966 544 HG2 LYS 74 2HG LYS 74 -23.521 40.580 -33.148 545 HG3 LYS 74 3HG LYS 74 -22.665 41.903 -33.960 546 HD2 LYS 74 2HD LYS 74 -23.110 40.877 -36.154 547 HD3 LYS 74 3HD LYS 74 -23.850 39.461 -35.365 548 HE2 LYS 74 2HE LYS 74 -25.538 40.946 -34.304 549 HE3 LYS 74 3HE LYS 74 -24.837 42.340 -35.117 550 HZ1 LYS 74 HZ1 LYS 74 -26.791 41.466 -36.239 551 HZ2 LYS 74 HZ2 LYS 74 -25.490 41.370 -37.238 552 HZ3 LYS 74 HZ3 LYS 74 -26.069 40.022 -36.506 553 H LYS 75 H LYS 75 -21.677 42.031 -30.984 554 HA LYS 75 HA LYS 75 -23.541 40.189 -29.609 555 HB2 LYS 75 2HB LYS 75 -21.198 40.184 -28.452 556 HB3 LYS 75 3HB LYS 75 -21.605 41.820 -27.940 557 HG2 LYS 75 2HG LYS 75 -23.900 40.568 -27.183 558 HG3 LYS 75 3HG LYS 75 -22.885 39.159 -27.278 559 HD2 LYS 75 2HD LYS 75 -23.043 39.990 -24.974 560 HD3 LYS 75 3HD LYS 75 -21.387 40.127 -25.567 561 HE2 LYS 75 2HE LYS 75 -21.897 42.141 -24.389 562 HE3 LYS 75 3HE LYS 75 -21.794 42.568 -26.095 563 HZ1 LYS 75 HZ1 LYS 75 -24.118 42.750 -26.206 564 HZ2 LYS 75 HZ2 LYS 75 -24.413 41.907 -24.851 565 HZ3 LYS 75 HZ3 LYS 75 -23.792 43.440 -24.754 566 H VAL 76 H VAL 76 -24.123 42.218 -31.365 567 HA VAL 76 HA VAL 76 -26.032 43.815 -29.826 568 HB VAL 76 HB VAL 76 -25.520 45.879 -31.131 569 HG11 VAL 76 1HG1 VAL 76 -24.805 45.636 -28.763 570 HG12 VAL 76 2HG1 VAL 76 -23.207 45.100 -29.329 571 HG13 VAL 76 3HG1 VAL 76 -23.784 46.732 -29.708 572 HG21 VAL 76 3HG2 VAL 76 -24.116 44.943 -32.943 573 HG22 VAL 76 1HG2 VAL 76 -23.307 46.262 -32.090 574 HG23 VAL 76 2HG2 VAL 76 -22.835 44.585 -31.763 575 H LYS 77 H LYS 77 -27.768 44.579 -31.187 576 HA LYS 77 HA LYS 77 -29.386 44.274 -32.801 577 HB2 LYS 77 2HB LYS 77 -26.954 44.768 -34.544 578 HB3 LYS 77 3HB LYS 77 -28.640 44.918 -35.057 579 HG2 LYS 77 2HG LYS 77 -29.018 46.664 -33.326 580 HG3 LYS 77 3HG LYS 77 -27.309 46.558 -32.856 581 HD2 LYS 77 2HD LYS 77 -26.630 47.216 -35.148 582 HD3 LYS 77 3HD LYS 77 -28.341 47.332 -35.621 583 HE2 LYS 77 2HE LYS 77 -28.699 49.069 -33.875 584 HE3 LYS 77 3HE LYS 77 -26.996 48.957 -33.411 585 HZ1 LYS 77 HZ1 LYS 77 -27.981 49.814 -36.083 586 HZ2 LYS 77 HZ2 LYS 77 -27.379 50.807 -34.937 587 HZ3 LYS 77 HZ3 LYS 77 -26.406 49.712 -35.656 588 HA PRO 78 HA PRO 78 -30.683 42.737 -31.916 589 HB2 PRO 78 2HB PRO 78 -30.680 39.872 -31.054 590 HB3 PRO 78 3HB PRO 78 -32.064 40.950 -31.397 591 HG2 PRO 78 2HG PRO 78 -31.361 39.011 -33.155 592 HG3 PRO 78 3HG PRO 78 -31.822 40.644 -33.750 593 HD2 PRO 78 2HD PRO 78 -29.023 39.563 -33.243 594 HD3 PRO 78 3HD PRO 78 -29.670 40.341 -34.717 595 HA PRO 79 HA PRO 79 -28.044 42.984 -28.282 596 HB2 PRO 79 2HB PRO 79 -29.833 43.231 -26.218 597 HB3 PRO 79 3HB PRO 79 -29.505 44.533 -27.403 598 HG2 PRO 79 2HG PRO 79 -31.761 42.500 -27.450 599 HG3 PRO 79 3HG PRO 79 -31.872 44.279 -27.647 600 HD2 PRO 79 2HD PRO 79 -31.822 42.625 -29.788 601 HD3 PRO 79 3HD PRO 79 -30.952 44.187 -29.828 602 H ARG 80 H ARG 80 -27.194 41.730 -26.638 603 HA ARG 80 HA ARG 80 -28.201 39.017 -26.042 604 HB2 ARG 80 2HB ARG 80 -27.279 38.713 -28.235 605 HB3 ARG 80 3HB ARG 80 -25.844 39.659 -27.857 606 HG2 ARG 80 2HG ARG 80 -25.056 37.949 -26.315 607 HG3 ARG 80 3HG ARG 80 -26.516 36.977 -26.567 608 HD2 ARG 80 2HD ARG 80 -24.528 37.736 -28.754 609 HD3 ARG 80 3HD ARG 80 -24.462 36.235 -27.844 610 HE ARG 80 HE ARG 80 -26.446 37.002 -29.898 611 HH11 ARG 80 1HH2 ARG 80 -25.342 34.416 -27.780 612 HH12 ARG 80 2HH2 ARG 80 -26.641 33.367 -28.278 613 HH21 ARG 80 1HH1 ARG 80 -27.943 35.539 -30.583 614 HH22 ARG 80 2HH1 ARG 80 -27.992 33.944 -29.890 Start of MODEL 35 1 H1 SER 1 1H SER 1 -15.419 21.813 -60.643 2 H2 SER 1 2H SER 1 -14.840 23.252 -60.100 3 H3 SER 1 3H SER 1 -15.638 23.177 -61.529 4 HA SER 1 HA SER 1 -16.814 22.606 -58.898 5 HB2 SER 1 2HB SER 1 -17.242 25.061 -60.640 6 HB3 SER 1 3HB SER 1 -17.966 24.734 -59.052 7 HG SER 1 HG SER 1 -16.094 26.087 -58.929 8 H MET 2 H MET 2 -19.023 22.144 -58.883 9 HA MET 2 HA MET 2 -20.505 21.853 -61.442 10 HB2 MET 2 2HB MET 2 -19.194 19.744 -61.191 11 HB3 MET 2 3HB MET 2 -19.971 19.461 -59.629 12 HG2 MET 2 2HG MET 2 -22.181 19.345 -60.765 13 HG3 MET 2 3HG MET 2 -21.404 19.719 -62.304 14 HE1 MET 2 3HE MET 2 -20.339 17.169 -59.358 15 HE2 MET 2 1HE MET 2 -22.107 17.078 -59.532 16 HE3 MET 2 2HE MET 2 -21.092 15.699 -60.004 17 H ALA 3 H ALA 3 -20.595 21.259 -57.900 18 HA ALA 3 HA ALA 3 -23.392 22.282 -57.788 19 HB1 ALA 3 3HB ALA 3 -22.413 19.665 -56.566 20 HB2 ALA 3 1HB ALA 3 -24.047 20.349 -56.423 21 HB3 ALA 3 2HB ALA 3 -23.452 19.811 -58.001 22 H ASP 4 H ASP 4 -20.636 23.258 -56.962 23 HA ASP 4 HA ASP 4 -20.285 22.929 -54.184 24 HB2 ASP 4 2HB ASP 4 -19.112 24.999 -56.082 25 HB3 ASP 4 3HB ASP 4 -18.454 24.549 -54.507 26 H ARG 5 H ARG 5 -21.944 25.441 -55.943 27 HA ARG 5 HA ARG 5 -23.154 27.297 -55.425 28 HB2 ARG 5 2HB ARG 5 -23.580 25.656 -52.916 29 HB3 ARG 5 3HB ARG 5 -24.406 27.185 -53.164 30 HG2 ARG 5 2HG ARG 5 -25.678 26.441 -54.943 31 HG3 ARG 5 3HG ARG 5 -24.557 25.158 -55.400 32 HD2 ARG 5 2HD ARG 5 -26.126 25.090 -52.798 33 HD3 ARG 5 3HD ARG 5 -26.743 24.419 -54.320 34 HE ARG 5 HE ARG 5 -24.242 23.284 -54.124 35 HH11 ARG 5 1HH1 ARG 5 -26.998 23.174 -51.953 36 HH12 ARG 5 2HH1 ARG 5 -26.548 21.597 -51.357 37 HH21 ARG 5 1HH2 ARG 5 -23.761 21.373 -53.396 38 HH22 ARG 5 2HH2 ARG 5 -24.718 20.579 -52.159 39 H VAL 6 H VAL 6 -23.586 29.130 -53.915 40 HA VAL 6 HA VAL 6 -22.819 31.149 -53.417 41 HB VAL 6 HB VAL 6 -22.042 31.382 -51.215 42 HG11 VAL 6 1HG1 VAL 6 -24.385 30.743 -51.606 43 HG12 VAL 6 2HG1 VAL 6 -23.956 29.036 -51.347 44 HG13 VAL 6 3HG1 VAL 6 -23.782 30.208 -50.030 45 HG21 VAL 6 3HG2 VAL 6 -21.387 29.571 -49.741 46 HG22 VAL 6 1HG2 VAL 6 -21.574 28.377 -51.036 47 HG23 VAL 6 2HG2 VAL 6 -20.280 29.591 -51.121 48 H LEU 7 H LEU 7 -21.054 30.016 -55.382 49 HA LEU 7 HA LEU 7 -18.333 30.749 -54.788 50 HB2 LEU 7 2HB LEU 7 -19.708 30.350 -57.470 51 HB3 LEU 7 3HB LEU 7 -17.969 30.457 -57.214 52 HG LEU 7 HG LEU 7 -19.795 28.247 -56.167 53 HD11 LEU 7 1HD1 LEU 7 -19.396 28.177 -58.595 54 HD12 LEU 7 2HD1 LEU 7 -17.640 28.233 -58.315 55 HD13 LEU 7 3HD1 LEU 7 -18.594 26.834 -57.764 56 HD21 LEU 7 3HD2 LEU 7 -17.945 28.545 -54.592 57 HD22 LEU 7 1HD2 LEU 7 -17.668 27.094 -55.553 58 HD23 LEU 7 2HD2 LEU 7 -16.769 28.580 -55.931 59 H ARG 8 H ARG 8 -17.146 32.518 -55.257 60 HA ARG 8 HA ARG 8 -18.301 34.925 -56.503 61 HB2 ARG 8 2HB ARG 8 -18.039 36.338 -54.563 62 HB3 ARG 8 3HB ARG 8 -19.163 35.030 -54.214 63 HG2 ARG 8 2HG ARG 8 -17.288 33.788 -53.060 64 HG3 ARG 8 3HG ARG 8 -16.256 35.204 -53.288 65 HD2 ARG 8 2HD ARG 8 -18.888 35.131 -51.753 66 HD3 ARG 8 3HD ARG 8 -17.262 35.076 -51.054 67 HE ARG 8 HE ARG 8 -17.607 37.416 -52.727 68 HH11 ARG 8 1HH1 ARG 8 -18.442 36.257 -49.528 69 HH12 ARG 8 2HH1 ARG 8 -18.546 37.869 -48.875 70 HH21 ARG 8 1HH2 ARG 8 -17.762 39.445 -51.827 71 HH22 ARG 8 2HH2 ARG 8 -18.173 39.616 -50.147 72 H GLY 9 H GLY 9 -16.783 36.647 -56.795 73 HA2 GLY 9 HA2 GLY 9 -14.073 35.792 -57.447 74 HA3 GLY 9 HA3 GLY 9 -14.777 37.389 -57.695 75 H SER 10 H SER 10 -14.245 35.456 -54.706 76 HA SER 10 HA SER 10 -12.301 37.362 -53.605 77 HB2 SER 10 2HB SER 10 -14.603 38.375 -53.207 78 HB3 SER 10 3HB SER 10 -14.948 36.986 -52.158 79 HG SER 10 HG SER 10 -14.094 38.869 -51.053 80 H ARG 11 H ARG 11 -11.986 36.708 -51.161 81 HA ARG 11 HA ARG 11 -11.057 33.928 -51.170 82 HB2 ARG 11 2HB ARG 11 -9.752 35.928 -50.348 83 HB3 ARG 11 3HB ARG 11 -10.838 36.007 -48.958 84 HG2 ARG 11 2HG ARG 11 -10.146 33.650 -48.362 85 HG3 ARG 11 3HG ARG 11 -9.035 33.663 -49.744 86 HD2 ARG 11 2HD ARG 11 -7.839 35.603 -48.767 87 HD3 ARG 11 3HD ARG 11 -8.962 35.601 -47.393 88 HE ARG 11 HE ARG 11 -7.668 33.025 -47.745 89 HH11 ARG 11 1HH2 ARG 11 -7.028 36.213 -46.391 90 HH12 ARG 11 2HH2 ARG 11 -5.867 35.554 -45.250 91 HH21 ARG 11 1HH1 ARG 11 -6.081 32.341 -46.304 92 HH22 ARG 11 2HH1 ARG 11 -5.321 33.524 -45.260 93 H LEU 12 H LEU 12 -13.195 33.058 -51.397 94 HA LEU 12 HA LEU 12 -15.211 33.080 -49.405 95 HB2 LEU 12 2HB LEU 12 -15.464 32.442 -51.793 96 HB3 LEU 12 3HB LEU 12 -14.489 31.005 -51.512 97 HG LEU 12 HG LEU 12 -16.253 30.100 -50.004 98 HD11 LEU 12 1HD1 LEU 12 -17.877 32.521 -50.913 99 HD12 LEU 12 2HD1 LEU 12 -18.491 31.139 -49.991 100 HD13 LEU 12 3HD1 LEU 12 -17.316 32.230 -49.252 101 HD21 LEU 12 3HD2 LEU 12 -17.237 30.957 -52.751 102 HD22 LEU 12 1HD2 LEU 12 -16.215 29.543 -52.405 103 HD23 LEU 12 2HD2 LEU 12 -17.873 29.608 -51.787 104 H GLY 13 H GLY 13 -15.822 31.582 -47.807 105 HA2 GLY 13 HA2 GLY 13 -15.618 29.830 -46.269 106 HA3 GLY 13 HA3 GLY 13 -14.107 29.333 -47.020 107 H ALA 14 H ALA 14 -13.285 29.048 -44.857 108 HA ALA 14 HA ALA 14 -13.017 31.226 -42.985 109 HB1 ALA 14 3HB ALA 14 -11.547 28.563 -43.167 110 HB2 ALA 14 1HB ALA 14 -11.574 29.651 -41.763 111 HB3 ALA 14 2HB ALA 14 -13.071 28.864 -42.296 112 H VAL 15 H VAL 15 -11.153 32.385 -42.365 113 HA VAL 15 HA VAL 15 -8.969 32.622 -44.378 114 HB VAL 15 HB VAL 15 -9.087 35.049 -44.134 115 HG11 VAL 15 1HG1 VAL 15 -10.955 35.433 -45.604 116 HG12 VAL 15 2HG1 VAL 15 -10.244 33.857 -46.001 117 HG13 VAL 15 3HG1 VAL 15 -11.754 33.940 -45.077 118 HG21 VAL 15 3HG2 VAL 15 -11.729 34.645 -42.674 119 HG22 VAL 15 1HG2 VAL 15 -10.230 35.273 -41.951 120 HG23 VAL 15 2HG2 VAL 15 -11.047 36.187 -43.223 121 H SER 16 H SER 16 -7.047 33.549 -43.711 122 HA SER 16 HA SER 16 -6.573 34.226 -40.898 123 HB2 SER 16 2HB SER 16 -6.103 31.765 -41.043 124 HB3 SER 16 3HB SER 16 -4.878 32.107 -42.281 125 HG SER 16 HG SER 16 -3.922 31.982 -40.229 126 H TYR 17 H TYR 17 -4.867 35.703 -40.684 127 HA TYR 17 HA TYR 17 -3.292 36.533 -43.029 128 HB2 TYR 17 2HB TYR 17 -4.253 38.817 -43.085 129 HB3 TYR 17 3HB TYR 17 -5.399 37.586 -43.567 130 HD1 TYR 17 HD1 TYR 17 -7.303 36.940 -42.066 131 HD2 TYR 17 HD2 TYR 17 -4.636 40.194 -41.105 132 HE1 TYR 17 HE1 TYR 17 -8.908 37.746 -40.350 133 HE2 TYR 17 HE2 TYR 17 -6.247 40.999 -39.384 134 HH TYR 17 HH TYR 17 -9.352 39.322 -38.744 135 H GLU 18 H GLU 18 -4.245 37.248 -39.813 136 HA GLU 18 HA GLU 18 -1.485 37.734 -38.914 137 HB2 GLU 18 3HB GLU 18 -3.678 39.806 -38.492 138 HB3 GLU 18 2HB GLU 18 -2.192 39.732 -37.542 139 HG2 GLU 18 3HG GLU 18 -0.853 40.025 -39.630 140 HG3 GLU 18 2HG GLU 18 -2.353 40.232 -40.539 141 H THR 19 H THR 19 -4.776 37.657 -38.098 142 HA THR 19 HA THR 19 -6.098 36.460 -36.650 143 HB THR 19 HB THR 19 -4.052 34.307 -37.225 144 HG1 THR 19 HG1 THR 19 -4.973 34.133 -39.195 145 HG21 THR 19 1HG2 THR 19 -7.107 34.306 -37.072 146 HG22 THR 19 2HG2 THR 19 -6.086 32.912 -37.480 147 HG23 THR 19 3HG2 THR 19 -6.009 33.614 -35.855 148 H ASP 20 H ASP 20 -5.940 37.479 -34.652 149 HA ASP 20 HA ASP 20 -3.880 36.857 -32.740 150 HB2 ASP 20 2HB ASP 20 -5.102 38.293 -31.243 151 HB3 ASP 20 3HB ASP 20 -5.120 39.023 -32.836 152 H ARG 21 H ARG 21 -5.071 34.418 -30.585 153 HA ARG 21 HA ARG 21 -3.335 36.857 -30.804 154 HB2 ARG 21 2HB ARG 21 -3.406 37.117 -28.483 155 HB3 ARG 21 3HB ARG 21 -5.059 37.038 -29.054 156 HG2 ARG 21 2HG ARG 21 -5.438 34.883 -28.145 157 HG3 ARG 21 3HG ARG 21 -3.718 34.525 -27.968 158 HD2 ARG 21 2HD ARG 21 -5.195 36.654 -26.376 159 HD3 ARG 21 3HD ARG 21 -4.833 35.011 -25.811 160 HE ARG 21 HE ARG 21 -2.416 36.256 -26.722 161 HH11 ARG 21 1HH2 ARG 21 -4.512 36.304 -23.904 162 HH12 ARG 21 2HH2 ARG 21 -3.163 36.666 -22.850 163 HH21 ARG 21 1HH1 ARG 21 -0.877 36.829 -25.381 164 HH22 ARG 21 2HH1 ARG 21 -1.186 37.144 -23.683 165 H ASN 22 H ASN 22 -2.990 33.652 -31.239 166 HA ASN 22 HA ASN 22 -0.130 33.797 -30.545 167 HB2 ASN 22 2HB ASN 22 -1.054 32.913 -28.510 168 HB3 ASN 22 3HB ASN 22 -1.914 31.640 -29.377 169 HD21 ASN 22 1HD2 ASN 22 1.494 32.933 -29.186 170 HD22 ASN 22 2HD2 ASN 22 2.188 31.320 -29.090 171 H HIS 23 H HIS 23 -1.282 31.107 -33.385 172 HA HIS 23 HA HIS 23 -3.243 31.561 -31.191 173 HB2 HIS 23 2HB HIS 23 -4.970 31.933 -32.891 174 HB3 HIS 23 3HB HIS 23 -3.723 33.164 -33.022 175 HD2 HIS 23 HD2 HIS 23 -5.466 30.485 -35.021 176 HE1 HIS 23 HE1 HIS 23 -2.271 31.810 -37.517 177 HE2 HIS 23 HE2 HIS 23 -4.399 30.415 -37.429 178 H ASP 24 H ASP 24 -4.936 29.957 -31.115 179 HA ASP 24 HA ASP 24 -4.023 27.282 -31.917 180 HB2 ASP 24 2HB ASP 24 -5.793 26.447 -30.529 181 HB3 ASP 24 3HB ASP 24 -4.783 27.580 -29.652 182 H LEU 25 H LEU 25 -5.250 25.802 -33.066 183 HA LEU 25 HA LEU 25 -6.714 27.072 -35.320 184 HB2 LEU 25 2HB LEU 25 -5.391 24.361 -35.121 185 HB3 LEU 25 3HB LEU 25 -6.130 25.071 -36.558 186 HG LEU 25 HG LEU 25 -3.654 26.133 -35.119 187 HD11 LEU 25 1HD1 LEU 25 -2.459 25.399 -37.129 188 HD12 LEU 25 2HD1 LEU 25 -3.278 24.034 -36.356 189 HD13 LEU 25 3HD1 LEU 25 -3.970 24.767 -37.822 190 HD21 LEU 25 3HD2 LEU 25 -3.411 27.623 -37.093 191 HD22 LEU 25 1HD2 LEU 25 -5.005 27.096 -37.679 192 HD23 LEU 25 2HD2 LEU 25 -4.854 28.002 -36.153 193 H ALA 26 H ALA 26 -8.512 27.283 -33.858 194 HA ALA 26 HA ALA 26 -10.483 25.143 -34.362 195 HB1 ALA 26 3HB ALA 26 -9.650 24.574 -32.154 196 HB2 ALA 26 1HB ALA 26 -9.901 26.239 -31.589 197 HB3 ALA 26 2HB ALA 26 -11.297 25.220 -32.016 198 HA PRO 27 HA PRO 27 -12.860 28.963 -35.049 199 HB2 PRO 27 2HB PRO 27 -15.137 27.038 -35.503 200 HB3 PRO 27 3HB PRO 27 -14.580 28.410 -36.504 201 HG2 PRO 27 2HG PRO 27 -14.009 25.860 -37.205 202 HG3 PRO 27 3HG PRO 27 -12.740 27.124 -37.336 203 HD2 PRO 27 2HD PRO 27 -13.183 25.152 -35.059 204 HD3 PRO 27 3HD PRO 27 -11.687 25.503 -35.982 205 H ARG 28 H ARG 28 -12.453 29.218 -32.652 206 HA ARG 28 HA ARG 28 -15.031 29.294 -31.185 207 HB2 ARG 28 2HB ARG 28 -14.102 28.273 -29.218 208 HB3 ARG 28 3HB ARG 28 -13.895 27.206 -30.608 209 HG2 ARG 28 2HG ARG 28 -11.519 27.896 -30.807 210 HG3 ARG 28 3HG ARG 28 -11.717 28.962 -29.405 211 HD2 ARG 28 2HD ARG 28 -12.262 27.041 -27.982 212 HD3 ARG 28 3HD ARG 28 -12.183 25.951 -29.382 213 HE ARG 28 HE ARG 28 -9.684 27.254 -29.283 214 HH11 ARG 28 2HH2 ARG 28 -11.394 25.014 -27.169 215 HH12 ARG 28 1HH2 ARG 28 -9.898 24.364 -26.554 216 HH21 ARG 28 1HH1 ARG 28 -7.957 26.422 -28.546 217 HH22 ARG 28 2HH1 ARG 28 -7.933 25.149 -27.318 218 H GLN 29 H GLN 29 -14.920 30.393 -29.129 219 HA GLN 29 HA GLN 29 -13.348 32.934 -29.118 220 HB2 GLN 29 2HB GLN 29 -16.354 32.710 -28.704 221 HB3 GLN 29 3HB GLN 29 -15.394 34.183 -28.694 222 HG2 GLN 29 2HG GLN 29 -15.669 34.454 -30.912 223 HG3 GLN 29 3HG GLN 29 -15.070 32.831 -31.257 224 HE21 GLN 29 1HE2 GLN 29 -16.813 31.119 -30.186 225 HE22 GLN 29 2HE2 GLN 29 -18.406 31.334 -30.915 226 H ILE 30 H ILE 30 -12.217 32.411 -27.250 227 HA ILE 30 HA ILE 30 -13.549 31.531 -24.807 228 HB ILE 30 HB ILE 30 -10.723 32.490 -25.361 229 HG12 ILE 30 2HG1 ILE 30 -10.110 30.156 -24.935 230 HG13 ILE 30 3HG1 ILE 30 -11.805 29.731 -24.685 231 HG21 ILE 30 1HG2 ILE 30 -11.274 32.990 -23.010 232 HG22 ILE 30 2HG2 ILE 30 -11.973 31.369 -22.804 233 HG23 ILE 30 3HG2 ILE 30 -10.228 31.578 -23.069 234 HD11 ILE 30 3HD1 ILE 30 -12.283 29.867 -27.008 235 HD12 ILE 30 1HD1 ILE 30 -10.722 30.678 -27.351 236 HD13 ILE 30 2HD1 ILE 30 -10.769 28.977 -26.844 237 H ALA 31 H ALA 31 -14.938 32.852 -23.941 238 HA ALA 31 HA ALA 31 -14.266 35.723 -23.461 239 HB1 ALA 31 3HB ALA 31 -16.647 35.859 -22.710 240 HB2 ALA 31 1HB ALA 31 -16.460 35.378 -24.404 241 HB3 ALA 31 2HB ALA 31 -16.860 34.156 -23.175 242 H ARG 32 H ARG 32 -14.582 36.531 -21.291 243 HA ARG 32 HA ARG 32 -14.162 34.524 -19.107 244 HB2 ARG 32 2HB ARG 32 -12.739 37.094 -19.681 245 HB3 ARG 32 3HB ARG 32 -13.242 36.858 -18.003 246 HG2 ARG 32 2HG ARG 32 -12.169 34.702 -17.889 247 HG3 ARG 32 3HG ARG 32 -11.673 34.794 -19.592 248 HD2 ARG 32 2HD ARG 32 -10.123 36.549 -19.132 249 HD3 ARG 32 3HD ARG 32 -10.809 36.835 -17.512 250 HE ARG 32 HE ARG 32 -9.930 34.137 -17.619 251 HH11 ARG 32 2HH2 ARG 32 -8.408 37.289 -17.541 252 HH12 ARG 32 1HH2 ARG 32 -6.990 36.664 -16.741 253 HH21 ARG 32 1HH1 ARG 32 -8.178 33.411 -16.621 254 HH22 ARG 32 2HH1 ARG 32 -6.854 34.498 -16.236 255 H TYR 33 H TYR 33 -15.219 34.822 -17.172 256 HA TYR 33 HA TYR 33 -17.269 36.946 -17.025 257 HB2 TYR 33 2HB TYR 33 -17.898 34.017 -16.580 258 HB3 TYR 33 3HB TYR 33 -18.945 35.352 -16.208 259 HD1 TYR 33 HD2 TYR 33 -17.232 33.633 -19.068 260 HD2 TYR 33 HD1 TYR 33 -20.423 36.206 -17.777 261 HE1 TYR 33 HE2 TYR 33 -18.311 33.446 -21.311 262 HE2 TYR 33 HE1 TYR 33 -21.472 36.048 -20.026 263 HH TYR 33 HH TYR 33 -21.434 35.072 -22.015 264 H ARG 34 H ARG 34 -17.687 37.652 -14.999 265 HA ARG 34 HA ARG 34 -15.976 36.652 -12.761 266 HB2 ARG 34 2HB ARG 34 -15.565 38.940 -13.698 267 HB3 ARG 34 3HB ARG 34 -17.192 39.410 -13.199 268 HG2 ARG 34 2HG ARG 34 -16.609 38.891 -10.831 269 HG3 ARG 34 3HG ARG 34 -14.989 38.414 -11.318 270 HD2 ARG 34 2HD ARG 34 -16.262 41.156 -11.547 271 HD3 ARG 34 3HD ARG 34 -14.990 40.652 -10.412 272 HE ARG 34 HE ARG 34 -13.720 40.197 -12.752 273 HH11 ARG 34 1HH1 ARG 34 -15.458 43.103 -11.792 274 HH12 ARG 34 2HH1 ARG 34 -14.457 44.100 -12.811 275 HH21 ARG 34 1HH2 ARG 34 -12.543 41.428 -13.898 276 HH22 ARG 34 2HH2 ARG 34 -12.801 43.172 -14.016 277 H THR 35 H THR 35 -16.855 35.868 -11.009 278 HA THR 35 HA THR 35 -19.774 35.575 -10.783 279 HB THR 35 HB THR 35 -19.289 34.168 -8.807 280 HG1 THR 35 HG1 THR 35 -16.607 34.568 -9.394 281 HG21 THR 35 1HG2 THR 35 -18.049 32.389 -9.904 282 HG22 THR 35 2HG2 THR 35 -19.261 33.096 -10.995 283 HG23 THR 35 3HG2 THR 35 -17.545 33.484 -11.206 284 H ASP 36 H ASP 36 -20.533 35.688 -8.314 285 HA ASP 36 HA ASP 36 -20.482 38.558 -7.751 286 HB2 ASP 36 2HB ASP 36 -22.588 37.194 -7.786 287 HB3 ASP 36 3HB ASP 36 -22.005 36.294 -6.387 288 H ASN 37 H ASN 37 -18.676 35.899 -6.751 289 HA ASN 37 HA ASN 37 -17.855 37.055 -4.147 290 HB2 ASN 37 2HB ASN 37 -18.675 34.735 -4.295 291 HB3 ASN 37 3HB ASN 37 -17.444 34.352 -5.471 292 HD21 ASN 37 1HD2 ASN 37 -16.094 32.937 -4.420 293 HD22 ASN 37 2HD2 ASN 37 -15.520 33.165 -2.803 294 H GLY 38 H GLY 38 -17.163 37.841 -7.136 295 HA2 GLY 38 HA2 GLY 38 -15.408 39.098 -8.007 296 HA3 GLY 38 HA3 GLY 38 -14.354 38.601 -6.673 297 H GLU 39 H GLU 39 -15.685 35.818 -7.898 298 HA GLU 39 HA GLU 39 -12.990 35.080 -8.718 299 HB2 GLU 39 2HB GLU 39 -15.333 33.190 -8.736 300 HB3 GLU 39 3HB GLU 39 -13.630 32.861 -8.503 301 HG2 GLU 39 2HG GLU 39 -14.149 34.502 -6.347 302 HG3 GLU 39 3HG GLU 39 -15.780 33.875 -6.682 303 H GLU 40 H GLU 40 -12.287 35.247 -10.706 304 HA GLU 40 HA GLU 40 -14.173 35.402 -12.974 305 HB2 GLU 40 2HB GLU 40 -11.202 35.992 -12.761 306 HB3 GLU 40 3HB GLU 40 -12.182 36.215 -14.221 307 HG2 GLU 40 2HG GLU 40 -13.635 37.786 -13.051 308 HG3 GLU 40 3HG GLU 40 -12.712 37.607 -11.562 309 H PHE 41 H PHE 41 -14.461 33.856 -14.438 310 HA PHE 41 HA PHE 41 -12.453 31.668 -14.830 311 HB2 PHE 41 2HB PHE 41 -15.470 31.450 -14.669 312 HB3 PHE 41 3HB PHE 41 -14.398 30.157 -15.130 313 HD1 PHE 41 HD1 PHE 41 -15.581 32.219 -12.245 314 HD2 PHE 41 HD2 PHE 41 -12.970 29.012 -13.489 315 HE1 PHE 41 HE1 PHE 41 -15.304 31.516 -9.930 316 HE2 PHE 41 HE2 PHE 41 -12.621 28.377 -11.123 317 HZ PHE 41 HZ PHE 41 -13.795 29.627 -9.322 318 H GLU 42 H GLU 42 -12.702 30.508 -16.847 319 HA GLU 42 HA GLU 42 -13.391 32.344 -19.082 320 HB2 GLU 42 2HB GLU 42 -11.471 29.998 -19.298 321 HB3 GLU 42 3HB GLU 42 -11.721 31.361 -20.369 322 HG2 GLU 42 2HG GLU 42 -9.800 32.058 -19.388 323 HG3 GLU 42 3HG GLU 42 -10.989 32.817 -18.335 324 H VAL 43 H VAL 43 -14.749 31.771 -20.638 325 HA VAL 43 HA VAL 43 -15.759 28.941 -20.785 326 HB VAL 43 HB VAL 43 -17.413 31.416 -21.255 327 HG11 VAL 43 1HG1 VAL 43 -19.272 29.881 -21.330 328 HG12 VAL 43 2HG1 VAL 43 -18.098 29.376 -22.530 329 HG13 VAL 43 3HG1 VAL 43 -18.209 28.492 -20.994 330 HG21 VAL 43 3HG2 VAL 43 -16.820 31.161 -18.818 331 HG22 VAL 43 1HG2 VAL 43 -18.520 31.007 -19.190 332 HG23 VAL 43 2HG2 VAL 43 -17.552 29.544 -18.868 333 HA PRO 44 HA PRO 44 -14.500 29.628 -25.112 334 HB2 PRO 44 2HB PRO 44 -14.623 26.662 -25.216 335 HB3 PRO 44 3HB PRO 44 -13.307 27.759 -25.711 336 HG2 PRO 44 2HG PRO 44 -13.151 26.230 -23.438 337 HG3 PRO 44 3HG PRO 44 -12.459 27.880 -23.508 338 HD2 PRO 44 2HD PRO 44 -15.117 27.014 -22.343 339 HD3 PRO 44 3HD PRO 44 -13.889 28.150 -21.693 340 H PHE 45 H PHE 45 -16.004 30.145 -26.467 341 HA PHE 45 HA PHE 45 -18.511 28.538 -26.872 342 HB2 PHE 45 2HB PHE 45 -17.787 31.433 -27.391 343 HB3 PHE 45 3HB PHE 45 -19.171 30.700 -28.144 344 HD1 PHE 45 HD2 PHE 45 -17.641 31.681 -24.899 345 HD2 PHE 45 HD1 PHE 45 -21.203 30.224 -26.855 346 HE1 PHE 45 HE2 PHE 45 -18.965 32.137 -22.856 347 HE2 PHE 45 HE1 PHE 45 -22.515 30.669 -24.783 348 HZ PHE 45 HZ PHE 45 -21.376 31.624 -22.776 349 H ALA 46 H ALA 46 -19.072 27.860 -28.948 350 HA ALA 46 HA ALA 46 -16.870 27.674 -30.933 351 HB1 ALA 46 3HB ALA 46 -18.358 26.062 -32.039 352 HB2 ALA 46 1HB ALA 46 -18.083 25.630 -30.342 353 HB3 ALA 46 2HB ALA 46 -19.619 26.384 -30.826 354 H ASP 47 H ASP 47 -17.208 28.245 -33.158 355 HA ASP 47 HA ASP 47 -18.078 30.873 -33.558 356 HB2 ASP 47 2HB ASP 47 -16.380 29.674 -34.878 357 HB3 ASP 47 3HB ASP 47 -17.629 28.647 -35.584 358 H ASP 48 H ASP 48 -20.061 28.038 -33.611 359 HA ASP 48 HA ASP 48 -22.246 29.248 -35.190 360 HB2 ASP 48 2HB ASP 48 -23.453 27.244 -34.787 361 HB3 ASP 48 3HB ASP 48 -21.811 26.843 -35.279 362 H ALA 49 H ALA 49 -21.156 29.526 -32.038 363 HA ALA 49 HA ALA 49 -23.760 30.552 -30.977 364 HB1 ALA 49 3HB ALA 49 -21.334 29.531 -29.449 365 HB2 ALA 49 1HB ALA 49 -22.869 30.091 -28.753 366 HB3 ALA 49 2HB ALA 49 -22.833 28.614 -29.735 367 H GLU 50 H GLU 50 -23.629 32.435 -29.578 368 HA GLU 50 HA GLU 50 -21.221 34.159 -29.859 369 HB2 GLU 50 2HB GLU 50 -24.088 34.989 -30.431 370 HB3 GLU 50 3HB GLU 50 -22.826 36.145 -29.984 371 HG2 GLU 50 2HG GLU 50 -21.454 35.481 -31.900 372 HG3 GLU 50 3HG GLU 50 -22.638 34.260 -32.358 373 H ILE 51 H ILE 51 -20.712 35.296 -28.142 374 HA ILE 51 HA ILE 51 -21.181 34.358 -25.605 375 HB ILE 51 HB ILE 51 -20.235 37.183 -26.094 376 HG12 ILE 51 2HG1 ILE 51 -19.051 35.841 -27.748 377 HG13 ILE 51 3HG1 ILE 51 -17.969 36.390 -26.472 378 HG21 ILE 51 1HG2 ILE 51 -18.800 36.738 -24.146 379 HG22 ILE 51 2HG2 ILE 51 -20.492 36.458 -23.719 380 HG23 ILE 51 3HG2 ILE 51 -19.415 35.091 -24.038 381 HD11 ILE 51 3HD1 ILE 51 -19.118 33.590 -26.816 382 HD12 ILE 51 1HD1 ILE 51 -17.456 34.108 -27.149 383 HD13 ILE 51 2HD1 ILE 51 -18.045 34.088 -25.486 384 HA PRO 52 HA PRO 52 -24.990 36.655 -24.567 385 HB2 PRO 52 2HB PRO 52 -25.665 35.123 -22.416 386 HB3 PRO 52 3HB PRO 52 -25.984 34.615 -24.105 387 HG2 PRO 52 2HG PRO 52 -23.730 33.786 -22.272 388 HG3 PRO 52 3HG PRO 52 -24.712 32.765 -23.379 389 HD2 PRO 52 2HD PRO 52 -22.188 33.791 -23.966 390 HD3 PRO 52 3HD PRO 52 -23.368 33.372 -25.211 391 H GLY 53 H GLY 53 -25.307 38.175 -22.963 392 HA2 GLY 53 HA2 GLY 53 -23.239 39.540 -21.781 393 HA3 GLY 53 HA3 GLY 53 -24.908 39.610 -21.207 394 H THR 54 H THR 54 -24.920 36.771 -20.264 395 HA THR 54 HA THR 54 -22.720 36.681 -18.329 396 HB THR 54 HB THR 54 -24.308 36.060 -16.470 397 HG1 THR 54 HG1 THR 54 -26.544 36.367 -16.818 398 HG21 THR 54 1HG2 THR 54 -25.319 38.671 -17.662 399 HG22 THR 54 2HG2 THR 54 -25.335 38.167 -15.955 400 HG23 THR 54 3HG2 THR 54 -23.807 38.508 -16.766 401 H TRP 55 H TRP 55 -22.480 34.551 -17.254 402 HA TRP 55 HA TRP 55 -23.802 32.214 -18.410 403 HB2 TRP 55 2HB TRP 55 -22.058 32.913 -20.107 404 HB3 TRP 55 3HB TRP 55 -20.831 32.604 -18.886 405 HD1 TRP 55 HD1 TRP 55 -20.269 30.095 -18.342 406 HE1 TRP 55 HE1 TRP 55 -20.581 27.929 -19.643 407 HE3 TRP 55 HE3 TRP 55 -23.899 31.650 -21.543 408 HZ2 TRP 55 HZ2 TRP 55 -22.370 26.912 -21.704 409 HZ3 TRP 55 HZ3 TRP 55 -24.940 30.056 -23.162 410 HH2 TRP 55 HH2 TRP 55 -24.174 27.693 -23.251 411 H LEU 56 H LEU 56 -23.363 30.267 -17.228 412 HA LEU 56 HA LEU 56 -22.720 30.694 -14.454 413 HB2 LEU 56 2HB LEU 56 -24.207 28.846 -15.911 414 HB3 LEU 56 3HB LEU 56 -22.815 27.903 -15.379 415 HG LEU 56 HG LEU 56 -24.591 29.542 -13.525 416 HD11 LEU 56 1HD1 LEU 56 -24.593 26.544 -14.089 417 HD12 LEU 56 2HD1 LEU 56 -25.571 27.379 -12.860 418 HD13 LEU 56 3HD1 LEU 56 -25.853 27.700 -14.579 419 HD21 LEU 56 3HD2 LEU 56 -22.490 27.398 -12.965 420 HD22 LEU 56 1HD2 LEU 56 -22.362 29.121 -12.573 421 HD23 LEU 56 2HD2 LEU 56 -23.570 28.129 -11.753 422 H CYS 57 H CYS 57 -20.858 30.526 -13.401 423 HA CYS 57 HA CYS 57 -18.411 29.714 -14.870 424 HB2 CYS 57 2HB CYS 57 -18.945 31.360 -12.374 425 HB3 CYS 57 3HB CYS 57 -17.322 30.859 -12.863 426 HG CYS 57 HG CYS 57 -19.522 32.367 -14.813 427 H ARG 58 H ARG 58 -16.676 28.653 -13.627 428 HA ARG 58 HA ARG 58 -17.580 26.092 -12.789 429 HB2 ARG 58 2HB ARG 58 -14.783 27.149 -12.275 430 HB3 ARG 58 3HB ARG 58 -15.277 25.485 -12.549 431 HG2 ARG 58 2HG ARG 58 -15.831 26.060 -14.927 432 HG3 ARG 58 3HG ARG 58 -15.282 27.719 -14.625 433 HD2 ARG 58 2HD ARG 58 -13.050 26.667 -13.867 434 HD3 ARG 58 3HD ARG 58 -13.619 25.187 -14.644 435 HE ARG 58 HE ARG 58 -13.922 26.628 -16.737 436 HH11 ARG 58 1HH2 ARG 58 -11.260 27.391 -14.509 437 HH12 ARG 58 2HH2 ARG 58 -10.569 28.480 -15.709 438 HH21 ARG 58 1HH1 ARG 58 -12.887 28.107 -18.073 439 HH22 ARG 58 2HH1 ARG 58 -11.322 28.726 -17.548 440 H ASN 59 H ASN 59 -17.014 28.909 -10.849 441 HA ASN 59 HA ASN 59 -16.743 27.623 -8.317 442 HB2 ASN 59 2HB ASN 59 -16.154 29.925 -8.663 443 HB3 ASN 59 3HB ASN 59 -17.812 30.332 -9.129 444 HD21 ASN 59 1HD2 ASN 59 -17.719 32.020 -7.510 445 HD22 ASN 59 2HD2 ASN 59 -17.875 31.606 -5.835 446 H GLY 60 H GLY 60 -19.447 27.959 -10.434 447 HA2 GLY 60 HA2 GLY 60 -21.532 26.854 -10.266 448 HA3 GLY 60 HA3 GLY 60 -21.370 26.741 -8.513 449 H MET 61 H MET 61 -20.632 29.841 -9.835 450 HA MET 61 HA MET 61 -23.297 30.975 -9.119 451 HB2 MET 61 2HB MET 61 -21.300 31.595 -7.683 452 HB3 MET 61 3HB MET 61 -20.569 32.309 -9.104 453 HG2 MET 61 2HG MET 61 -21.581 34.043 -7.778 454 HG3 MET 61 3HG MET 61 -22.464 33.897 -9.290 455 HE1 MET 61 3HE MET 61 -22.690 31.825 -5.828 456 HE2 MET 61 1HE MET 61 -22.468 33.545 -5.421 457 HE3 MET 61 2HE MET 61 -24.012 32.737 -5.072 458 H GLU 62 H GLU 62 -24.291 32.337 -10.614 459 HA GLU 62 HA GLU 62 -23.496 32.357 -13.371 460 HB2 GLU 62 2HB GLU 62 -25.149 34.226 -13.577 461 HB3 GLU 62 3HB GLU 62 -25.759 32.667 -13.068 462 HG2 GLU 62 2HG GLU 62 -25.107 34.669 -10.901 463 HG3 GLU 62 3HG GLU 62 -26.500 34.969 -11.926 464 H GLY 63 H GLY 63 -21.749 33.213 -14.153 465 HA2 GLY 63 HA2 GLY 63 -20.427 35.539 -12.962 466 HA3 GLY 63 HA3 GLY 63 -19.814 34.567 -14.277 467 H THR 64 H THR 64 -20.152 37.533 -14.045 468 HA THR 64 HA THR 64 -21.822 37.971 -16.479 469 HB THR 64 HB THR 64 -20.668 40.008 -14.542 470 HG1 THR 64 HG1 THR 64 -22.787 40.195 -13.827 471 HG21 THR 64 1HG2 THR 64 -22.358 41.561 -15.648 472 HG22 THR 64 2HG2 THR 64 -20.993 41.110 -16.671 473 HG23 THR 64 3HG2 THR 64 -22.568 40.331 -16.915 474 H LEU 65 H LEU 65 -21.010 38.818 -18.339 475 HA LEU 65 HA LEU 65 -18.390 38.080 -19.056 476 HB2 LEU 65 2HB LEU 65 -20.481 38.206 -20.414 477 HB3 LEU 65 3HB LEU 65 -20.362 39.947 -20.412 478 HG LEU 65 HG LEU 65 -18.657 37.860 -21.821 479 HD11 LEU 65 1HD1 LEU 65 -20.806 38.625 -22.821 480 HD12 LEU 65 2HD1 LEU 65 -20.209 40.295 -22.809 481 HD13 LEU 65 3HD1 LEU 65 -19.415 39.075 -23.822 482 HD21 LEU 65 3HD2 LEU 65 -16.952 39.414 -21.188 483 HD22 LEU 65 1HD2 LEU 65 -17.354 39.734 -22.865 484 HD23 LEU 65 2HD2 LEU 65 -17.982 40.818 -21.601 485 H ILE 66 H ILE 66 -16.482 39.052 -18.708 486 HA ILE 66 HA ILE 66 -16.265 42.016 -18.654 487 HB ILE 66 HB ILE 66 -14.663 42.036 -16.911 488 HG12 ILE 66 2HG1 ILE 66 -13.436 40.006 -17.040 489 HG13 ILE 66 3HG1 ILE 66 -14.169 40.072 -15.442 490 HG21 ILE 66 1HG2 ILE 66 -16.019 41.566 -14.977 491 HG22 ILE 66 2HG2 ILE 66 -17.024 42.228 -16.280 492 HG23 ILE 66 3HG2 ILE 66 -17.067 40.495 -15.913 493 HD11 ILE 66 3HD1 ILE 66 -15.965 38.560 -16.295 494 HD12 ILE 66 1HD1 ILE 66 -14.927 38.340 -17.720 495 HD13 ILE 66 2HD1 ILE 66 -14.336 37.867 -16.116 496 H GLU 67 H GLU 67 -14.226 42.873 -19.240 497 HA GLU 67 HA GLU 67 -12.589 41.182 -21.058 498 HB2 GLU 67 2HB GLU 67 -12.532 44.165 -20.467 499 HB3 GLU 67 3HB GLU 67 -11.427 43.323 -21.560 500 HG2 GLU 67 2HG GLU 67 -13.361 42.577 -22.942 501 HG3 GLU 67 3HG GLU 67 -14.457 43.473 -21.888 502 H GLY 68 H GLY 68 -10.347 40.911 -20.768 503 HA2 GLY 68 HA2 GLY 68 -9.432 40.409 -18.116 504 HA3 GLY 68 HA3 GLY 68 -8.458 40.371 -19.588 505 H ASP 69 H ASP 69 -9.446 43.416 -19.742 506 HA ASP 69 HA ASP 69 -8.503 45.434 -19.414 507 HB2 ASP 69 2HB ASP 69 -9.875 45.041 -17.391 508 HB3 ASP 69 3HB ASP 69 -8.429 44.528 -16.524 509 H LEU 70 H LEU 70 -6.609 43.951 -20.533 510 HA LEU 70 HA LEU 70 -4.054 44.027 -19.206 511 HB2 LEU 70 2HB LEU 70 -4.931 43.780 -22.109 512 HB3 LEU 70 3HB LEU 70 -3.245 43.914 -21.683 513 HG LEU 70 HG LEU 70 -3.838 41.629 -22.116 514 HD11 LEU 70 1HD1 LEU 70 -3.231 41.972 -19.153 515 HD12 LEU 70 2HD1 LEU 70 -2.857 40.572 -20.174 516 HD13 LEU 70 3HD1 LEU 70 -2.046 42.116 -20.475 517 HD21 LEU 70 3HD2 LEU 70 -5.633 41.656 -19.669 518 HD22 LEU 70 1HD2 LEU 70 -6.211 41.662 -21.356 519 HD23 LEU 70 2HD2 LEU 70 -5.278 40.289 -20.737 520 HA PRO 71 HA PRO 71 -3.120 48.347 -19.752 521 HB2 PRO 71 2HB PRO 71 -0.474 48.441 -19.201 522 HB3 PRO 71 3HB PRO 71 -1.653 47.842 -18.004 523 HG2 PRO 71 2HG PRO 71 -0.001 46.173 -19.943 524 HG3 PRO 71 3HG PRO 71 -0.112 45.997 -18.160 525 HD2 PRO 71 2HD PRO 71 -1.667 44.533 -19.866 526 HD3 PRO 71 3HD PRO 71 -2.280 45.103 -18.286 527 H GLU 72 H GLU 72 -3.641 47.286 -22.178 528 HA GLU 72 HA GLU 72 -3.070 46.866 -24.368 529 HB2 GLU 72 2HB GLU 72 -2.832 49.023 -25.574 530 HB3 GLU 72 3HB GLU 72 -4.177 48.898 -24.451 531 HG2 GLU 72 2HG GLU 72 -3.103 50.305 -22.820 532 HG3 GLU 72 3HG GLU 72 -1.577 50.268 -23.695 533 HA PRO 73 HA PRO 73 1.560 46.595 -23.944 534 HB2 PRO 73 2HB PRO 73 1.893 43.879 -24.034 535 HB3 PRO 73 3HB PRO 73 1.488 44.771 -22.534 536 HG2 PRO 73 2HG PRO 73 -0.422 43.340 -24.417 537 HG3 PRO 73 3HG PRO 73 -0.309 43.194 -22.632 538 HD2 PRO 73 2HD PRO 73 -2.123 44.842 -23.804 539 HD3 PRO 73 3HD PRO 73 -1.278 45.316 -22.301 540 H LYS 74 H LYS 74 2.988 46.465 -25.595 541 HA LYS 74 HA LYS 74 1.946 46.094 -28.321 542 HB2 LYS 74 2HB LYS 74 3.928 47.196 -29.058 543 HB3 LYS 74 3HB LYS 74 3.291 48.070 -27.667 544 HG2 LYS 74 2HG LYS 74 5.006 46.949 -26.210 545 HG3 LYS 74 3HG LYS 74 5.650 46.120 -27.640 546 HD2 LYS 74 2HD LYS 74 6.166 48.313 -28.682 547 HD3 LYS 74 3HD LYS 74 5.523 49.145 -27.248 548 HE2 LYS 74 2HE LYS 74 7.224 48.009 -25.833 549 HE3 LYS 74 3HE LYS 74 7.864 47.183 -27.260 550 HZ1 LYS 74 HZ1 LYS 74 8.437 49.366 -28.185 551 HZ2 LYS 74 HZ2 LYS 74 7.844 50.131 -26.867 552 HZ3 LYS 74 HZ3 LYS 74 9.156 49.171 -26.734 553 H LYS 75 H LYS 75 3.557 44.031 -26.177 554 HA LYS 75 HA LYS 75 5.375 42.683 -27.918 555 HB2 LYS 75 2HB LYS 75 5.492 42.663 -25.446 556 HB3 LYS 75 3HB LYS 75 4.025 41.675 -25.376 557 HG2 LYS 75 2HG LYS 75 5.183 39.845 -26.582 558 HG3 LYS 75 3HG LYS 75 6.634 40.857 -26.739 559 HD2 LYS 75 2HD LYS 75 6.846 40.928 -24.266 560 HD3 LYS 75 3HD LYS 75 5.391 39.918 -24.112 561 HE2 LYS 75 2HE LYS 75 6.511 38.106 -25.385 562 HE3 LYS 75 3HE LYS 75 7.951 39.116 -25.572 563 HZ1 LYS 75 HZ1 LYS 75 8.205 39.095 -23.148 564 HZ2 LYS 75 HZ2 LYS 75 6.874 38.163 -22.969 565 HZ3 LYS 75 HZ3 LYS 75 8.194 37.567 -23.718 566 H VAL 76 H VAL 76 5.164 41.157 -29.374 567 HA VAL 76 HA VAL 76 2.814 39.357 -29.416 568 HB VAL 76 HB VAL 76 2.751 39.420 -31.900 569 HG11 VAL 76 1HG1 VAL 76 1.478 41.466 -32.142 570 HG12 VAL 76 2HG1 VAL 76 1.124 40.726 -30.572 571 HG13 VAL 76 3HG1 VAL 76 2.196 42.142 -30.667 572 HG21 VAL 76 3HG2 VAL 76 4.494 41.911 -31.683 573 HG22 VAL 76 1HG2 VAL 76 5.017 40.342 -32.336 574 HG23 VAL 76 2HG2 VAL 76 3.744 41.260 -33.152 575 H LYS 77 H LYS 77 4.680 36.678 -29.953 576 HA LYS 77 HA LYS 77 1.890 37.745 -30.050 577 HB2 LYS 77 2HB LYS 77 2.890 37.086 -32.339 578 HB3 LYS 77 3HB LYS 77 2.850 35.428 -31.749 579 HG2 LYS 77 2HG LYS 77 0.384 35.733 -31.322 580 HG3 LYS 77 3HG LYS 77 0.484 37.350 -32.022 581 HD2 LYS 77 2HD LYS 77 1.122 36.417 -34.195 582 HD3 LYS 77 3HD LYS 77 1.245 34.787 -33.498 583 HE2 LYS 77 2HE LYS 77 -1.176 34.906 -32.870 584 HE3 LYS 77 3HE LYS 77 -1.295 36.476 -33.675 585 HZ1 LYS 77 HZ1 LYS 77 -0.861 35.435 -35.761 586 HZ2 LYS 77 HZ2 LYS 77 -0.520 33.964 -35.072 587 HZ3 LYS 77 HZ3 LYS 77 -2.033 34.593 -35.044 588 HA PRO 78 HA PRO 78 2.907 34.412 -26.926 589 HB2 PRO 78 2HB PRO 78 2.566 35.653 -24.529 590 HB3 PRO 78 3HB PRO 78 4.027 35.893 -25.535 591 HG2 PRO 78 2HG PRO 78 1.551 37.656 -25.411 592 HG3 PRO 78 3HG PRO 78 3.267 38.152 -25.250 593 HD2 PRO 78 2HD PRO 78 1.929 38.305 -27.624 594 HD3 PRO 78 3HD PRO 78 3.667 37.875 -27.536 595 HA PRO 79 HA PRO 79 -1.401 33.392 -26.142 596 HB2 PRO 79 2HB PRO 79 -1.185 31.072 -24.772 597 HB3 PRO 79 3HB PRO 79 -0.577 31.225 -26.447 598 HG2 PRO 79 2HG PRO 79 1.009 31.454 -23.866 599 HG3 PRO 79 3HG PRO 79 1.386 30.462 -25.310 600 HD2 PRO 79 2HD PRO 79 2.463 32.961 -24.880 601 HD3 PRO 79 3HD PRO 79 2.122 32.324 -26.514 602 H ARG 80 H ARG 80 0.682 34.148 -23.449 603 HA ARG 80 HA ARG 80 -1.384 33.890 -21.369 604 HB2 ARG 80 2HB ARG 80 0.977 33.236 -20.985 605 HB3 ARG 80 3HB ARG 80 1.477 34.918 -21.213 606 HG2 ARG 80 2HG ARG 80 0.109 35.595 -19.253 607 HG3 ARG 80 3HG ARG 80 -0.440 33.918 -19.055 608 HD2 ARG 80 2HD ARG 80 1.899 33.199 -18.679 609 HD3 ARG 80 3HD ARG 80 2.449 34.876 -18.884 610 HE ARG 80 HE ARG 80 0.464 34.834 -16.851 611 HH11 ARG 80 1HH1 ARG 80 3.753 33.702 -17.259 612 HH12 ARG 80 2HH1 ARG 80 4.093 33.800 -15.551 613 HH21 ARG 80 1HH2 ARG 80 0.965 34.934 -14.694 614 HH22 ARG 80 2HH2 ARG 80 2.552 34.480 -14.145
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