NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
277902 | 2kqr | 16610 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY -1 1HT GLY -1 -3.929 -2.659 -31.305 2 H2 GLY -1 2HT GLY -1 -5.533 -2.581 -30.869 3 H3 GLY -1 3HT GLY -1 -5.049 -3.678 -32.077 4 HA2 GLY -1 1HA GLY -1 -5.441 -4.816 -30.007 5 HA3 GLY -1 2HA GLY -1 -3.723 -4.844 -30.386 6 H SER 0 H SER 0 -3.412 -5.192 -28.091 7 HA SER 0 HA SER 0 -2.856 -4.612 -26.038 8 HB2 SER 0 2HB SER 0 -2.814 -1.783 -27.137 9 HB3 SER 0 1HB SER 0 -2.104 -2.275 -25.600 10 HG SER 0 HG SER 0 -1.369 -3.782 -27.777 11 H MET 1 H MET 1 -4.526 -5.246 -24.852 12 HA MET 1 HA MET 1 -6.947 -3.710 -24.632 13 HB2 MET 1 2HB MET 1 -7.055 -6.146 -24.583 14 HB3 MET 1 1HB MET 1 -5.975 -6.189 -23.201 15 HG2 MET 1 2HG MET 1 -7.680 -5.041 -21.850 16 HG3 MET 1 1HG MET 1 -8.768 -5.055 -23.236 17 HE1 MET 1 3HE MET 1 -10.638 -6.237 -21.716 18 HE2 MET 1 1HE MET 1 -9.514 -6.200 -20.355 19 HE3 MET 1 2HE MET 1 -10.328 -7.700 -20.777 20 H THR 2 H THR 2 -7.120 -2.012 -23.292 21 HA THR 2 HA THR 2 -5.221 -1.597 -21.182 22 HB THR 2 HB THR 2 -7.703 -0.059 -22.004 23 HG1 THR 2 1HG THR 2 -5.135 0.963 -22.284 24 HG21 THR 2 3HG2 THR 2 -7.166 0.336 -19.643 25 HG22 THR 2 1HG2 THR 2 -6.805 1.767 -20.610 26 HG23 THR 2 2HG2 THR 2 -5.497 0.712 -20.079 27 H VAL 3 H VAL 3 -5.512 -2.295 -19.182 28 HA VAL 3 HA VAL 3 -8.189 -3.280 -18.444 29 HB VAL 3 HB VAL 3 -5.633 -3.860 -16.950 30 HG11 VAL 3 1HG1 VAL 3 -7.647 -4.262 -15.710 31 HG12 VAL 3 2HG1 VAL 3 -6.835 -5.782 -16.165 32 HG13 VAL 3 3HG1 VAL 3 -8.255 -5.257 -17.049 33 HG21 VAL 3 3HG2 VAL 3 -6.847 -5.575 -19.101 34 HG22 VAL 3 1HG2 VAL 3 -5.529 -6.005 -18.012 35 HG23 VAL 3 2HG2 VAL 3 -5.300 -4.710 -19.198 36 H TYR 4 H TYR 4 -9.236 -2.321 -16.779 37 HA TYR 4 HA TYR 4 -7.858 -0.117 -15.472 38 HB2 TYR 4 2HB TYR 4 -10.795 -0.708 -15.818 39 HB3 TYR 4 1HB TYR 4 -10.133 0.700 -14.990 40 HD1 TYR 4 2HD TYR 4 -10.574 -0.921 -18.268 41 HD2 TYR 4 1HD TYR 4 -9.184 2.525 -16.219 42 HE1 TYR 4 2HE TYR 4 -10.448 0.272 -20.392 43 HE2 TYR 4 1HE TYR 4 -9.050 3.739 -18.337 44 HH TYR 4 HH TYR 4 -10.500 2.631 -21.158 45 H ILE 5 H ILE 5 -7.606 -0.047 -13.326 46 HA ILE 5 HA ILE 5 -8.554 -2.371 -11.753 47 HB ILE 5 HB ILE 5 -6.079 -0.725 -11.200 48 HG12 ILE 5 2HG1 ILE 5 -4.701 -2.553 -11.668 49 HG13 ILE 5 1HG1 ILE 5 -5.949 -3.650 -12.124 50 HG21 ILE 5 1HG2 ILE 5 -7.046 -1.619 -9.202 51 HG22 ILE 5 2HG2 ILE 5 -5.525 -2.444 -9.539 52 HG23 ILE 5 3HG2 ILE 5 -7.054 -3.242 -9.892 53 HD11 ILE 5 3HD1 ILE 5 -4.891 -1.234 -13.636 54 HD12 ILE 5 1HD1 ILE 5 -6.353 -2.091 -14.115 55 HD13 ILE 5 2HD1 ILE 5 -4.804 -2.925 -14.112 56 H CYS 6 H CYS 6 -10.005 -1.761 -10.279 57 HA CYS 6 HA CYS 6 -9.476 0.667 -8.752 58 HB2 CYS 6 2HB CYS 6 -12.209 -0.436 -9.455 59 HB3 CYS 6 1HB CYS 6 -11.932 0.822 -8.265 60 HG CYS 6 HG CYS 6 -12.959 1.663 -10.873 61 HA PRO 7 HA PRO 7 -8.957 -2.898 -5.937 62 HB2 PRO 7 2HB PRO 7 -7.818 -0.706 -4.288 63 HB3 PRO 7 1HB PRO 7 -7.125 -2.283 -4.684 64 HG2 PRO 7 2HG PRO 7 -6.184 -0.070 -5.824 65 HG3 PRO 7 1HG PRO 7 -6.346 -1.571 -6.750 66 HD2 PRO 7 2HD PRO 7 -8.089 0.860 -6.755 67 HD3 PRO 7 1HD PRO 7 -7.561 -0.162 -8.113 68 H GLU 8 H GLU 8 -10.361 0.141 -5.629 69 HA GLU 8 HA GLU 8 -11.567 -0.187 -3.073 70 HB2 GLU 8 2HB GLU 8 -12.755 1.923 -3.719 71 HB3 GLU 8 1HB GLU 8 -11.005 2.032 -3.612 72 HG2 GLU 8 2HG GLU 8 -10.940 1.817 -6.110 73 HG3 GLU 8 1HG GLU 8 -12.700 1.874 -6.100 74 H THR 9 H THR 9 -13.068 0.192 -6.341 75 HA THR 9 HA THR 9 -15.466 -0.931 -5.139 76 HB THR 9 HB THR 9 -16.681 0.398 -6.848 77 HG1 THR 9 1HG THR 9 -15.578 1.493 -8.282 78 HG21 THR 9 3HG2 THR 9 -14.798 1.928 -5.032 79 HG22 THR 9 1HG2 THR 9 -16.359 1.256 -4.560 80 HG23 THR 9 2HG2 THR 9 -16.286 2.578 -5.732 81 H GLY 10 H GLY 10 -13.074 -1.886 -7.244 82 HA2 GLY 10 2HA GLY 10 -15.046 -3.237 -8.905 83 HA3 GLY 10 1HA GLY 10 -13.410 -3.135 -9.452 84 H ASP 11 H ASP 11 -12.992 -5.320 -9.601 85 HA ASP 11 HA ASP 11 -12.716 -6.812 -7.180 86 HB2 ASP 11 2HB ASP 11 -15.162 -7.031 -7.576 87 HB3 ASP 11 1HB ASP 11 -14.812 -7.761 -9.139 88 H ASP 12 H ASP 12 -11.431 -8.502 -7.391 89 HA ASP 12 HA ASP 12 -9.580 -8.673 -9.501 90 HB2 ASP 12 2HB ASP 12 -9.181 -9.373 -7.137 91 HB3 ASP 12 1HB ASP 12 -10.232 -10.750 -7.401 92 H GLY 13 H GLY 13 -12.696 -10.188 -9.143 93 HA2 GLY 13 2HA GLY 13 -12.077 -12.285 -11.048 94 HA3 GLY 13 1HA GLY 13 -13.532 -12.099 -10.106 95 H ASN 14 H ASN 14 -12.701 -9.146 -11.553 96 HA ASN 14 HA ASN 14 -14.931 -9.450 -13.376 97 HB2 ASN 14 2HB ASN 14 -13.300 -7.021 -12.664 98 HB3 ASN 14 1HB ASN 14 -14.605 -7.013 -13.840 99 HD21 ASN 14 1HD2 ASN 14 -14.378 -5.529 -11.403 100 HD22 ASN 14 2HD2 ASN 14 -15.739 -6.011 -10.449 101 H ASP 15 H ASP 15 -14.590 -7.956 -15.464 102 HA ASP 15 HA ASP 15 -12.656 -9.387 -17.084 103 HB2 ASP 15 2HB ASP 15 -14.701 -7.295 -17.846 104 HB3 ASP 15 1HB ASP 15 -13.669 -8.142 -18.985 105 H GLY 16 H GLY 16 -12.614 -6.609 -15.301 106 HA2 GLY 16 2HA GLY 16 -11.008 -5.005 -15.050 107 HA3 GLY 16 1HA GLY 16 -10.082 -5.879 -16.268 108 H SER 17 H SER 17 -13.251 -4.430 -16.733 109 HA SER 17 HA SER 17 -12.055 -2.646 -18.714 110 HB2 SER 17 2HB SER 17 -14.413 -2.273 -19.425 111 HB3 SER 17 1HB SER 17 -13.955 -3.977 -19.495 112 HG SER 17 HG SER 17 -15.918 -3.809 -18.571 113 H GLU 18 H GLU 18 -13.422 -0.349 -18.715 114 HA GLU 18 HA GLU 18 -12.731 0.780 -16.278 115 HB2 GLU 18 2HB GLU 18 -12.714 2.082 -18.365 116 HB3 GLU 18 1HB GLU 18 -14.454 1.906 -18.520 117 HG2 GLU 18 2HG GLU 18 -14.726 3.152 -16.399 118 HG3 GLU 18 1HG GLU 18 -12.961 3.284 -16.393 119 H LEU 19 H LEU 19 -15.592 -0.680 -17.546 120 HA LEU 19 HA LEU 19 -17.351 0.425 -15.563 121 HB2 LEU 19 2HB LEU 19 -17.834 -1.744 -17.602 122 HB3 LEU 19 1HB LEU 19 -19.047 -1.006 -16.584 123 HG LEU 19 HG LEU 19 -19.312 -0.124 -18.650 124 HD11 LEU 19 1HD1 LEU 19 -19.494 1.567 -16.972 125 HD12 LEU 19 2HD1 LEU 19 -18.846 2.280 -18.448 126 HD13 LEU 19 3HD1 LEU 19 -17.771 1.930 -17.096 127 HD21 LEU 19 3HD2 LEU 19 -17.267 -0.748 -19.770 128 HD22 LEU 19 1HD2 LEU 19 -16.359 0.456 -18.854 129 HD23 LEU 19 2HD2 LEU 19 -17.564 0.972 -20.031 130 H LYS 20 H LYS 20 -15.417 -2.438 -16.038 131 HA LYS 20 HA LYS 20 -16.271 -3.568 -13.396 132 HB2 LYS 20 2HB LYS 20 -15.369 -5.229 -15.737 133 HB3 LYS 20 1HB LYS 20 -16.098 -5.732 -14.249 134 HG2 LYS 20 2HG LYS 20 -18.281 -4.968 -14.877 135 HG3 LYS 20 1HG LYS 20 -17.646 -4.200 -16.338 136 HD2 LYS 20 2HD LYS 20 -17.002 -6.369 -17.219 137 HD3 LYS 20 1HD LYS 20 -17.535 -7.137 -15.730 138 HE2 LYS 20 2HE LYS 20 -19.297 -5.666 -17.688 139 HE3 LYS 20 1HE LYS 20 -19.159 -7.413 -17.539 140 HZ1 LYS 20 3HZ LYS 20 -21.088 -6.707 -16.374 141 HZ2 LYS 20 1HZ LYS 20 -20.242 -5.553 -15.476 142 HZ3 LYS 20 2HZ LYS 20 -19.956 -7.183 -15.225 143 HA PRO 21 HA PRO 21 -11.811 -2.802 -13.817 144 HB2 PRO 21 2HB PRO 21 -11.481 -1.517 -11.459 145 HB3 PRO 21 1HB PRO 21 -11.918 -0.685 -12.951 146 HG2 PRO 21 2HG PRO 21 -13.650 -1.479 -10.655 147 HG3 PRO 21 1HG PRO 21 -13.709 -0.030 -11.664 148 HD2 PRO 21 2HD PRO 21 -15.374 -2.177 -11.964 149 HD3 PRO 21 1HD PRO 21 -14.963 -1.046 -13.264 150 H LEU 22 H LEU 22 -10.184 -3.832 -12.767 151 HA LEU 22 HA LEU 22 -10.940 -6.097 -11.117 152 HB2 LEU 22 2HB LEU 22 -8.257 -5.144 -12.087 153 HB3 LEU 22 1HB LEU 22 -8.551 -6.662 -11.262 154 HG LEU 22 HG LEU 22 -9.685 -5.905 -13.946 155 HD11 LEU 22 1HD1 LEU 22 -8.146 -7.552 -14.817 156 HD12 LEU 22 2HD1 LEU 22 -7.474 -7.781 -13.202 157 HD13 LEU 22 3HD1 LEU 22 -7.292 -6.234 -14.021 158 HD21 LEU 22 3HD2 LEU 22 -9.770 -8.479 -12.393 159 HD22 LEU 22 1HD2 LEU 22 -10.335 -8.255 -14.049 160 HD23 LEU 22 2HD2 LEU 22 -11.132 -7.407 -12.727 161 H ARG 23 H ARG 23 -9.447 -6.514 -9.120 162 HA ARG 23 HA ARG 23 -9.146 -3.913 -7.900 163 HB2 ARG 23 2HB ARG 23 -9.785 -4.813 -5.718 164 HB3 ARG 23 1HB ARG 23 -11.029 -5.068 -6.893 165 HG2 ARG 23 2HG ARG 23 -10.995 -6.840 -5.505 166 HG3 ARG 23 1HG ARG 23 -10.239 -7.424 -6.989 167 HD2 ARG 23 2HD ARG 23 -8.056 -7.327 -5.970 168 HD3 ARG 23 1HD ARG 23 -8.707 -6.541 -4.530 169 HE ARG 23 HE ARG 23 -10.095 -8.776 -4.495 170 HH11 ARG 23 1HH1 ARG 23 -6.640 -8.460 -5.198 171 HH12 ARG 23 2HH1 ARG 23 -6.221 -9.931 -4.463 172 HH21 ARG 23 1HH2 ARG 23 -9.528 -10.740 -3.460 173 HH22 ARG 23 2HH2 ARG 23 -7.915 -11.286 -3.437 174 H THR 24 H THR 24 -7.469 -6.013 -9.327 175 HA THR 24 HA THR 24 -5.126 -5.673 -7.623 176 HB THR 24 HB THR 24 -5.655 -8.283 -9.037 177 HG1 THR 24 1HG THR 24 -6.885 -8.939 -7.545 178 HG21 THR 24 3HG2 THR 24 -4.154 -9.121 -7.326 179 HG22 THR 24 1HG2 THR 24 -4.086 -7.509 -6.604 180 HG23 THR 24 2HG2 THR 24 -3.423 -7.778 -8.223 181 H LEU 25 H LEU 25 -3.281 -5.343 -8.934 182 HA LEU 25 HA LEU 25 -3.629 -4.914 -11.746 183 HB2 LEU 25 2HB LEU 25 -2.242 -3.444 -10.379 184 HB3 LEU 25 1HB LEU 25 -1.188 -4.777 -9.979 185 HG LEU 25 HG LEU 25 -0.404 -4.885 -12.293 186 HD11 LEU 25 1HD1 LEU 25 -2.447 -4.144 -13.429 187 HD12 LEU 25 2HD1 LEU 25 -1.057 -3.184 -13.917 188 HD13 LEU 25 3HD1 LEU 25 -2.225 -2.519 -12.780 189 HD21 LEU 25 3HD2 LEU 25 0.759 -2.716 -12.331 190 HD22 LEU 25 1HD2 LEU 25 0.744 -3.454 -10.723 191 HD23 LEU 25 2HD2 LEU 25 -0.362 -2.136 -11.100 192 H TYR 26 H TYR 26 -2.438 -7.406 -9.710 193 HA TYR 26 HA TYR 26 -0.907 -9.018 -11.335 194 HB2 TYR 26 2HB TYR 26 -1.311 -9.334 -8.936 195 HB3 TYR 26 1HB TYR 26 -2.978 -9.759 -9.261 196 HD1 TYR 26 1HD TYR 26 0.508 -10.886 -9.335 197 HD2 TYR 26 2HD TYR 26 -3.534 -12.011 -10.087 198 HE1 TYR 26 1HE TYR 26 1.151 -13.216 -9.388 199 HE2 TYR 26 2HE TYR 26 -2.854 -14.373 -10.128 200 HH TYR 26 HH TYR 26 -0.910 -15.721 -10.457 201 H GLN 27 H GLN 27 -4.483 -8.969 -11.003 202 HA GLN 27 HA GLN 27 -4.906 -11.058 -12.881 203 HB2 GLN 27 2HB GLN 27 -6.566 -10.608 -11.169 204 HB3 GLN 27 1HB GLN 27 -6.841 -8.994 -11.774 205 HG2 GLN 27 2HG GLN 27 -8.671 -10.462 -12.413 206 HG3 GLN 27 1HG GLN 27 -7.824 -9.941 -13.843 207 HE21 GLN 27 1HE2 GLN 27 -8.543 -11.657 -15.021 208 HE22 GLN 27 2HE2 GLN 27 -7.994 -13.272 -14.868 209 H ALA 28 H ALA 28 -4.588 -7.569 -13.222 210 HA ALA 28 HA ALA 28 -5.628 -7.269 -15.784 211 HB1 ALA 28 1HB ALA 28 -5.092 -5.389 -14.278 212 HB2 ALA 28 2HB ALA 28 -4.290 -5.198 -15.831 213 HB3 ALA 28 3HB ALA 28 -3.379 -5.764 -14.429 214 H MET 29 H MET 29 -2.430 -8.173 -14.585 215 HA MET 29 HA MET 29 -1.284 -8.385 -17.128 216 HB2 MET 29 2HB MET 29 -0.485 -9.288 -14.401 217 HB3 MET 29 1HB MET 29 0.405 -9.811 -15.821 218 HG2 MET 29 2HG MET 29 0.889 -7.410 -16.357 219 HG3 MET 29 1HG MET 29 0.024 -6.934 -14.915 220 HE1 MET 29 3HE MET 29 3.831 -6.354 -14.374 221 HE2 MET 29 1HE MET 29 2.267 -5.581 -14.616 222 HE3 MET 29 2HE MET 29 3.054 -6.405 -15.960 223 H ILE 30 H ILE 30 -3.079 -10.599 -15.122 224 HA ILE 30 HA ILE 30 -2.393 -12.966 -16.555 225 HB ILE 30 HB ILE 30 -4.913 -12.386 -14.971 226 HG12 ILE 30 2HG1 ILE 30 -2.369 -13.833 -14.190 227 HG13 ILE 30 1HG1 ILE 30 -2.900 -12.263 -13.593 228 HG21 ILE 30 1HG2 ILE 30 -5.211 -14.826 -14.884 229 HG22 ILE 30 2HG2 ILE 30 -3.820 -15.019 -15.951 230 HG23 ILE 30 3HG2 ILE 30 -5.278 -14.213 -16.539 231 HD11 ILE 30 3HD1 ILE 30 -4.821 -13.337 -12.531 232 HD12 ILE 30 1HD1 ILE 30 -3.285 -14.008 -11.986 233 HD13 ILE 30 2HD1 ILE 30 -4.269 -14.899 -13.145 234 H ILE 31 H ILE 31 -5.231 -10.819 -16.851 235 HA ILE 31 HA ILE 31 -6.530 -12.290 -18.805 236 HB ILE 31 HB ILE 31 -6.671 -9.302 -18.331 237 HG12 ILE 31 2HG1 ILE 31 -8.291 -11.590 -17.205 238 HG13 ILE 31 1HG1 ILE 31 -7.122 -10.622 -16.320 239 HG21 ILE 31 1HG2 ILE 31 -7.627 -9.996 -20.472 240 HG22 ILE 31 2HG2 ILE 31 -8.893 -9.506 -19.317 241 HG23 ILE 31 3HG2 ILE 31 -8.571 -11.226 -19.617 242 HD11 ILE 31 3HD1 ILE 31 -8.520 -8.651 -16.665 243 HD12 ILE 31 1HD1 ILE 31 -9.386 -9.943 -15.816 244 HD13 ILE 31 2HD1 ILE 31 -9.677 -9.660 -17.538 245 H THR 32 H THR 32 -4.080 -9.798 -19.100 246 HA THR 32 HA THR 32 -4.389 -9.764 -22.001 247 HB THR 32 HB THR 32 -2.916 -7.780 -21.918 248 HG1 THR 32 1HG THR 32 -3.120 -7.673 -19.118 249 HG21 THR 32 3HG2 THR 32 -5.201 -7.602 -19.907 250 HG22 THR 32 1HG2 THR 32 -5.387 -7.529 -21.664 251 HG23 THR 32 2HG2 THR 32 -4.491 -6.284 -20.803 252 H LYS 33 H LYS 33 -1.983 -10.496 -19.465 253 HA LYS 33 HA LYS 33 0.028 -11.185 -19.379 254 HB2 LYS 33 2HB LYS 33 -1.072 -13.219 -20.412 255 HB3 LYS 33 1HB LYS 33 -0.507 -12.651 -21.982 256 HG2 LYS 33 2HG LYS 33 1.780 -12.703 -21.176 257 HG3 LYS 33 1HG LYS 33 1.212 -13.278 -19.622 258 HD2 LYS 33 2HD LYS 33 0.851 -14.761 -22.226 259 HD3 LYS 33 1HD LYS 33 2.132 -15.103 -21.060 260 HE2 LYS 33 2HE LYS 33 0.363 -15.572 -19.367 261 HE3 LYS 33 1HE LYS 33 -0.844 -15.377 -20.637 262 HZ1 LYS 33 3HZ LYS 33 1.323 -17.408 -20.589 263 HZ2 LYS 33 1HZ LYS 33 0.203 -17.236 -21.836 264 HZ3 LYS 33 2HZ LYS 33 -0.295 -17.690 -20.289 265 H SER 34 H SER 34 -0.576 -8.715 -20.812 266 HA SER 34 HA SER 34 1.491 -8.574 -22.832 267 HB2 SER 34 2HB SER 34 -0.326 -6.417 -21.741 268 HB3 SER 34 1HB SER 34 0.702 -6.278 -23.172 269 HG SER 34 HG SER 34 -0.696 -8.468 -23.488 270 H SER 35 H SER 35 1.129 -7.959 -19.464 271 HA SER 35 HA SER 35 2.452 -7.289 -17.785 272 HB2 SER 35 2HB SER 35 4.689 -7.807 -19.741 273 HB3 SER 35 1HB SER 35 4.847 -7.713 -17.983 274 HG SER 35 HG SER 35 4.623 -9.831 -18.420 275 H LYS 36 H LYS 36 3.806 -5.795 -20.647 276 HA LYS 36 HA LYS 36 4.354 -3.290 -19.203 277 HB2 LYS 36 2HB LYS 36 5.817 -2.780 -21.122 278 HB3 LYS 36 1HB LYS 36 6.260 -4.288 -20.326 279 HG2 LYS 36 2HG LYS 36 5.084 -5.530 -22.106 280 HG3 LYS 36 1HG LYS 36 4.727 -4.000 -22.903 281 HD2 LYS 36 2HD LYS 36 6.646 -5.084 -23.934 282 HD3 LYS 36 1HD LYS 36 7.137 -3.582 -23.151 283 HE2 LYS 36 2HE LYS 36 8.029 -4.800 -21.263 284 HE3 LYS 36 1HE LYS 36 7.420 -6.322 -21.901 285 HZ1 LYS 36 3HZ LYS 36 9.556 -4.627 -23.108 286 HZ2 LYS 36 1HZ LYS 36 8.922 -6.038 -23.795 287 HZ3 LYS 36 2HZ LYS 36 9.743 -6.118 -22.345 288 H GLY 37 H GLY 37 1.868 -4.500 -20.531 289 HA2 GLY 37 2HA GLY 37 1.160 -2.720 -22.656 290 HA3 GLY 37 1HA GLY 37 0.068 -3.811 -21.807 291 H ASP 38 H ASP 38 -1.304 -1.853 -22.143 292 HA ASP 38 HA ASP 38 -0.710 0.333 -20.331 293 HB2 ASP 38 2HB ASP 38 -1.503 0.830 -22.619 294 HB3 ASP 38 1HB ASP 38 -2.986 -0.045 -22.249 295 H PHE 39 H PHE 39 -1.277 0.105 -18.351 296 HA PHE 39 HA PHE 39 -3.838 -1.150 -17.701 297 HB2 PHE 39 2HB PHE 39 -1.275 -1.290 -16.084 298 HB3 PHE 39 1HB PHE 39 -2.812 -2.031 -15.652 299 HD1 PHE 39 1HD PHE 39 -3.742 -3.763 -17.325 300 HD2 PHE 39 2HD PHE 39 0.312 -2.528 -17.264 301 HE1 PHE 39 1HE PHE 39 -3.099 -5.814 -18.520 302 HE2 PHE 39 2HE PHE 39 0.959 -4.565 -18.459 303 HZ PHE 39 HZ PHE 39 -0.741 -6.212 -19.089 304 H LEU 40 H LEU 40 -5.137 0.204 -16.605 305 HA LEU 40 HA LEU 40 -3.836 2.595 -15.480 306 HB2 LEU 40 2HB LEU 40 -6.649 2.585 -16.639 307 HB3 LEU 40 1HB LEU 40 -5.714 3.901 -15.997 308 HG LEU 40 HG LEU 40 -5.039 2.440 -18.536 309 HD11 LEU 40 1HD1 LEU 40 -6.272 5.138 -18.071 310 HD12 LEU 40 2HD1 LEU 40 -7.035 3.730 -18.821 311 HD13 LEU 40 3HD1 LEU 40 -5.689 4.541 -19.619 312 HD21 LEU 40 3HD2 LEU 40 -3.052 3.307 -17.466 313 HD22 LEU 40 1HD2 LEU 40 -3.808 4.894 -17.274 314 HD23 LEU 40 2HD2 LEU 40 -3.446 4.267 -18.886 315 H ILE 41 H ILE 41 -4.152 2.967 -13.424 316 HA ILE 41 HA ILE 41 -6.245 1.416 -12.077 317 HB ILE 41 HB ILE 41 -3.606 2.386 -10.928 318 HG12 ILE 41 2HG1 ILE 41 -4.490 -0.332 -11.960 319 HG13 ILE 41 1HG1 ILE 41 -3.185 0.667 -12.502 320 HG21 ILE 41 1HG2 ILE 41 -5.748 0.616 -9.729 321 HG22 ILE 41 2HG2 ILE 41 -5.404 2.279 -9.281 322 HG23 ILE 41 3HG2 ILE 41 -4.201 1.020 -8.967 323 HD11 ILE 41 3HD1 ILE 41 -1.910 0.206 -10.529 324 HD12 ILE 41 1HD1 ILE 41 -2.507 -1.287 -11.266 325 HD13 ILE 41 2HD1 ILE 41 -3.308 -0.675 -9.831 326 H ARG 42 H ARG 42 -7.736 2.543 -10.834 327 HA ARG 42 HA ARG 42 -7.740 5.307 -11.201 328 HB2 ARG 42 2HB ARG 42 -9.667 3.716 -11.211 329 HB3 ARG 42 1HB ARG 42 -9.534 3.712 -9.453 330 HG2 ARG 42 2HG ARG 42 -9.927 5.998 -9.316 331 HG3 ARG 42 1HG ARG 42 -9.768 6.208 -11.061 332 HD2 ARG 42 2HD ARG 42 -11.975 6.200 -10.818 333 HD3 ARG 42 1HD ARG 42 -11.606 4.554 -11.218 334 HE ARG 42 HE ARG 42 -11.635 4.652 -8.448 335 HH11 ARG 42 1HH1 ARG 42 -13.954 5.006 -11.109 336 HH12 ARG 42 2HH1 ARG 42 -15.319 4.615 -10.185 337 HH21 ARG 42 1HH2 ARG 42 -13.540 4.129 -7.141 338 HH22 ARG 42 2HH2 ARG 42 -15.070 4.080 -7.876 339 H THR 43 H THR 43 -7.038 6.741 -9.934 340 HA THR 43 HA THR 43 -6.371 6.135 -7.153 341 HB THR 43 HB THR 43 -4.373 6.387 -8.623 342 HG1 THR 43 1HG THR 43 -3.460 7.246 -6.925 343 HG21 THR 43 3HG2 THR 43 -5.371 9.204 -9.035 344 HG22 THR 43 1HG2 THR 43 -5.228 7.952 -10.268 345 HG23 THR 43 2HG2 THR 43 -3.777 8.615 -9.512 346 H LYS 44 H LYS 44 -6.717 7.990 -5.751 347 HA LYS 44 HA LYS 44 -8.489 9.923 -7.041 348 HB2 LYS 44 2HB LYS 44 -8.344 9.109 -4.150 349 HB3 LYS 44 1HB LYS 44 -9.239 10.549 -4.655 350 HG2 LYS 44 2HG LYS 44 -10.838 8.865 -4.384 351 HG3 LYS 44 1HG LYS 44 -10.560 8.916 -6.123 352 HD2 LYS 44 2HD LYS 44 -10.569 6.609 -5.533 353 HD3 LYS 44 1HD LYS 44 -8.884 7.124 -5.769 354 HE2 LYS 44 2HE LYS 44 -8.544 7.308 -3.384 355 HE3 LYS 44 1HE LYS 44 -10.231 6.908 -3.089 356 HZ1 LYS 44 3HZ LYS 44 -9.780 4.745 -4.190 357 HZ2 LYS 44 1HZ LYS 44 -8.897 4.979 -2.750 358 HZ3 LYS 44 2HZ LYS 44 -8.152 5.163 -4.242 359 H LYS 45 H LYS 45 -7.638 11.589 -7.547 360 HA LYS 45 HA LYS 45 -5.266 12.584 -6.160 361 HB2 LYS 45 2HB LYS 45 -4.946 11.571 -8.484 362 HB3 LYS 45 1HB LYS 45 -6.064 12.766 -9.045 363 HG2 LYS 45 2HG LYS 45 -4.549 14.517 -8.611 364 HG3 LYS 45 1HG LYS 45 -3.440 13.415 -7.776 365 HD2 LYS 45 2HD LYS 45 -4.353 12.990 -10.563 366 HD3 LYS 45 1HD LYS 45 -2.847 13.906 -10.231 367 HE2 LYS 45 2HE LYS 45 -2.012 11.839 -9.101 368 HE3 LYS 45 1HE LYS 45 -3.494 11.005 -9.535 369 HZ1 LYS 45 3HZ LYS 45 -1.657 10.511 -11.006 370 HZ2 LYS 45 1HZ LYS 45 -1.538 12.128 -11.452 371 HZ3 LYS 45 2HZ LYS 45 -2.914 11.246 -11.863 372 H ASP 46 H ASP 46 -5.733 14.395 -5.174 373 HA ASP 46 HA ASP 46 -6.613 16.350 -4.526 374 HB2 ASP 46 2HB ASP 46 -5.760 17.098 -6.771 375 HB3 ASP 46 1HB ASP 46 -7.325 16.704 -7.466 376 H GLY 47 H GLY 47 -8.151 13.971 -4.474 377 HA2 GLY 47 2HA GLY 47 -10.202 13.553 -3.461 378 HA3 GLY 47 1HA GLY 47 -10.747 15.147 -3.951 379 H LYS 48 H LYS 48 -9.549 13.942 -6.728 380 HA LYS 48 HA LYS 48 -12.151 12.790 -7.460 381 HB2 LYS 48 2HB LYS 48 -10.127 14.210 -9.157 382 HB3 LYS 48 1HB LYS 48 -11.515 13.336 -9.784 383 HG2 LYS 48 2HG LYS 48 -13.002 14.876 -8.587 384 HG3 LYS 48 1HG LYS 48 -11.593 15.753 -7.986 385 HD2 LYS 48 2HD LYS 48 -12.571 16.846 -9.958 386 HD3 LYS 48 1HD LYS 48 -10.924 16.302 -10.257 387 HE2 LYS 48 2HE LYS 48 -11.795 14.317 -11.419 388 HE3 LYS 48 1HE LYS 48 -13.446 14.856 -11.109 389 HZ1 LYS 48 3HZ LYS 48 -12.733 15.379 -13.314 390 HZ2 LYS 48 1HZ LYS 48 -11.404 16.254 -12.744 391 HZ3 LYS 48 2HZ LYS 48 -12.985 16.804 -12.450 392 H GLN 49 H GLN 49 -12.280 10.877 -8.396 393 HA GLN 49 HA GLN 49 -9.936 9.239 -8.462 394 HB2 GLN 49 2HB GLN 49 -11.446 7.429 -9.209 395 HB3 GLN 49 1HB GLN 49 -11.976 8.093 -7.699 396 HG2 GLN 49 2HG GLN 49 -13.161 8.671 -10.425 397 HG3 GLN 49 1HG GLN 49 -13.828 7.577 -9.221 398 HE21 GLN 49 1HE2 GLN 49 -14.915 9.979 -10.489 399 HE22 GLN 49 2HE2 GLN 49 -15.372 11.026 -9.203 400 H VAL 50 H VAL 50 -8.655 9.013 -10.075 401 HA VAL 50 HA VAL 50 -9.626 9.424 -12.807 402 HB VAL 50 HB VAL 50 -7.448 10.535 -13.353 403 HG11 VAL 50 1HG1 VAL 50 -7.999 12.734 -12.405 404 HG12 VAL 50 2HG1 VAL 50 -9.098 11.962 -11.259 405 HG13 VAL 50 3HG1 VAL 50 -9.443 11.908 -12.984 406 HG21 VAL 50 3HG2 VAL 50 -6.071 11.454 -11.523 407 HG22 VAL 50 1HG2 VAL 50 -6.128 9.690 -11.447 408 HG23 VAL 50 2HG2 VAL 50 -7.107 10.637 -10.347 409 H TRP 51 H TRP 51 -8.098 8.437 -14.374 410 HA TRP 51 HA TRP 51 -7.074 5.968 -13.255 411 HB2 TRP 51 2HB TRP 51 -7.476 6.864 -16.122 412 HB3 TRP 51 1HB TRP 51 -6.870 5.312 -15.693 413 HD1 TRP 51 HD TRP 51 -9.828 6.992 -16.534 414 HE1 TRP 51 1HE TRP 51 -11.954 5.531 -16.030 415 HE3 TRP 51 3HE TRP 51 -7.677 3.573 -13.559 416 HZ2 TRP 51 2HZ TRP 51 -12.548 3.226 -14.501 417 HZ3 TRP 51 3HZ TRP 51 -9.042 1.765 -12.602 418 HH2 TRP 51 HH TRP 51 -11.430 1.605 -13.074 419 H GLU 52 H GLU 52 -4.993 5.747 -12.873 420 HA GLU 52 HA GLU 52 -3.172 7.529 -14.293 421 HB2 GLU 52 2HB GLU 52 -3.299 7.935 -11.840 422 HB3 GLU 52 1HB GLU 52 -2.818 6.270 -11.561 423 HG2 GLU 52 2HG GLU 52 -0.690 6.684 -12.652 424 HG3 GLU 52 1HG GLU 52 -1.184 8.342 -12.989 425 H ALA 53 H ALA 53 -1.470 6.578 -15.291 426 HA ALA 53 HA ALA 53 -1.766 3.876 -16.027 427 HB1 ALA 53 1HB ALA 53 0.580 5.725 -16.425 428 HB2 ALA 53 2HB ALA 53 -0.789 5.547 -17.520 429 HB3 ALA 53 3HB ALA 53 0.316 4.196 -17.258 430 H ALA 54 H ALA 54 -0.963 2.094 -15.203 431 HA ALA 54 HA ALA 54 0.290 1.985 -12.719 432 HB1 ALA 54 1HB ALA 54 0.307 -0.062 -14.938 433 HB2 ALA 54 2HB ALA 54 -0.937 0.098 -13.696 434 HB3 ALA 54 3HB ALA 54 0.703 -0.375 -13.248 435 H SER 55 H SER 55 2.469 1.464 -12.203 436 HA SER 55 HA SER 55 4.284 2.646 -14.141 437 HB2 SER 55 2HB SER 55 4.044 3.853 -11.980 438 HB3 SER 55 1HB SER 55 4.553 2.393 -11.130 439 HG SER 55 HG SER 55 6.003 4.088 -12.837 440 H LYS 56 H LYS 56 6.386 1.663 -14.242 441 HA LYS 56 HA LYS 56 6.234 -1.068 -14.652 442 HB2 LYS 56 2HB LYS 56 8.636 0.715 -14.394 443 HB3 LYS 56 1HB LYS 56 8.677 -0.940 -15.006 444 HG2 LYS 56 2HG LYS 56 7.196 -0.373 -16.810 445 HG3 LYS 56 1HG LYS 56 6.986 1.251 -16.173 446 HD2 LYS 56 2HD LYS 56 8.480 1.292 -18.018 447 HD3 LYS 56 1HD LYS 56 9.348 1.658 -16.515 448 HE2 LYS 56 2HE LYS 56 10.248 -0.602 -16.474 449 HE3 LYS 56 1HE LYS 56 9.332 -1.016 -17.923 450 HZ1 LYS 56 3HZ LYS 56 11.618 -0.506 -18.467 451 HZ2 LYS 56 1HZ LYS 56 11.483 1.021 -17.757 452 HZ3 LYS 56 2HZ LYS 56 10.596 0.656 -19.138 453 H THR 57 H THR 57 7.152 0.775 -11.859 454 HA THR 57 HA THR 57 8.488 -1.225 -10.424 455 HB THR 57 HB THR 57 7.937 0.267 -8.475 456 HG1 THR 57 1HG THR 57 6.621 1.959 -8.791 457 HG21 THR 57 3HG2 THR 57 8.963 1.662 -10.955 458 HG22 THR 57 1HG2 THR 57 9.939 0.665 -9.881 459 HG23 THR 57 2HG2 THR 57 9.252 2.179 -9.295 460 H ALA 58 H ALA 58 5.160 -0.086 -10.431 461 HA ALA 58 HA ALA 58 4.196 -1.965 -8.506 462 HB1 ALA 58 1HB ALA 58 2.626 -0.308 -10.484 463 HB2 ALA 58 2HB ALA 58 3.103 0.206 -8.868 464 HB3 ALA 58 3HB ALA 58 1.971 -1.135 -9.072 465 H LEU 59 H LEU 59 4.255 -1.832 -12.022 466 HA LEU 59 HA LEU 59 2.685 -4.071 -12.519 467 HB2 LEU 59 2HB LEU 59 4.919 -2.747 -14.045 468 HB3 LEU 59 1HB LEU 59 3.988 -4.173 -14.658 469 HG LEU 59 HG LEU 59 2.743 -1.514 -13.942 470 HD11 LEU 59 1HD1 LEU 59 4.436 -1.176 -15.727 471 HD12 LEU 59 2HD1 LEU 59 2.792 -1.014 -16.334 472 HD13 LEU 59 3HD1 LEU 59 3.700 -2.491 -16.646 473 HD21 LEU 59 3HD2 LEU 59 0.957 -2.325 -15.308 474 HD22 LEU 59 1HD2 LEU 59 1.316 -3.548 -14.090 475 HD23 LEU 59 2HD2 LEU 59 1.883 -3.744 -15.763 476 H LYS 60 H LYS 60 6.255 -3.814 -12.192 477 HA LYS 60 HA LYS 60 6.691 -6.584 -12.439 478 HB2 LYS 60 2HB LYS 60 8.346 -4.491 -11.067 479 HB3 LYS 60 1HB LYS 60 8.893 -6.131 -11.396 480 HG2 LYS 60 2HG LYS 60 8.670 -5.727 -13.786 481 HG3 LYS 60 1HG LYS 60 8.085 -4.094 -13.460 482 HD2 LYS 60 2HD LYS 60 10.195 -3.595 -12.312 483 HD3 LYS 60 1HD LYS 60 10.743 -5.226 -12.704 484 HE2 LYS 60 2HE LYS 60 10.601 -4.719 -15.088 485 HE3 LYS 60 1HE LYS 60 9.993 -3.110 -14.717 486 HZ1 LYS 60 3HZ LYS 60 12.341 -3.097 -15.225 487 HZ2 LYS 60 1HZ LYS 60 12.663 -4.157 -13.961 488 HZ3 LYS 60 2HZ LYS 60 12.095 -2.602 -13.627 489 H LYS 61 H LYS 61 5.885 -4.587 -9.684 490 HA LYS 61 HA LYS 61 6.374 -6.497 -7.696 491 HB2 LYS 61 2HB LYS 61 6.228 -4.226 -7.050 492 HB3 LYS 61 1HB LYS 61 4.714 -3.992 -7.875 493 HG2 LYS 61 2HG LYS 61 4.866 -5.756 -5.455 494 HG3 LYS 61 1HG LYS 61 4.812 -4.000 -5.284 495 HD2 LYS 61 2HD LYS 61 2.749 -4.004 -6.682 496 HD3 LYS 61 1HD LYS 61 2.780 -5.763 -6.646 497 HE2 LYS 61 2HE LYS 61 2.539 -5.769 -4.238 498 HE3 LYS 61 1HE LYS 61 2.673 -4.011 -4.184 499 HZ1 LYS 61 3HZ LYS 61 0.613 -3.864 -5.435 500 HZ2 LYS 61 1HZ LYS 61 0.378 -4.701 -3.994 501 HZ3 LYS 61 2HZ LYS 61 0.455 -5.549 -5.440 502 H SER 62 H SER 62 3.677 -5.971 -9.793 503 HA SER 62 HA SER 62 1.935 -7.898 -8.531 504 HB2 SER 62 2HB SER 62 1.832 -6.557 -11.235 505 HB3 SER 62 1HB SER 62 0.511 -7.432 -10.455 506 HG SER 62 HG SER 62 1.703 -4.978 -9.724 507 H TRP 63 H TRP 63 4.141 -7.807 -11.367 508 HA TRP 63 HA TRP 63 3.411 -10.348 -12.309 509 HB2 TRP 63 2HB TRP 63 4.306 -8.566 -13.758 510 HB3 TRP 63 1HB TRP 63 5.844 -8.659 -12.911 511 HD1 TRP 63 HD TRP 63 7.468 -10.477 -13.615 512 HE1 TRP 63 1HE TRP 63 7.502 -12.276 -15.527 513 HE3 TRP 63 3HE TRP 63 2.627 -10.142 -15.121 514 HZ2 TRP 63 2HZ TRP 63 5.679 -13.362 -17.385 515 HZ3 TRP 63 3HZ TRP 63 1.830 -11.583 -16.947 516 HH2 TRP 63 HH TRP 63 3.337 -13.152 -18.059 517 H LYS 64 H LYS 64 5.771 -9.219 -10.012 518 HA LYS 64 HA LYS 64 7.496 -11.403 -9.934 519 HB2 LYS 64 2HB LYS 64 7.765 -9.198 -8.735 520 HB3 LYS 64 1HB LYS 64 6.546 -9.714 -7.596 521 HG2 LYS 64 2HG LYS 64 9.188 -11.130 -7.972 522 HG3 LYS 64 1HG LYS 64 8.932 -9.843 -6.810 523 HD2 LYS 64 2HD LYS 64 7.186 -11.239 -5.730 524 HD3 LYS 64 1HD LYS 64 7.545 -12.522 -6.880 525 HE2 LYS 64 2HE LYS 64 9.833 -12.650 -6.073 526 HE3 LYS 64 1HE LYS 64 9.535 -11.316 -4.962 527 HZ1 LYS 64 3HZ LYS 64 7.883 -12.725 -3.833 528 HZ2 LYS 64 1HZ LYS 64 9.431 -13.397 -3.833 529 HZ3 LYS 64 2HZ LYS 64 8.290 -14.007 -4.877 530 H ARG 65 H ARG 65 4.337 -10.935 -8.452 531 HA ARG 65 HA ARG 65 4.347 -13.429 -7.044 532 HB2 ARG 65 2HB ARG 65 2.923 -11.391 -6.448 533 HB3 ARG 65 1HB ARG 65 1.983 -11.776 -7.852 534 HG2 ARG 65 2HG ARG 65 1.292 -13.879 -6.988 535 HG3 ARG 65 1HG ARG 65 2.369 -13.705 -5.601 536 HD2 ARG 65 2HD ARG 65 0.027 -11.935 -6.252 537 HD3 ARG 65 1HD ARG 65 0.050 -13.203 -5.028 538 HE ARG 65 HE ARG 65 2.059 -11.122 -4.785 539 HH11 ARG 65 1HH1 ARG 65 -1.067 -12.364 -3.674 540 HH12 ARG 65 2HH1 ARG 65 -1.085 -11.402 -2.267 541 HH21 ARG 65 1HH2 ARG 65 2.024 -9.832 -2.880 542 HH22 ARG 65 2HH2 ARG 65 0.711 -9.942 -1.794 543 H TYR 66 H TYR 66 3.368 -12.324 -10.181 544 HA TYR 66 HA TYR 66 1.762 -14.486 -11.146 545 HB2 TYR 66 2HB TYR 66 2.224 -12.187 -12.210 546 HB3 TYR 66 1HB TYR 66 3.741 -12.873 -12.757 547 HD1 TYR 66 1HD TYR 66 3.491 -15.117 -14.138 548 HD2 TYR 66 2HD TYR 66 0.389 -12.294 -13.552 549 HE1 TYR 66 1HE TYR 66 2.374 -15.966 -16.121 550 HE2 TYR 66 2HE TYR 66 -0.751 -13.110 -15.518 551 HH TYR 66 HH TYR 66 0.054 -16.039 -17.101 552 H GLU 67 H GLU 67 5.215 -13.871 -11.139 553 HA GLU 67 HA GLU 67 6.128 -16.218 -12.351 554 HB2 GLU 67 2HB GLU 67 7.380 -14.667 -10.086 555 HB3 GLU 67 1HB GLU 67 8.202 -15.826 -11.119 556 HG2 GLU 67 2HG GLU 67 6.858 -13.375 -12.027 557 HG3 GLU 67 1HG GLU 67 8.592 -13.428 -11.676 558 H GLN 68 H GLN 68 5.536 -15.449 -9.020 559 HA GLN 68 HA GLN 68 6.469 -17.854 -7.936 560 HB2 GLN 68 2HB GLN 68 4.302 -16.103 -6.798 561 HB3 GLN 68 1HB GLN 68 5.131 -17.361 -5.910 562 HG2 GLN 68 2HG GLN 68 7.235 -16.174 -6.252 563 HG3 GLN 68 1HG GLN 68 6.350 -14.875 -7.058 564 HE21 GLN 68 1HE2 GLN 68 7.036 -16.445 -4.070 565 HE22 GLN 68 2HE2 GLN 68 6.364 -15.240 -3.036 566 H GLU 69 H GLU 69 3.071 -17.036 -8.659 567 HA GLU 69 HA GLU 69 2.362 -19.727 -8.048 568 HB2 GLU 69 2HB GLU 69 0.586 -17.601 -9.253 569 HB3 GLU 69 1HB GLU 69 0.048 -19.166 -8.650 570 HG2 GLU 69 2HG GLU 69 1.038 -18.494 -6.418 571 HG3 GLU 69 1HG GLU 69 1.182 -16.870 -7.078 572 H MET 70 H MET 70 2.631 -17.942 -11.072 573 HA MET 70 HA MET 70 1.701 -20.211 -12.596 574 HB2 MET 70 2HB MET 70 2.831 -17.605 -13.579 575 HB3 MET 70 1HB MET 70 2.080 -18.833 -14.588 576 HG2 MET 70 2HG MET 70 0.743 -17.258 -12.389 577 HG3 MET 70 1HG MET 70 0.541 -17.006 -14.121 578 HE1 MET 70 3HE MET 70 -1.329 -20.274 -15.209 579 HE2 MET 70 1HE MET 70 0.420 -20.023 -15.182 580 HE3 MET 70 2HE MET 70 -0.639 -18.729 -15.722 581 H LEU 71 H LEU 71 5.005 -18.985 -11.932 582 HA LEU 71 HA LEU 71 6.173 -20.503 -14.013 583 HB2 LEU 71 2HB LEU 71 7.279 -18.555 -12.807 584 HB3 LEU 71 1HB LEU 71 7.342 -19.565 -11.418 585 HG LEU 71 HG LEU 71 8.778 -21.121 -12.470 586 HD11 LEU 71 1HD1 LEU 71 9.889 -20.576 -14.631 587 HD12 LEU 71 2HD1 LEU 71 8.780 -19.218 -14.822 588 HD13 LEU 71 3HD1 LEU 71 8.161 -20.871 -14.805 589 HD21 LEU 71 3HD2 LEU 71 9.767 -19.347 -11.173 590 HD22 LEU 71 1HD2 LEU 71 9.777 -18.279 -12.576 591 HD23 LEU 71 2HD2 LEU 71 10.811 -19.706 -12.546 592 H LYS 72 H LYS 72 5.775 -20.996 -10.549 593 HA LYS 72 HA LYS 72 6.771 -23.680 -10.593 594 HB2 LYS 72 2HB LYS 72 5.120 -22.210 -8.515 595 HB3 LYS 72 1HB LYS 72 5.699 -23.846 -8.302 596 HG2 LYS 72 2HG LYS 72 7.111 -22.340 -7.081 597 HG3 LYS 72 1HG LYS 72 8.031 -22.991 -8.430 598 HD2 LYS 72 2HD LYS 72 7.644 -20.899 -9.664 599 HD3 LYS 72 1HD LYS 72 6.730 -20.267 -8.293 600 HE2 LYS 72 2HE LYS 72 9.639 -21.062 -8.282 601 HE3 LYS 72 1HE LYS 72 9.016 -19.416 -8.305 602 HZ1 LYS 72 3HZ LYS 72 8.015 -19.826 -6.110 603 HZ2 LYS 72 1HZ LYS 72 9.678 -20.081 -6.078 604 HZ3 LYS 72 2HZ LYS 72 8.654 -21.395 -6.110 605 H ASN 73 H ASN 73 3.860 -22.108 -11.179 606 HA ASN 73 HA ASN 73 1.844 -22.597 -11.777 607 HB2 ASN 73 2HB ASN 73 2.881 -23.573 -13.725 608 HB3 ASN 73 1HB ASN 73 3.084 -25.106 -12.895 609 HD21 ASN 73 1HD2 ASN 73 1.303 -26.471 -12.693 610 HD22 ASN 73 2HD2 ASN 73 -0.183 -26.222 -13.525 611 H GLU 74 H GLU 74 1.005 -22.548 -9.872 612 HA GLU 74 HA GLU 74 0.458 -25.089 -8.576 613 HB2 GLU 74 2HB GLU 74 -0.208 -22.283 -7.684 614 HB3 GLU 74 1HB GLU 74 -0.377 -23.749 -6.722 615 HG2 GLU 74 2HG GLU 74 2.075 -24.083 -6.914 616 HG3 GLU 74 1HG GLU 74 2.174 -22.520 -7.717 617 H LYS 75 H LYS 75 -1.884 -25.201 -7.737 618 HA LYS 75 HA LYS 75 -3.475 -24.855 -10.138 619 HB2 LYS 75 2HB LYS 75 -4.083 -26.468 -7.659 620 HB3 LYS 75 1HB LYS 75 -5.006 -26.492 -9.158 621 HG2 LYS 75 2HG LYS 75 -3.086 -27.398 -10.351 622 HG3 LYS 75 1HG LYS 75 -2.124 -27.330 -8.875 623 HD2 LYS 75 2HD LYS 75 -3.715 -28.901 -7.826 624 HD3 LYS 75 1HD LYS 75 -4.574 -29.019 -9.364 625 HE2 LYS 75 2HE LYS 75 -1.684 -29.746 -8.888 626 HE3 LYS 75 1HE LYS 75 -3.006 -30.899 -9.048 627 HZ1 LYS 75 3HZ LYS 75 -2.017 -29.047 -11.169 628 HZ2 LYS 75 1HZ LYS 75 -3.320 -30.102 -11.332 629 HZ3 LYS 75 2HZ LYS 75 -1.784 -30.705 -11.098 630 H VAL 76 H VAL 76 -3.764 -22.633 -9.903 631 HA VAL 76 HA VAL 76 -5.705 -21.880 -7.815 632 HB VAL 76 HB VAL 76 -3.832 -20.020 -9.325 633 HG11 VAL 76 1HG1 VAL 76 -5.593 -19.483 -6.940 634 HG12 VAL 76 2HG1 VAL 76 -5.853 -18.896 -8.582 635 HG13 VAL 76 3HG1 VAL 76 -4.454 -18.347 -7.660 636 HG21 VAL 76 3HG2 VAL 76 -2.557 -21.485 -7.857 637 HG22 VAL 76 1HG2 VAL 76 -3.598 -21.056 -6.500 638 HG23 VAL 76 2HG2 VAL 76 -2.564 -19.834 -7.239 639 H ALA 77 H ALA 77 -5.031 -22.118 -11.169 640 HA ALA 77 HA ALA 77 -6.181 -21.889 -13.044 641 HB1 ALA 77 1HB ALA 77 -8.089 -22.933 -11.855 642 HB2 ALA 77 2HB ALA 77 -8.612 -21.768 -13.075 643 HB3 ALA 77 3HB ALA 77 -8.637 -21.326 -11.370 644 H ALA 78 H ALA 78 -5.164 -20.253 -13.893 645 HA ALA 78 HA ALA 78 -5.829 -17.539 -13.190 646 HB1 ALA 78 1HB ALA 78 -4.131 -16.910 -14.844 647 HB2 ALA 78 2HB ALA 78 -4.008 -18.593 -15.359 648 HB3 ALA 78 3HB ALA 78 -3.507 -18.129 -13.734 649 H LYS 79 H LYS 79 -7.808 -17.042 -13.758 650 HA LYS 79 HA LYS 79 -9.010 -17.995 -16.173 651 HB2 LYS 79 2HB LYS 79 -10.311 -17.745 -14.117 652 HB3 LYS 79 1HB LYS 79 -10.021 -16.007 -14.165 653 HG2 LYS 79 2HG LYS 79 -11.241 -15.834 -16.257 654 HG3 LYS 79 1HG LYS 79 -11.485 -17.575 -16.274 655 HD2 LYS 79 2HD LYS 79 -13.482 -16.468 -15.497 656 HD3 LYS 79 1HD LYS 79 -12.734 -17.413 -14.203 657 HE2 LYS 79 2HE LYS 79 -11.777 -15.394 -13.244 658 HE3 LYS 79 1HE LYS 79 -12.421 -14.431 -14.576 659 HZ1 LYS 79 3HZ LYS 79 -13.800 -14.252 -12.580 660 HZ2 LYS 79 1HZ LYS 79 -14.011 -15.917 -12.565 661 HZ3 LYS 79 2HZ LYS 79 -14.657 -15.005 -13.806 662 H MET 80 H MET 80 -8.710 -17.159 -18.018 663 HA MET 80 HA MET 80 -8.207 -14.272 -18.280 664 HB2 MET 80 2HB MET 80 -7.526 -16.517 -20.211 665 HB3 MET 80 1HB MET 80 -7.168 -14.813 -20.447 666 HG2 MET 80 2HG MET 80 -5.663 -14.829 -18.566 667 HG3 MET 80 1HG MET 80 -6.056 -16.512 -18.223 668 HE1 MET 80 3HE MET 80 -5.438 -14.761 -21.736 669 HE2 MET 80 1HE MET 80 -3.710 -15.050 -21.924 670 HE3 MET 80 2HE MET 80 -4.291 -13.992 -20.637 671 H LEU 81 H LEU 81 -9.487 -16.965 -20.167 672 HA LEU 81 HA LEU 81 -11.261 -17.323 -21.432 673 HB2 LEU 81 2HB LEU 81 -12.605 -15.374 -19.580 674 HB3 LEU 81 1HB LEU 81 -13.444 -16.345 -20.770 675 HG LEU 81 HG LEU 81 -11.911 -17.392 -18.390 676 HD11 LEU 81 1HD1 LEU 81 -14.867 -17.303 -18.979 677 HD12 LEU 81 2HD1 LEU 81 -14.008 -16.333 -17.781 678 HD13 LEU 81 3HD1 LEU 81 -14.112 -18.084 -17.591 679 HD21 LEU 81 3HD2 LEU 81 -13.505 -18.866 -20.495 680 HD22 LEU 81 1HD2 LEU 81 -12.832 -19.581 -19.031 681 HD23 LEU 81 2HD2 LEU 81 -11.756 -18.947 -20.268 682 H GLU 82 H GLU 82 -11.736 -16.881 -23.385 683 HA GLU 82 HA GLU 82 -11.544 -14.122 -24.259 684 HB2 GLU 82 2HB GLU 82 -11.323 -15.073 -26.532 685 HB3 GLU 82 1HB GLU 82 -10.067 -15.615 -25.438 686 HG2 GLU 82 2HG GLU 82 -11.269 -17.742 -25.143 687 HG3 GLU 82 1HG GLU 82 -12.470 -17.190 -26.312 688 H LYS 83 H LYS 83 -13.205 -13.249 -25.594 689 HA LYS 83 HA LYS 83 -15.787 -14.103 -24.729 690 HB2 LYS 83 2HB LYS 83 -15.083 -11.985 -26.770 691 HB3 LYS 83 1HB LYS 83 -16.668 -12.229 -26.060 692 HG2 LYS 83 2HG LYS 83 -14.172 -11.375 -24.595 693 HG3 LYS 83 1HG LYS 83 -15.535 -10.346 -25.022 694 HD2 LYS 83 2HD LYS 83 -16.991 -11.696 -23.576 695 HD3 LYS 83 1HD LYS 83 -15.624 -12.728 -23.162 696 HE2 LYS 83 2HE LYS 83 -14.465 -10.740 -22.219 697 HE3 LYS 83 1HE LYS 83 -15.908 -9.788 -22.553 698 HZ1 LYS 83 3HZ LYS 83 -17.160 -11.159 -21.035 699 HZ2 LYS 83 1HZ LYS 83 -15.789 -10.587 -20.232 700 HZ3 LYS 83 2HZ LYS 83 -15.818 -12.162 -20.784 701 H ASP 84 H ASP 84 -14.755 -13.521 -28.098 702 HA ASP 84 HA ASP 84 -15.384 -16.086 -29.042 703 HB2 ASP 84 2HB ASP 84 -17.713 -15.507 -28.600 704 HB3 ASP 84 1HB ASP 84 -17.540 -14.007 -29.502 705 H ALA 85 H ALA 85 -14.769 -16.330 -31.109 706 HA ALA 85 HA ALA 85 -14.282 -14.008 -32.807 707 HB1 ALA 85 1HB ALA 85 -12.214 -16.088 -32.077 708 HB2 ALA 85 2HB ALA 85 -12.167 -14.376 -31.643 709 HB3 ALA 85 3HB ALA 85 -12.018 -14.867 -33.332 710 H THR 86 H THR 86 -16.267 -16.193 -32.767 711 HA THR 86 HA THR 86 -15.266 -18.027 -34.797 712 HB THR 86 HB THR 86 -17.311 -19.368 -34.375 713 HG1 THR 86 1HG THR 86 -17.866 -17.568 -32.211 714 HG21 THR 86 3HG2 THR 86 -15.760 -18.627 -31.896 715 HG22 THR 86 1HG2 THR 86 -15.298 -19.826 -33.102 716 HG23 THR 86 2HG2 THR 86 -16.726 -20.090 -32.104 717 H GLU 87 H GLU 87 -15.576 -17.584 -36.850 718 HA GLU 87 HA GLU 87 -17.953 -16.063 -37.552 719 HB2 GLU 87 2HB GLU 87 -16.780 -15.335 -39.582 720 HB3 GLU 87 1HB GLU 87 -15.916 -14.875 -38.132 721 HG2 GLU 87 2HG GLU 87 -15.201 -17.211 -39.906 722 HG3 GLU 87 1HG GLU 87 -14.445 -15.622 -39.962 723 H VAL 88 H VAL 88 -19.323 -16.842 -39.045 724 HA VAL 88 HA VAL 88 -18.832 -19.607 -39.862 725 HB VAL 88 HB VAL 88 -21.277 -19.816 -40.169 726 HG11 VAL 88 1HG1 VAL 88 -20.298 -20.453 -38.035 727 HG12 VAL 88 2HG1 VAL 88 -21.901 -19.768 -37.788 728 HG13 VAL 88 3HG1 VAL 88 -20.466 -18.800 -37.449 729 HG21 VAL 88 3HG2 VAL 88 -22.788 -18.057 -39.334 730 HG22 VAL 88 1HG2 VAL 88 -21.809 -17.476 -40.681 731 HG23 VAL 88 2HG2 VAL 88 -21.401 -17.019 -39.027 732 H GLY 89 H GLY 89 -20.205 -20.103 -41.960 733 HA2 GLY 89 2HA GLY 89 -20.751 -18.314 -43.889 734 HA3 GLY 89 1HA GLY 89 -19.000 -18.501 -43.979 735 H VAL 90 H VAL 90 -21.526 -19.381 -45.546 736 HA VAL 90 HA VAL 90 -20.309 -21.749 -46.547 737 HB VAL 90 HB VAL 90 -21.635 -22.704 -44.686 738 HG11 VAL 90 1HG1 VAL 90 -24.031 -21.519 -46.072 739 HG12 VAL 90 2HG1 VAL 90 -23.402 -21.066 -44.489 740 HG13 VAL 90 3HG1 VAL 90 -24.098 -22.668 -44.737 741 HG21 VAL 90 3HG2 VAL 90 -21.292 -24.050 -46.687 742 HG22 VAL 90 1HG2 VAL 90 -22.750 -23.378 -47.412 743 HG23 VAL 90 2HG2 VAL 90 -22.866 -24.402 -45.979 744 H LYS 91 H LYS 91 -20.784 -21.999 -48.674 745 HA LYS 91 HA LYS 91 -22.792 -20.180 -49.802 746 HB2 LYS 91 2HB LYS 91 -20.252 -21.232 -51.083 747 HB3 LYS 91 1HB LYS 91 -21.397 -20.124 -51.824 748 HG2 LYS 91 2HG LYS 91 -19.666 -19.549 -49.416 749 HG3 LYS 91 1HG LYS 91 -19.398 -18.953 -51.051 750 HD2 LYS 91 2HD LYS 91 -21.531 -17.723 -50.933 751 HD3 LYS 91 1HD LYS 91 -21.782 -18.330 -49.296 752 HE2 LYS 91 2HE LYS 91 -19.500 -16.563 -50.199 753 HE3 LYS 91 1HE LYS 91 -20.915 -16.032 -49.296 754 HZ1 LYS 91 3HZ LYS 91 -20.201 -17.496 -47.459 755 HZ2 LYS 91 1HZ LYS 91 -19.031 -16.356 -47.814 756 HZ3 LYS 91 2HZ LYS 91 -18.828 -17.933 -48.313 757 H ALA 92 H ALA 92 -23.993 -21.030 -51.578 758 HA ALA 92 HA ALA 92 -24.360 -23.914 -51.374 759 HB1 ALA 92 1HB ALA 92 -26.428 -23.550 -52.644 760 HB2 ALA 92 2HB ALA 92 -26.002 -21.856 -52.863 761 HB3 ALA 92 3HB ALA 92 -26.349 -22.472 -51.251 762 H ALA 93 H ALA 93 -23.831 -25.338 -52.952 763 HA ALA 93 HA ALA 93 -22.355 -24.245 -55.202 764 HB1 ALA 93 1HB ALA 93 -22.564 -27.096 -54.246 765 HB2 ALA 93 2HB ALA 93 -21.284 -25.961 -53.816 766 HB3 ALA 93 3HB ALA 93 -21.463 -26.488 -55.485 767 H LEU 94 H LEU 94 -22.942 -24.483 -57.298 768 HA LEU 94 HA LEU 94 -25.010 -26.315 -58.084 769 HB2 LEU 94 2HB LEU 94 -26.539 -24.709 -59.029 770 HB3 LEU 94 1HB LEU 94 -26.337 -24.339 -57.336 771 HG LEU 94 HG LEU 94 -25.033 -22.814 -59.609 772 HD11 LEU 94 1HD1 LEU 94 -26.651 -21.051 -59.077 773 HD12 LEU 94 2HD1 LEU 94 -27.450 -22.146 -57.941 774 HD13 LEU 94 3HD1 LEU 94 -27.422 -22.523 -59.659 775 HD21 LEU 94 3HD2 LEU 94 -25.217 -22.167 -56.658 776 HD22 LEU 94 1HD2 LEU 94 -24.540 -21.113 -57.902 777 HD23 LEU 94 2HD2 LEU 94 -23.760 -22.647 -57.526 778 H GLU 95 H GLU 95 -25.322 -26.186 -60.513 779 HA GLU 95 HA GLU 95 -23.031 -25.014 -61.877 780 HB2 GLU 95 2HB GLU 95 -22.657 -27.106 -63.123 781 HB3 GLU 95 1HB GLU 95 -22.343 -27.301 -61.407 782 HG2 GLU 95 2HG GLU 95 -24.531 -28.363 -61.136 783 HG3 GLU 95 1HG GLU 95 -24.826 -28.179 -62.862 784 H GLU 96 H GLU 96 -23.379 -24.714 -64.108 785 HA GLU 96 HA GLU 96 -26.150 -24.400 -64.871 786 HB2 GLU 96 2HB GLU 96 -24.576 -22.632 -65.450 787 HB3 GLU 96 1HB GLU 96 -23.539 -23.777 -66.277 788 HG2 GLU 96 2HG GLU 96 -24.757 -22.439 -67.880 789 HG3 GLU 96 1HG GLU 96 -25.287 -24.113 -67.967 790 H ALA 97 H ALA 97 -27.082 -25.446 -66.665 791 HA ALA 97 HA ALA 97 -25.659 -27.701 -67.798 792 HB1 ALA 97 1HB ALA 97 -27.453 -29.282 -67.271 793 HB2 ALA 97 2HB ALA 97 -28.293 -28.030 -66.354 794 HB3 ALA 97 3HB ALA 97 -26.732 -28.629 -65.797 795 H LYS 98 H LYS 98 -25.806 -27.097 -69.855 796 HA LYS 98 HA LYS 98 -28.480 -26.544 -70.924 797 HB2 LYS 98 2HB LYS 98 -25.895 -25.171 -71.687 798 HB3 LYS 98 1HB LYS 98 -27.408 -24.988 -72.560 799 HG2 LYS 98 2HG LYS 98 -26.976 -24.224 -69.674 800 HG3 LYS 98 1HG LYS 98 -26.944 -23.105 -71.036 801 HD2 LYS 98 2HD LYS 98 -29.276 -23.618 -71.542 802 HD3 LYS 98 1HD LYS 98 -29.315 -24.814 -70.248 803 HE2 LYS 98 2HE LYS 98 -30.364 -22.705 -69.589 804 HE3 LYS 98 1HE LYS 98 -28.953 -23.074 -68.600 805 HZ1 LYS 98 3HZ LYS 98 -29.033 -20.765 -69.248 806 HZ2 LYS 98 1HZ LYS 98 -29.001 -21.179 -70.884 807 HZ3 LYS 98 2HZ LYS 98 -27.673 -21.512 -69.877 808 H LYS 99 H LYS 99 -28.634 -26.944 -73.247 809 HA LYS 99 HA LYS 99 -27.136 -29.361 -73.910 810 HB2 LYS 99 2HB LYS 99 -29.819 -28.389 -74.939 811 HB3 LYS 99 1HB LYS 99 -28.988 -29.796 -75.567 812 HG2 LYS 99 2HG LYS 99 -30.660 -30.589 -74.076 813 HG3 LYS 99 1HG LYS 99 -29.118 -30.781 -73.253 814 HD2 LYS 99 2HD LYS 99 -29.579 -28.664 -72.020 815 HD3 LYS 99 1HD LYS 99 -31.163 -28.604 -72.792 816 HE2 LYS 99 2HE LYS 99 -30.139 -30.768 -70.955 817 HE3 LYS 99 1HE LYS 99 -31.348 -29.551 -70.561 818 HZ1 LYS 99 3HZ LYS 99 -32.799 -30.537 -72.264 819 HZ2 LYS 99 1HZ LYS 99 -32.365 -31.670 -71.091 820 HZ3 LYS 99 2HZ LYS 99 -31.631 -31.697 -72.594 821 H VAL 100 H VAL 100 -26.818 -29.692 -76.305 822 HA VAL 100 HA VAL 100 -26.301 -27.222 -77.756 823 HB VAL 100 HB VAL 100 -24.186 -27.753 -76.569 824 HG11 VAL 100 1HG1 VAL 100 -24.434 -30.135 -76.279 825 HG12 VAL 100 2HG1 VAL 100 -22.910 -29.786 -77.100 826 HG13 VAL 100 3HG1 VAL 100 -24.286 -30.390 -78.019 827 HG21 VAL 100 3HG2 VAL 100 -22.678 -27.825 -78.518 828 HG22 VAL 100 1HG2 VAL 100 -24.022 -26.706 -78.758 829 HG23 VAL 100 2HG2 VAL 100 -24.045 -28.286 -79.533 830 H GLN 101 H GLN 101 -26.436 -27.516 -79.991 831 HA GLN 101 HA GLN 101 -27.621 -30.033 -80.806 832 HB2 GLN 101 2HB GLN 101 -27.238 -27.456 -82.320 833 HB3 GLN 101 1HB GLN 101 -28.095 -28.865 -82.918 834 HG2 GLN 101 2HG GLN 101 -28.872 -27.279 -80.490 835 HG3 GLN 101 1HG GLN 101 -29.580 -27.090 -82.092 836 HE21 GLN 101 1HE2 GLN 101 -31.594 -27.604 -81.357 837 HE22 GLN 101 2HE2 GLN 101 -32.056 -29.203 -80.896 838 H ILE 102 H ILE 102 -26.608 -31.521 -81.943 839 HA ILE 102 HA ILE 102 -24.093 -30.791 -83.199 840 HB ILE 102 HB ILE 102 -23.218 -33.098 -82.670 841 HG12 ILE 102 2HG1 ILE 102 -25.529 -33.156 -80.697 842 HG13 ILE 102 1HG1 ILE 102 -25.375 -34.171 -82.123 843 HG21 ILE 102 1HG2 ILE 102 -22.540 -32.548 -80.372 844 HG22 ILE 102 2HG2 ILE 102 -23.758 -31.271 -80.336 845 HG23 ILE 102 3HG2 ILE 102 -22.412 -31.170 -81.468 846 HD11 ILE 102 3HD1 ILE 102 -23.533 -34.186 -79.744 847 HD12 ILE 102 1HD1 ILE 102 -23.393 -35.223 -81.162 848 HD13 ILE 102 2HD1 ILE 102 -24.786 -35.376 -80.091 849 H GLU 103 H GLU 103 -24.601 -30.723 -85.229 850 HA GLU 103 HA GLU 103 -26.235 -32.796 -86.412 851 HB2 GLU 103 2HB GLU 103 -25.054 -30.265 -87.580 852 HB3 GLU 103 1HB GLU 103 -25.940 -31.447 -88.521 853 HG2 GLU 103 2HG GLU 103 -27.368 -29.580 -87.999 854 HG3 GLU 103 1HG GLU 103 -27.941 -31.005 -87.152 855 H LEU 104 H LEU 104 -25.374 -34.509 -87.235 856 HA LEU 104 HA LEU 104 -22.559 -34.470 -88.098 857 HB2 LEU 104 2HB LEU 104 -24.248 -36.828 -87.231 858 HB3 LEU 104 1HB LEU 104 -22.569 -36.895 -87.712 859 HG LEU 104 HG LEU 104 -23.655 -35.558 -85.235 860 HD11 LEU 104 1HD1 LEU 104 -22.008 -38.053 -85.581 861 HD12 LEU 104 2HD1 LEU 104 -23.702 -37.981 -85.105 862 HD13 LEU 104 3HD1 LEU 104 -22.459 -37.322 -84.042 863 HD21 LEU 104 3HD2 LEU 104 -21.711 -34.350 -86.077 864 HD22 LEU 104 1HD2 LEU 104 -20.805 -35.860 -86.193 865 HD23 LEU 104 2HD2 LEU 104 -21.296 -35.244 -84.615 866 H ASP 105 H ASP 105 -22.100 -35.682 -90.053 867 HA ASP 105 HA ASP 105 -24.072 -35.229 -92.050 868 HB2 ASP 105 2HB ASP 105 -21.456 -36.713 -92.204 869 HB3 ASP 105 1HB ASP 105 -22.508 -36.455 -93.589 870 H THR 106 H THR 106 -22.642 -38.262 -90.849 871 HA THR 106 HA THR 106 -23.331 -40.419 -90.942 872 HB THR 106 HB THR 106 -25.636 -40.854 -90.229 873 HG1 THR 106 1HG THR 106 -26.004 -38.326 -91.146 874 HG21 THR 106 3HG2 THR 106 -24.298 -38.620 -88.707 875 HG22 THR 106 1HG2 THR 106 -23.966 -40.343 -88.539 876 HG23 THR 106 2HG2 THR 106 -25.532 -39.697 -88.051 877 H SER 107 H SER 107 -23.099 -39.175 -93.429 878 HA SER 107 HA SER 107 -25.411 -39.812 -95.020 879 HB2 SER 107 2HB SER 107 -24.208 -37.689 -95.326 880 HB3 SER 107 1HB SER 107 -22.751 -38.576 -95.751 881 HG SER 107 HG SER 107 -25.216 -38.634 -97.119 882 H LEU 108 H LEU 108 -22.417 -41.231 -94.128 883 HA LEU 108 HA LEU 108 -21.250 -43.012 -94.723 884 HB2 LEU 108 2HB LEU 108 -23.816 -43.879 -96.083 885 HB3 LEU 108 1HB LEU 108 -22.378 -44.867 -96.100 886 HG LEU 108 HG LEU 108 -23.868 -45.725 -94.464 887 HD11 LEU 108 1HD1 LEU 108 -21.633 -44.282 -93.084 888 HD12 LEU 108 2HD1 LEU 108 -21.562 -45.859 -93.867 889 HD13 LEU 108 3HD1 LEU 108 -22.548 -45.635 -92.426 890 HD21 LEU 108 3HD2 LEU 108 -24.640 -44.431 -92.514 891 HD22 LEU 108 1HD2 LEU 108 -25.263 -43.792 -94.036 892 HD23 LEU 108 2HD2 LEU 108 -23.931 -42.978 -93.218 893 H SER 109 H SER 109 -19.626 -42.355 -95.821 894 HA SER 109 HA SER 109 -19.840 -41.342 -98.468 895 HB2 SER 109 2HB SER 109 -17.409 -42.117 -96.846 896 HB3 SER 109 1HB SER 109 -17.421 -41.109 -98.304 897 HG SER 109 HG SER 109 -18.653 -39.607 -97.218 898 H TYR 110 H TYR 110 -19.209 -44.417 -97.019 899 HA TYR 110 HA TYR 110 -18.720 -45.526 -99.676 900 HB2 TYR 110 2HB TYR 110 -16.899 -46.072 -98.152 901 HB3 TYR 110 1HB TYR 110 -18.037 -46.694 -96.965 902 HD1 TYR 110 2HD TYR 110 -16.708 -47.308-100.393 903 HD2 TYR 110 1HD TYR 110 -18.667 -48.953 -97.002 904 HE1 TYR 110 2HE TYR 110 -16.513 -49.565-101.368 905 HE2 TYR 110 1HE TYR 110 -18.479 -51.191 -97.959 906 HH TYR 110 HH TYR 110 -16.503 -51.899-100.596 907 H ILE 111 H ILE 111 -20.737 -45.707-100.406 908 HA ILE 111 HA ILE 111 -22.312 -47.797 -99.232 909 HB ILE 111 HB ILE 111 -23.361 -45.879 -98.248 910 HG12 ILE 111 2HG1 ILE 111 -24.988 -46.813-100.615 911 HG13 ILE 111 1HG1 ILE 111 -24.803 -47.685 -99.103 912 HG21 ILE 111 1HG2 ILE 111 -23.548 -44.693-101.002 913 HG22 ILE 111 2HG2 ILE 111 -22.538 -44.117 -99.676 914 HG23 ILE 111 3HG2 ILE 111 -24.296 -44.028 -99.551 915 HD11 ILE 111 3HD1 ILE 111 -26.908 -46.538 -99.177 916 HD12 ILE 111 1HD1 ILE 111 -26.075 -44.997 -99.461 917 HD13 ILE 111 2HD1 ILE 111 -25.841 -45.864 -97.934 Start of MODEL 2 1 H1 GLY -1 1HT GLY -1 -1.446 -3.460 -31.328 2 H2 GLY -1 2HT GLY -1 -1.175 -1.973 -30.579 3 H3 GLY -1 3HT GLY -1 -2.126 -2.053 -31.991 4 HA2 GLY -1 1HA GLY -1 -3.503 -1.787 -30.077 5 HA3 GLY -1 2HA GLY -1 -3.743 -3.378 -30.791 6 H SER 0 H SER 0 -3.601 -1.928 -27.952 7 HA SER 0 HA SER 0 -2.681 -4.333 -26.632 8 HB2 SER 0 2HB SER 0 -1.569 -2.868 -24.896 9 HB3 SER 0 1HB SER 0 -0.753 -2.910 -26.456 10 HG SER 0 HG SER 0 -2.171 -0.782 -25.244 11 H MET 1 H MET 1 -3.759 -4.702 -24.695 12 HA MET 1 HA MET 1 -6.327 -3.448 -24.540 13 HB2 MET 1 2HB MET 1 -5.014 -5.491 -22.764 14 HB3 MET 1 1HB MET 1 -6.645 -4.899 -22.525 15 HG2 MET 1 2HG MET 1 -7.256 -5.804 -24.729 16 HG3 MET 1 1HG MET 1 -5.620 -6.446 -24.892 17 HE1 MET 1 3HE MET 1 -6.676 -8.887 -25.307 18 HE2 MET 1 1HE MET 1 -8.294 -8.202 -25.126 19 HE3 MET 1 2HE MET 1 -7.831 -9.636 -24.209 20 H THR 2 H THR 2 -7.073 -2.059 -23.045 21 HA THR 2 HA THR 2 -5.113 -0.975 -21.182 22 HB THR 2 HB THR 2 -7.730 0.186 -22.208 23 HG1 THR 2 1HG THR 2 -5.406 -0.058 -23.357 24 HG21 THR 2 3HG2 THR 2 -7.060 1.020 -19.975 25 HG22 THR 2 1HG2 THR 2 -6.922 2.279 -21.198 26 HG23 THR 2 2HG2 THR 2 -5.475 1.452 -20.618 27 H VAL 3 H VAL 3 -5.375 -1.746 -19.205 28 HA VAL 3 HA VAL 3 -7.994 -2.886 -18.484 29 HB VAL 3 HB VAL 3 -5.403 -3.372 -17.030 30 HG11 VAL 3 1HG1 VAL 3 -7.360 -3.921 -15.766 31 HG12 VAL 3 2HG1 VAL 3 -6.503 -5.380 -16.290 32 HG13 VAL 3 3HG1 VAL 3 -7.962 -4.892 -17.137 33 HG21 VAL 3 3HG2 VAL 3 -6.532 -5.117 -19.215 34 HG22 VAL 3 1HG2 VAL 3 -5.217 -5.504 -18.105 35 HG23 VAL 3 2HG2 VAL 3 -5.016 -4.188 -19.275 36 H TYR 4 H TYR 4 -9.080 -2.038 -16.777 37 HA TYR 4 HA TYR 4 -7.787 0.155 -15.389 38 HB2 TYR 4 2HB TYR 4 -10.703 -0.579 -15.659 39 HB3 TYR 4 1HB TYR 4 -10.070 0.834 -14.808 40 HD1 TYR 4 1HD TYR 4 -9.046 2.672 -16.036 41 HD2 TYR 4 2HD TYR 4 -10.750 -0.625 -18.095 42 HE1 TYR 4 1HE TYR 4 -9.010 3.965 -18.118 43 HE2 TYR 4 2HE TYR 4 -10.712 0.642 -20.180 44 HH TYR 4 HH TYR 4 -10.698 3.022 -20.849 45 H ILE 5 H ILE 5 -7.313 0.043 -13.329 46 HA ILE 5 HA ILE 5 -8.108 -2.365 -11.776 47 HB ILE 5 HB ILE 5 -5.702 -0.613 -11.318 48 HG12 ILE 5 2HG1 ILE 5 -4.263 -2.375 -11.902 49 HG13 ILE 5 1HG1 ILE 5 -5.499 -3.488 -12.354 50 HG21 ILE 5 1HG2 ILE 5 -6.520 -1.596 -9.308 51 HG22 ILE 5 2HG2 ILE 5 -4.961 -2.321 -9.725 52 HG23 ILE 5 3HG2 ILE 5 -6.456 -3.205 -10.026 53 HD11 ILE 5 3HD1 ILE 5 -4.598 -0.967 -13.789 54 HD12 ILE 5 1HD1 ILE 5 -6.049 -1.859 -14.252 55 HD13 ILE 5 2HD1 ILE 5 -4.469 -2.630 -14.352 56 H CYS 6 H CYS 6 -9.574 -1.756 -10.246 57 HA CYS 6 HA CYS 6 -8.767 0.516 -8.657 58 HB2 CYS 6 2HB CYS 6 -10.858 1.141 -9.855 59 HB3 CYS 6 1HB CYS 6 -11.649 -0.262 -9.137 60 HG CYS 6 HG CYS 6 -12.664 1.633 -7.614 61 HA PRO 7 HA PRO 7 -8.470 -3.187 -6.066 62 HB2 PRO 7 2HB PRO 7 -7.145 -1.917 -4.027 63 HB3 PRO 7 1HB PRO 7 -6.340 -2.581 -5.449 64 HG2 PRO 7 2HG PRO 7 -7.131 0.243 -4.867 65 HG3 PRO 7 1HG PRO 7 -5.649 -0.372 -5.618 66 HD2 PRO 7 2HD PRO 7 -7.637 0.717 -7.041 67 HD3 PRO 7 1HD PRO 7 -6.653 -0.618 -7.687 68 H GLU 8 H GLU 8 -9.966 -0.221 -5.537 69 HA GLU 8 HA GLU 8 -10.924 -0.826 -2.863 70 HB2 GLU 8 2HB GLU 8 -11.573 1.538 -4.591 71 HB3 GLU 8 1HB GLU 8 -11.750 1.398 -2.845 72 HG2 GLU 8 2HG GLU 8 -9.325 1.137 -2.661 73 HG3 GLU 8 1HG GLU 8 -9.273 1.348 -4.424 74 H THR 9 H THR 9 -12.467 0.271 -5.894 75 HA THR 9 HA THR 9 -14.947 -0.813 -4.862 76 HB THR 9 HB THR 9 -16.024 0.667 -6.527 77 HG1 THR 9 1HG THR 9 -14.841 1.564 -8.046 78 HG21 THR 9 3HG2 THR 9 -13.889 1.985 -4.847 79 HG22 THR 9 1HG2 THR 9 -15.490 1.515 -4.274 80 HG23 THR 9 2HG2 THR 9 -15.321 2.799 -5.484 81 H GLY 10 H GLY 10 -12.541 -1.783 -6.993 82 HA2 GLY 10 2HA GLY 10 -14.522 -3.114 -8.677 83 HA3 GLY 10 1HA GLY 10 -12.872 -2.984 -9.185 84 H ASP 11 H ASP 11 -12.749 -5.205 -9.537 85 HA ASP 11 HA ASP 11 -12.222 -6.877 -7.274 86 HB2 ASP 11 2HB ASP 11 -14.663 -7.056 -7.278 87 HB3 ASP 11 1HB ASP 11 -14.638 -7.510 -8.981 88 H ASP 12 H ASP 12 -11.076 -8.716 -7.831 89 HA ASP 12 HA ASP 12 -9.718 -8.585 -10.340 90 HB2 ASP 12 2HB ASP 12 -8.420 -10.523 -9.557 91 HB3 ASP 12 1HB ASP 12 -8.497 -9.250 -8.346 92 H GLY 13 H GLY 13 -12.662 -10.071 -9.579 93 HA2 GLY 13 2HA GLY 13 -12.306 -12.238 -11.485 94 HA3 GLY 13 1HA GLY 13 -13.728 -11.909 -10.505 95 H ASN 14 H ASN 14 -12.680 -9.101 -11.838 96 HA ASN 14 HA ASN 14 -14.890 -9.051 -13.727 97 HB2 ASN 14 2HB ASN 14 -13.010 -6.895 -12.773 98 HB3 ASN 14 1HB ASN 14 -14.276 -6.615 -13.951 99 HD21 ASN 14 1HD2 ASN 14 -13.905 -5.399 -11.373 100 HD22 ASN 14 2HD2 ASN 14 -15.326 -5.759 -10.461 101 H ASP 15 H ASP 15 -14.327 -7.603 -15.766 102 HA ASP 15 HA ASP 15 -12.259 -9.073 -17.216 103 HB2 ASP 15 2HB ASP 15 -14.211 -6.996 -18.219 104 HB3 ASP 15 1HB ASP 15 -13.164 -8.001 -19.207 105 H GLY 16 H GLY 16 -12.432 -6.342 -15.414 106 HA2 GLY 16 2HA GLY 16 -10.906 -4.654 -15.090 107 HA3 GLY 16 1HA GLY 16 -9.987 -5.346 -16.426 108 H SER 17 H SER 17 -13.285 -4.529 -16.761 109 HA SER 17 HA SER 17 -12.807 -2.714 -18.906 110 HB2 SER 17 2HB SER 17 -15.352 -3.318 -17.376 111 HB3 SER 17 1HB SER 17 -15.206 -2.704 -19.023 112 HG SER 17 HG SER 17 -14.105 -4.694 -19.527 113 H GLU 18 H GLU 18 -13.904 -0.393 -18.703 114 HA GLU 18 HA GLU 18 -12.701 0.895 -16.559 115 HB2 GLU 18 2HB GLU 18 -13.226 1.923 -18.775 116 HB3 GLU 18 1HB GLU 18 -14.919 1.951 -18.315 117 HG2 GLU 18 2HG GLU 18 -14.358 3.401 -16.419 118 HG3 GLU 18 1HG GLU 18 -12.682 3.367 -16.990 119 H LEU 19 H LEU 19 -16.069 -0.186 -17.070 120 HA LEU 19 HA LEU 19 -16.874 0.876 -14.538 121 HB2 LEU 19 2HB LEU 19 -18.304 -0.617 -16.702 122 HB3 LEU 19 1HB LEU 19 -19.047 -0.288 -15.154 123 HG LEU 19 HG LEU 19 -19.779 1.226 -16.791 124 HD11 LEU 19 1HD1 LEU 19 -19.637 2.087 -14.536 125 HD12 LEU 19 2HD1 LEU 19 -19.300 3.386 -15.678 126 HD13 LEU 19 3HD1 LEU 19 -17.977 2.618 -14.808 127 HD21 LEU 19 3HD2 LEU 19 -17.955 1.311 -18.363 128 HD22 LEU 19 1HD2 LEU 19 -16.922 2.103 -17.177 129 HD23 LEU 19 2HD2 LEU 19 -18.321 2.954 -17.831 130 H LYS 20 H LYS 20 -15.226 -1.826 -15.444 131 HA LYS 20 HA LYS 20 -15.935 -3.217 -12.922 132 HB2 LYS 20 2HB LYS 20 -15.275 -4.769 -15.421 133 HB3 LYS 20 1HB LYS 20 -15.780 -5.351 -13.866 134 HG2 LYS 20 2HG LYS 20 -18.028 -4.388 -14.167 135 HG3 LYS 20 1HG LYS 20 -17.580 -3.928 -15.814 136 HD2 LYS 20 2HD LYS 20 -17.095 -6.290 -16.320 137 HD3 LYS 20 1HD LYS 20 -17.596 -6.729 -14.692 138 HE2 LYS 20 2HE LYS 20 -19.424 -7.172 -16.196 139 HE3 LYS 20 1HE LYS 20 -19.839 -5.795 -15.187 140 HZ1 LYS 20 3HZ LYS 20 -18.818 -5.606 -17.972 141 HZ2 LYS 20 1HZ LYS 20 -19.276 -4.313 -17.003 142 HZ3 LYS 20 2HZ LYS 20 -20.425 -5.431 -17.498 143 HA PRO 21 HA PRO 21 -11.529 -2.519 -13.597 144 HB2 PRO 21 2HB PRO 21 -11.031 -1.354 -11.193 145 HB3 PRO 21 1HB PRO 21 -11.508 -0.450 -12.632 146 HG2 PRO 21 2HG PRO 21 -13.118 -1.208 -10.253 147 HG3 PRO 21 1HG PRO 21 -13.241 0.218 -11.294 148 HD2 PRO 21 2HD PRO 21 -14.887 -2.011 -11.392 149 HD3 PRO 21 1HD PRO 21 -14.700 -0.813 -12.687 150 H LEU 22 H LEU 22 -9.863 -3.649 -12.713 151 HA LEU 22 HA LEU 22 -10.599 -5.989 -11.175 152 HB2 LEU 22 2HB LEU 22 -7.935 -5.051 -12.200 153 HB3 LEU 22 1HB LEU 22 -8.259 -6.624 -11.502 154 HG LEU 22 HG LEU 22 -9.493 -5.582 -14.038 155 HD11 LEU 22 1HD1 LEU 22 -8.061 -7.183 -15.131 156 HD12 LEU 22 2HD1 LEU 22 -7.320 -7.597 -13.586 157 HD13 LEU 22 3HD1 LEU 22 -7.122 -5.980 -14.251 158 HD21 LEU 22 3HD2 LEU 22 -9.589 -8.291 -12.733 159 HD22 LEU 22 1HD2 LEU 22 -10.245 -7.885 -14.315 160 HD23 LEU 22 2HD2 LEU 22 -10.929 -7.154 -12.866 161 H ARG 23 H ARG 23 -9.581 -6.548 -9.159 162 HA ARG 23 HA ARG 23 -9.188 -4.110 -7.662 163 HB2 ARG 23 2HB ARG 23 -9.532 -5.345 -5.635 164 HB3 ARG 23 1HB ARG 23 -10.714 -5.844 -6.788 165 HG2 ARG 23 2HG ARG 23 -9.612 -7.908 -7.182 166 HG3 ARG 23 1HG ARG 23 -8.206 -7.399 -6.244 167 HD2 ARG 23 2HD ARG 23 -9.554 -8.864 -4.894 168 HD3 ARG 23 1HD ARG 23 -9.637 -7.229 -4.249 169 HE ARG 23 HE ARG 23 -11.784 -8.555 -5.796 170 HH11 ARG 23 1HH1 ARG 23 -10.818 -6.168 -3.338 171 HH12 ARG 23 2HH1 ARG 23 -12.417 -5.833 -2.874 172 HH21 ARG 23 1HH2 ARG 23 -13.857 -8.120 -5.162 173 HH22 ARG 23 2HH2 ARG 23 -14.247 -6.958 -3.961 174 H THR 24 H THR 24 -7.229 -5.996 -9.354 175 HA THR 24 HA THR 24 -4.949 -5.049 -7.910 176 HB THR 24 HB THR 24 -5.028 -7.191 -6.849 177 HG1 THR 24 1HG THR 24 -3.017 -6.927 -7.224 178 HG21 THR 24 3HG2 THR 24 -6.581 -8.338 -8.371 179 HG22 THR 24 1HG2 THR 24 -5.141 -9.313 -8.075 180 HG23 THR 24 2HG2 THR 24 -5.314 -8.425 -9.591 181 H LEU 25 H LEU 25 -3.145 -4.896 -9.094 182 HA LEU 25 HA LEU 25 -3.459 -4.567 -11.896 183 HB2 LEU 25 2HB LEU 25 -2.053 -3.129 -10.477 184 HB3 LEU 25 1HB LEU 25 -1.042 -4.500 -10.104 185 HG LEU 25 HG LEU 25 -0.255 -4.593 -12.378 186 HD11 LEU 25 1HD1 LEU 25 -2.285 -3.795 -13.525 187 HD12 LEU 25 2HD1 LEU 25 -0.876 -2.856 -14.002 188 HD13 LEU 25 3HD1 LEU 25 -2.034 -2.182 -12.858 189 HD21 LEU 25 3HD2 LEU 25 0.956 -2.440 -12.393 190 HD22 LEU 25 1HD2 LEU 25 0.910 -3.198 -10.802 191 HD23 LEU 25 2HD2 LEU 25 -0.163 -1.847 -11.167 192 H TYR 26 H TYR 26 -2.558 -7.089 -9.766 193 HA TYR 26 HA TYR 26 -0.892 -8.692 -11.370 194 HB2 TYR 26 2HB TYR 26 -1.233 -9.049 -8.973 195 HB3 TYR 26 1HB TYR 26 -2.926 -9.416 -9.255 196 HD1 TYR 26 1HD TYR 26 0.274 -10.562 -10.763 197 HD2 TYR 26 2HD TYR 26 -3.347 -11.654 -8.846 198 HE1 TYR 26 1HE TYR 26 0.911 -12.867 -10.919 199 HE2 TYR 26 2HE TYR 26 -2.715 -14.027 -9.022 200 HH TYR 26 HH TYR 26 -1.255 -15.480 -10.064 201 H GLN 27 H GLN 27 -4.410 -8.630 -11.051 202 HA GLN 27 HA GLN 27 -4.819 -10.736 -12.896 203 HB2 GLN 27 2HB GLN 27 -6.501 -10.206 -11.212 204 HB3 GLN 27 1HB GLN 27 -6.754 -8.620 -11.909 205 HG2 GLN 27 2HG GLN 27 -8.564 -10.143 -12.515 206 HG3 GLN 27 1HG GLN 27 -7.673 -9.652 -13.940 207 HE21 GLN 27 1HE2 GLN 27 -8.345 -11.420 -15.086 208 HE22 GLN 27 2HE2 GLN 27 -7.746 -13.007 -14.836 209 H ALA 28 H ALA 28 -4.463 -7.251 -13.275 210 HA ALA 28 HA ALA 28 -5.432 -6.969 -15.842 211 HB1 ALA 28 1HB ALA 28 -4.893 -5.118 -14.314 212 HB2 ALA 28 2HB ALA 28 -4.093 -4.934 -15.871 213 HB3 ALA 28 3HB ALA 28 -3.179 -5.506 -14.469 214 H MET 29 H MET 29 -2.213 -7.853 -14.616 215 HA MET 29 HA MET 29 -1.187 -8.197 -17.199 216 HB2 MET 29 2HB MET 29 -0.234 -8.864 -14.485 217 HB3 MET 29 1HB MET 29 0.588 -9.576 -15.843 218 HG2 MET 29 2HG MET 29 0.849 -7.155 -16.704 219 HG3 MET 29 1HG MET 29 0.353 -6.666 -15.096 220 HE1 MET 29 3HE MET 29 4.178 -6.075 -15.265 221 HE2 MET 29 1HE MET 29 2.596 -5.334 -15.033 222 HE3 MET 29 2HE MET 29 3.037 -5.966 -16.616 223 H ILE 30 H ILE 30 -2.859 -10.292 -14.998 224 HA ILE 30 HA ILE 30 -2.217 -12.700 -16.352 225 HB ILE 30 HB ILE 30 -4.656 -12.106 -14.652 226 HG12 ILE 30 2HG1 ILE 30 -2.009 -13.393 -13.929 227 HG13 ILE 30 1HG1 ILE 30 -2.588 -11.820 -13.403 228 HG21 ILE 30 1HG2 ILE 30 -4.855 -14.535 -14.394 229 HG22 ILE 30 2HG2 ILE 30 -3.511 -14.755 -15.518 230 HG23 ILE 30 3HG2 ILE 30 -5.028 -14.043 -16.080 231 HD11 ILE 30 3HD1 ILE 30 -4.406 -12.894 -12.189 232 HD12 ILE 30 1HD1 ILE 30 -2.821 -13.473 -11.665 233 HD13 ILE 30 2HD1 ILE 30 -3.816 -14.469 -12.734 234 H ILE 31 H ILE 31 -4.841 -10.434 -16.784 235 HA ILE 31 HA ILE 31 -6.221 -11.998 -18.671 236 HB ILE 31 HB ILE 31 -6.324 -8.996 -18.291 237 HG12 ILE 31 2HG1 ILE 31 -8.022 -11.224 -17.164 238 HG13 ILE 31 1HG1 ILE 31 -6.894 -10.218 -16.265 239 HG21 ILE 31 1HG2 ILE 31 -7.180 -9.774 -20.449 240 HG22 ILE 31 2HG2 ILE 31 -8.486 -9.168 -19.396 241 HG23 ILE 31 3HG2 ILE 31 -8.223 -10.913 -19.563 242 HD11 ILE 31 3HD1 ILE 31 -8.265 -8.261 -16.812 243 HD12 ILE 31 1HD1 ILE 31 -9.160 -9.489 -15.892 244 HD13 ILE 31 2HD1 ILE 31 -9.392 -9.341 -17.637 245 H THR 32 H THR 32 -3.804 -9.415 -18.977 246 HA THR 32 HA THR 32 -4.039 -9.366 -21.825 247 HB THR 32 HB THR 32 -2.161 -7.727 -21.666 248 HG1 THR 32 1HG THR 32 -2.403 -7.603 -18.918 249 HG21 THR 32 3HG2 THR 32 -4.423 -7.203 -19.693 250 HG22 THR 32 1HG2 THR 32 -4.533 -6.996 -21.429 251 HG23 THR 32 2HG2 THR 32 -3.438 -5.986 -20.490 252 H LYS 33 H LYS 33 -1.812 -10.651 -19.418 253 HA LYS 33 HA LYS 33 -0.167 -12.139 -19.406 254 HB2 LYS 33 2HB LYS 33 -1.161 -12.906 -22.154 255 HB3 LYS 33 1HB LYS 33 0.026 -13.819 -21.236 256 HG2 LYS 33 2HG LYS 33 -1.667 -14.198 -19.482 257 HG3 LYS 33 1HG LYS 33 -2.846 -13.329 -20.458 258 HD2 LYS 33 2HD LYS 33 -1.413 -15.869 -21.246 259 HD3 LYS 33 1HD LYS 33 -3.086 -15.753 -20.709 260 HE2 LYS 33 2HE LYS 33 -3.593 -14.340 -22.652 261 HE3 LYS 33 1HE LYS 33 -1.926 -14.493 -23.198 262 HZ1 LYS 33 3HZ LYS 33 -2.273 -16.896 -23.342 263 HZ2 LYS 33 1HZ LYS 33 -3.319 -16.049 -24.355 264 HZ3 LYS 33 2HZ LYS 33 -3.877 -16.701 -22.902 265 H SER 34 H SER 34 -0.095 -9.504 -21.055 266 HA SER 34 HA SER 34 2.297 -10.032 -22.645 267 HB2 SER 34 2HB SER 34 0.458 -8.651 -23.590 268 HB3 SER 34 1HB SER 34 0.718 -7.476 -22.308 269 HG SER 34 HG SER 34 1.752 -6.811 -24.119 270 H SER 35 H SER 35 1.425 -8.839 -19.551 271 HA SER 35 HA SER 35 2.525 -7.832 -17.821 272 HB2 SER 35 2HB SER 35 4.117 -9.757 -18.259 273 HB3 SER 35 1HB SER 35 5.042 -8.688 -19.305 274 HG SER 35 HG SER 35 4.524 -8.300 -16.556 275 H LYS 36 H LYS 36 2.009 -6.431 -20.501 276 HA LYS 36 HA LYS 36 3.267 -3.954 -20.051 277 HB2 LYS 36 2HB LYS 36 3.629 -5.536 -22.616 278 HB3 LYS 36 1HB LYS 36 4.015 -3.835 -22.434 279 HG2 LYS 36 2HG LYS 36 5.771 -4.420 -20.820 280 HG3 LYS 36 1HG LYS 36 5.369 -6.126 -21.016 281 HD2 LYS 36 2HD LYS 36 6.335 -4.294 -23.212 282 HD3 LYS 36 1HD LYS 36 7.341 -5.450 -22.349 283 HE2 LYS 36 2HE LYS 36 4.939 -6.121 -24.064 284 HE3 LYS 36 1HE LYS 36 6.621 -6.316 -24.527 285 HZ1 LYS 36 3HZ LYS 36 6.861 -7.926 -22.671 286 HZ2 LYS 36 1HZ LYS 36 5.720 -8.397 -23.818 287 HZ3 LYS 36 2HZ LYS 36 5.207 -7.786 -22.354 288 H GLY 37 H GLY 37 2.085 -2.508 -21.275 289 HA2 GLY 37 2HA GLY 37 0.287 -2.453 -23.133 290 HA3 GLY 37 1HA GLY 37 -0.594 -3.468 -21.988 291 H ASP 38 H ASP 38 -2.149 -1.636 -22.097 292 HA ASP 38 HA ASP 38 -1.182 0.659 -20.597 293 HB2 ASP 38 2HB ASP 38 -3.786 0.241 -22.083 294 HB3 ASP 38 1HB ASP 38 -3.358 1.694 -21.190 295 H PHE 39 H PHE 39 -1.356 0.511 -18.520 296 HA PHE 39 HA PHE 39 -3.675 -0.893 -17.413 297 HB2 PHE 39 2HB PHE 39 -0.885 -0.721 -16.247 298 HB3 PHE 39 1HB PHE 39 -2.264 -1.521 -15.502 299 HD1 PHE 39 1HD PHE 39 -3.348 -3.411 -16.902 300 HD2 PHE 39 2HD PHE 39 0.583 -1.960 -17.555 301 HE1 PHE 39 1HE PHE 39 -2.764 -5.510 -18.051 302 HE2 PHE 39 2HE PHE 39 1.170 -4.039 -18.703 303 HZ PHE 39 HZ PHE 39 -0.496 -5.820 -18.951 304 H LEU 40 H LEU 40 -4.990 0.489 -16.460 305 HA LEU 40 HA LEU 40 -3.796 2.922 -15.341 306 HB2 LEU 40 2HB LEU 40 -6.563 2.714 -16.565 307 HB3 LEU 40 1HB LEU 40 -5.750 4.109 -15.884 308 HG LEU 40 HG LEU 40 -4.866 2.700 -18.394 309 HD11 LEU 40 1HD1 LEU 40 -6.324 5.309 -18.034 310 HD12 LEU 40 2HD1 LEU 40 -6.977 3.824 -18.733 311 HD13 LEU 40 3HD1 LEU 40 -5.675 4.683 -19.552 312 HD21 LEU 40 3HD2 LEU 40 -3.024 3.749 -17.207 313 HD22 LEU 40 1HD2 LEU 40 -3.925 5.264 -17.107 314 HD23 LEU 40 2HD2 LEU 40 -3.405 4.645 -18.675 315 H ILE 41 H ILE 41 -4.108 3.189 -13.295 316 HA ILE 41 HA ILE 41 -6.078 1.489 -11.980 317 HB ILE 41 HB ILE 41 -3.534 2.666 -10.820 318 HG12 ILE 41 2HG1 ILE 41 -4.151 -0.057 -12.028 319 HG13 ILE 41 1HG1 ILE 41 -2.873 1.055 -12.367 320 HG21 ILE 41 1HG2 ILE 41 -5.516 0.707 -9.661 321 HG22 ILE 41 2HG2 ILE 41 -5.281 2.375 -9.159 322 HG23 ILE 41 3HG2 ILE 41 -3.995 1.185 -8.892 323 HD11 ILE 41 3HD1 ILE 41 -1.674 0.465 -10.402 324 HD12 ILE 41 1HD1 ILE 41 -2.272 -1.006 -11.216 325 HD13 ILE 41 2HD1 ILE 41 -3.103 -0.427 -9.796 326 H ARG 42 H ARG 42 -7.476 2.336 -10.578 327 HA ARG 42 HA ARG 42 -8.199 5.088 -10.899 328 HB2 ARG 42 2HB ARG 42 -9.720 3.066 -10.507 329 HB3 ARG 42 1HB ARG 42 -9.254 3.193 -8.824 330 HG2 ARG 42 2HG ARG 42 -11.335 4.356 -8.965 331 HG3 ARG 42 1HG ARG 42 -10.086 5.557 -8.908 332 HD2 ARG 42 2HD ARG 42 -10.381 6.277 -10.999 333 HD3 ARG 42 1HD ARG 42 -10.903 4.695 -11.645 334 HE ARG 42 HE ARG 42 -12.782 5.748 -9.845 335 HH11 ARG 42 1HH1 ARG 42 -11.597 6.374 -13.147 336 HH12 ARG 42 2HH1 ARG 42 -13.041 7.108 -13.659 337 HH21 ARG 42 1HH2 ARG 42 -14.745 6.763 -10.586 338 HH22 ARG 42 2HH2 ARG 42 -14.843 7.338 -12.179 339 H THR 43 H THR 43 -7.598 6.663 -9.705 340 HA THR 43 HA THR 43 -6.479 6.235 -7.050 341 HB THR 43 HB THR 43 -4.606 6.399 -8.760 342 HG1 THR 43 1HG THR 43 -3.996 6.991 -6.779 343 HG21 THR 43 3HG2 THR 43 -5.638 9.223 -9.061 344 HG22 THR 43 1HG2 THR 43 -5.619 7.970 -10.307 345 HG23 THR 43 2HG2 THR 43 -4.102 8.623 -9.692 346 H LYS 44 H LYS 44 -6.558 8.257 -5.754 347 HA LYS 44 HA LYS 44 -8.772 9.911 -6.744 348 HB2 LYS 44 2HB LYS 44 -7.896 9.383 -3.905 349 HB3 LYS 44 1HB LYS 44 -9.136 10.573 -4.312 350 HG2 LYS 44 2HG LYS 44 -10.292 8.687 -3.562 351 HG3 LYS 44 1HG LYS 44 -10.369 8.555 -5.318 352 HD2 LYS 44 2HD LYS 44 -9.806 6.370 -4.492 353 HD3 LYS 44 1HD LYS 44 -8.352 7.131 -5.176 354 HE2 LYS 44 2HE LYS 44 -7.523 7.699 -2.999 355 HE3 LYS 44 1HE LYS 44 -8.994 7.103 -2.235 356 HZ1 LYS 44 3HZ LYS 44 -8.449 4.897 -3.034 357 HZ2 LYS 44 1HZ LYS 44 -7.198 5.496 -2.069 358 HZ3 LYS 44 2HZ LYS 44 -7.035 5.492 -3.752 359 H LYS 45 H LYS 45 -8.377 11.819 -7.298 360 HA LYS 45 HA LYS 45 -6.015 13.241 -6.294 361 HB2 LYS 45 2HB LYS 45 -5.627 12.351 -8.655 362 HB3 LYS 45 1HB LYS 45 -7.090 13.173 -9.100 363 HG2 LYS 45 2HG LYS 45 -6.090 15.303 -8.716 364 HG3 LYS 45 1HG LYS 45 -4.636 14.520 -8.082 365 HD2 LYS 45 2HD LYS 45 -5.734 13.912 -10.740 366 HD3 LYS 45 1HD LYS 45 -4.564 15.259 -10.551 367 HE2 LYS 45 2HE LYS 45 -4.174 12.291 -9.974 368 HE3 LYS 45 1HE LYS 45 -3.493 13.190 -11.315 369 HZ1 LYS 45 3HZ LYS 45 -2.836 13.636 -8.450 370 HZ2 LYS 45 1HZ LYS 45 -2.216 14.498 -9.775 371 HZ3 LYS 45 2HZ LYS 45 -1.889 12.863 -9.618 372 H ASP 46 H ASP 46 -6.908 14.818 -5.099 373 HA ASP 46 HA ASP 46 -8.098 16.640 -4.487 374 HB2 ASP 46 2HB ASP 46 -8.230 16.953 -7.476 375 HB3 ASP 46 1HB ASP 46 -8.970 18.141 -6.408 376 H GLY 47 H GLY 47 -9.478 14.190 -4.522 377 HA2 GLY 47 2HA GLY 47 -11.627 13.734 -3.733 378 HA3 GLY 47 1HA GLY 47 -12.168 15.272 -4.373 379 H LYS 48 H LYS 48 -10.540 13.843 -6.860 380 HA LYS 48 HA LYS 48 -12.997 12.494 -7.747 381 HB2 LYS 48 2HB LYS 48 -10.881 13.781 -9.473 382 HB3 LYS 48 1HB LYS 48 -12.277 12.903 -10.068 383 HG2 LYS 48 2HG LYS 48 -13.731 14.600 -9.031 384 HG3 LYS 48 1HG LYS 48 -12.291 15.508 -8.555 385 HD2 LYS 48 2HD LYS 48 -11.624 15.561 -10.972 386 HD3 LYS 48 1HD LYS 48 -13.171 14.818 -11.359 387 HE2 LYS 48 2HE LYS 48 -13.295 17.210 -11.689 388 HE3 LYS 48 1HE LYS 48 -14.321 16.733 -10.335 389 HZ1 LYS 48 3HZ LYS 48 -12.981 18.736 -9.865 390 HZ2 LYS 48 1HZ LYS 48 -11.581 17.834 -10.082 391 HZ3 LYS 48 2HZ LYS 48 -12.623 17.484 -8.805 392 H GLN 49 H GLN 49 -12.836 10.497 -8.708 393 HA GLN 49 HA GLN 49 -10.377 9.081 -8.251 394 HB2 GLN 49 2HB GLN 49 -13.093 8.225 -9.233 395 HB3 GLN 49 1HB GLN 49 -11.746 7.152 -8.938 396 HG2 GLN 49 2HG GLN 49 -11.843 7.666 -6.571 397 HG3 GLN 49 1HG GLN 49 -13.173 8.793 -6.865 398 HE21 GLN 49 1HE2 GLN 49 -14.586 7.611 -5.569 399 HE22 GLN 49 2HE2 GLN 49 -15.253 6.106 -6.091 400 H VAL 50 H VAL 50 -9.027 8.857 -9.877 401 HA VAL 50 HA VAL 50 -10.030 9.158 -12.618 402 HB VAL 50 HB VAL 50 -7.984 10.404 -13.259 403 HG11 VAL 50 1HG1 VAL 50 -8.584 12.568 -12.263 404 HG12 VAL 50 2HG1 VAL 50 -9.588 11.730 -11.076 405 HG13 VAL 50 3HG1 VAL 50 -10.003 11.663 -12.786 406 HG21 VAL 50 3HG2 VAL 50 -6.555 11.415 -11.528 407 HG22 VAL 50 1HG2 VAL 50 -6.490 9.648 -11.471 408 HG23 VAL 50 2HG2 VAL 50 -7.444 10.528 -10.289 409 H TRP 51 H TRP 51 -8.295 8.422 -14.214 410 HA TRP 51 HA TRP 51 -7.241 5.921 -13.193 411 HB2 TRP 51 2HB TRP 51 -7.739 6.881 -16.007 412 HB3 TRP 51 1HB TRP 51 -7.099 5.313 -15.651 413 HD1 TRP 51 HD TRP 51 -10.083 6.893 -16.480 414 HE1 TRP 51 1HE TRP 51 -12.192 5.471 -15.885 415 HE3 TRP 51 3HE TRP 51 -7.895 3.593 -13.301 416 HZ2 TRP 51 2HZ TRP 51 -12.782 3.241 -14.255 417 HZ3 TRP 51 3HZ TRP 51 -9.276 1.847 -12.269 418 HH2 TRP 51 HH TRP 51 -11.668 1.676 -12.731 419 H GLU 52 H GLU 52 -5.188 5.760 -12.800 420 HA GLU 52 HA GLU 52 -3.297 7.671 -13.982 421 HB2 GLU 52 2HB GLU 52 -3.581 7.954 -11.585 422 HB3 GLU 52 1HB GLU 52 -3.303 6.244 -11.311 423 HG2 GLU 52 2HG GLU 52 -1.369 7.605 -10.703 424 HG3 GLU 52 1HG GLU 52 -0.994 6.502 -12.026 425 H ALA 53 H ALA 53 -1.363 6.812 -14.713 426 HA ALA 53 HA ALA 53 -1.576 4.158 -15.747 427 HB1 ALA 53 1HB ALA 53 0.755 6.062 -15.813 428 HB2 ALA 53 2HB ALA 53 -0.512 5.960 -17.030 429 HB3 ALA 53 3HB ALA 53 0.586 4.602 -16.782 430 H ALA 54 H ALA 54 -0.654 2.349 -15.055 431 HA ALA 54 HA ALA 54 0.423 2.177 -12.448 432 HB1 ALA 54 1HB ALA 54 0.529 0.175 -14.708 433 HB2 ALA 54 2HB ALA 54 -0.760 0.310 -13.513 434 HB3 ALA 54 3HB ALA 54 0.865 -0.164 -13.012 435 H SER 55 H SER 55 2.637 1.457 -11.911 436 HA SER 55 HA SER 55 4.517 2.815 -13.646 437 HB2 SER 55 2HB SER 55 5.942 2.811 -11.594 438 HB3 SER 55 1HB SER 55 4.407 3.644 -11.353 439 HG SER 55 HG SER 55 4.007 2.319 -9.836 440 H LYS 56 H LYS 56 6.551 1.691 -14.015 441 HA LYS 56 HA LYS 56 6.067 -1.005 -14.666 442 HB2 LYS 56 2HB LYS 56 8.701 0.486 -14.654 443 HB3 LYS 56 1HB LYS 56 8.402 -1.083 -15.398 444 HG2 LYS 56 2HG LYS 56 6.726 -0.037 -16.878 445 HG3 LYS 56 1HG LYS 56 7.134 1.526 -16.169 446 HD2 LYS 56 2HD LYS 56 9.440 1.259 -16.955 447 HD3 LYS 56 1HD LYS 56 9.004 -0.280 -17.698 448 HE2 LYS 56 2HE LYS 56 7.852 2.427 -18.394 449 HE3 LYS 56 1HE LYS 56 9.001 1.513 -19.364 450 HZ1 LYS 56 3HZ LYS 56 7.264 -0.239 -19.606 451 HZ2 LYS 56 1HZ LYS 56 6.767 1.246 -20.219 452 HZ3 LYS 56 2HZ LYS 56 6.191 0.727 -18.750 453 H THR 57 H THR 57 7.395 0.540 -11.935 454 HA THR 57 HA THR 57 8.606 -1.710 -10.721 455 HB THR 57 HB THR 57 7.360 0.719 -9.400 456 HG1 THR 57 1HG THR 57 8.945 1.709 -10.295 457 HG21 THR 57 3HG2 THR 57 9.507 -1.184 -8.427 458 HG22 THR 57 1HG2 THR 57 7.842 -1.129 -7.847 459 HG23 THR 57 2HG2 THR 57 8.915 0.240 -7.564 460 H ALA 58 H ALA 58 5.331 -0.260 -10.416 461 HA ALA 58 HA ALA 58 4.327 -2.218 -8.630 462 HB1 ALA 58 1HB ALA 58 2.814 -0.469 -10.572 463 HB2 ALA 58 2HB ALA 58 3.269 -0.018 -8.933 464 HB3 ALA 58 3HB ALA 58 2.117 -1.330 -9.199 465 H LEU 59 H LEU 59 4.355 -1.889 -12.125 466 HA LEU 59 HA LEU 59 2.846 -4.134 -12.741 467 HB2 LEU 59 2HB LEU 59 4.994 -2.620 -14.155 468 HB3 LEU 59 1HB LEU 59 4.156 -4.017 -14.920 469 HG LEU 59 HG LEU 59 2.908 -1.415 -14.003 470 HD11 LEU 59 1HD1 LEU 59 4.413 -1.077 -15.911 471 HD12 LEU 59 2HD1 LEU 59 2.725 -0.926 -16.405 472 HD13 LEU 59 3HD1 LEU 59 3.621 -2.398 -16.769 473 HD21 LEU 59 3HD2 LEU 59 0.970 -2.165 -15.172 474 HD22 LEU 59 1HD2 LEU 59 1.407 -3.414 -14.016 475 HD23 LEU 59 2HD2 LEU 59 1.789 -3.610 -15.733 476 H LYS 60 H LYS 60 6.393 -3.787 -12.232 477 HA LYS 60 HA LYS 60 7.141 -6.370 -12.697 478 HB2 LYS 60 2HB LYS 60 8.739 -4.563 -12.343 479 HB3 LYS 60 1HB LYS 60 8.203 -4.378 -10.686 480 HG2 LYS 60 2HG LYS 60 10.314 -5.548 -10.746 481 HG3 LYS 60 1HG LYS 60 9.042 -6.612 -10.155 482 HD2 LYS 60 2HD LYS 60 10.375 -7.895 -11.698 483 HD3 LYS 60 1HD LYS 60 8.820 -7.480 -12.445 484 HE2 LYS 60 2HE LYS 60 9.797 -5.763 -13.761 485 HE3 LYS 60 1HE LYS 60 11.333 -5.901 -12.908 486 HZ1 LYS 60 3HZ LYS 60 10.153 -8.000 -14.678 487 HZ2 LYS 60 1HZ LYS 60 11.592 -8.124 -13.842 488 HZ3 LYS 60 2HZ LYS 60 11.440 -6.985 -15.055 489 H LYS 61 H LYS 61 5.955 -4.905 -9.677 490 HA LYS 61 HA LYS 61 6.228 -7.209 -8.065 491 HB2 LYS 61 2HB LYS 61 4.322 -4.890 -7.751 492 HB3 LYS 61 1HB LYS 61 4.678 -6.082 -6.510 493 HG2 LYS 61 2HG LYS 61 7.013 -5.369 -6.501 494 HG3 LYS 61 1HG LYS 61 6.651 -4.175 -7.746 495 HD2 LYS 61 2HD LYS 61 5.072 -3.084 -6.217 496 HD3 LYS 61 1HD LYS 61 5.473 -4.269 -4.968 497 HE2 LYS 61 2HE LYS 61 7.385 -2.329 -6.258 498 HE3 LYS 61 1HE LYS 61 6.697 -2.185 -4.640 499 HZ1 LYS 61 3HZ LYS 61 7.880 -4.178 -3.983 500 HZ2 LYS 61 1HZ LYS 61 8.947 -3.072 -4.639 501 HZ3 LYS 61 2HZ LYS 61 8.487 -4.401 -5.543 502 H SER 62 H SER 62 3.788 -6.222 -10.284 503 HA SER 62 HA SER 62 1.805 -8.070 -9.377 504 HB2 SER 62 2HB SER 62 2.042 -6.507 -11.960 505 HB3 SER 62 1HB SER 62 0.589 -7.333 -11.385 506 HG SER 62 HG SER 62 1.911 -5.100 -10.268 507 H TRP 63 H TRP 63 4.188 -7.965 -12.065 508 HA TRP 63 HA TRP 63 3.393 -10.479 -13.072 509 HB2 TRP 63 2HB TRP 63 4.435 -8.744 -14.463 510 HB3 TRP 63 1HB TRP 63 5.921 -8.897 -13.534 511 HD1 TRP 63 HD TRP 63 7.550 -10.618 -14.259 512 HE1 TRP 63 1HE TRP 63 7.627 -12.474 -16.096 513 HE3 TRP 63 3HE TRP 63 2.677 -10.485 -15.669 514 HZ2 TRP 63 2HZ TRP 63 5.770 -13.708 -17.889 515 HZ3 TRP 63 3HZ TRP 63 1.872 -12.036 -17.420 516 HH2 TRP 63 HH TRP 63 3.403 -13.598 -18.507 517 H LYS 64 H LYS 64 5.648 -9.397 -10.689 518 HA LYS 64 HA LYS 64 7.249 -11.639 -10.450 519 HB2 LYS 64 2HB LYS 64 7.723 -9.565 -9.255 520 HB3 LYS 64 1HB LYS 64 6.272 -9.771 -8.284 521 HG2 LYS 64 2HG LYS 64 7.213 -11.757 -7.262 522 HG3 LYS 64 1HG LYS 64 8.653 -11.608 -8.268 523 HD2 LYS 64 2HD LYS 64 9.161 -9.471 -7.247 524 HD3 LYS 64 1HD LYS 64 7.707 -9.585 -6.248 525 HE2 LYS 64 2HE LYS 64 9.699 -10.252 -4.975 526 HE3 LYS 64 1HE LYS 64 8.586 -11.601 -5.178 527 HZ1 LYS 64 3HZ LYS 64 10.815 -12.322 -5.557 528 HZ2 LYS 64 1HZ LYS 64 11.082 -11.142 -6.733 529 HZ3 LYS 64 2HZ LYS 64 9.999 -12.411 -7.001 530 H ARG 65 H ARG 65 4.010 -10.982 -9.237 531 HA ARG 65 HA ARG 65 3.844 -13.286 -7.548 532 HB2 ARG 65 2HB ARG 65 2.312 -11.094 -7.590 533 HB3 ARG 65 1HB ARG 65 1.487 -11.969 -8.825 534 HG2 ARG 65 2HG ARG 65 1.079 -13.856 -7.349 535 HG3 ARG 65 1HG ARG 65 1.847 -12.981 -6.022 536 HD2 ARG 65 2HD ARG 65 -0.667 -12.215 -7.511 537 HD3 ARG 65 1HD ARG 65 -0.556 -12.841 -5.873 538 HE ARG 65 HE ARG 65 0.914 -10.425 -6.124 539 HH11 ARG 65 1HH1 ARG 65 -2.384 -11.690 -5.804 540 HH12 ARG 65 2HH1 ARG 65 -3.045 -10.231 -5.233 541 HH21 ARG 65 1HH2 ARG 65 0.014 -8.434 -5.315 542 HH22 ARG 65 2HH2 ARG 65 -1.652 -8.329 -4.931 543 H TYR 66 H TYR 66 3.293 -12.567 -10.889 544 HA TYR 66 HA TYR 66 1.663 -14.757 -11.743 545 HB2 TYR 66 2HB TYR 66 2.258 -12.544 -12.919 546 HB3 TYR 66 1HB TYR 66 3.765 -13.326 -13.356 547 HD1 TYR 66 1HD TYR 66 3.602 -15.484 -14.754 548 HD2 TYR 66 2HD TYR 66 0.366 -12.816 -14.143 549 HE1 TYR 66 1HE TYR 66 2.493 -16.399 -16.719 550 HE2 TYR 66 2HE TYR 66 -0.756 -13.690 -16.079 551 HH TYR 66 HH TYR 66 0.135 -16.587 -17.584 552 H GLU 67 H GLU 67 5.135 -14.141 -11.792 553 HA GLU 67 HA GLU 67 6.155 -16.643 -12.681 554 HB2 GLU 67 2HB GLU 67 7.287 -14.740 -10.635 555 HB3 GLU 67 1HB GLU 67 8.182 -15.969 -11.527 556 HG2 GLU 67 2HG GLU 67 6.686 -13.773 -12.781 557 HG3 GLU 67 1HG GLU 67 8.390 -13.594 -12.346 558 H GLN 68 H GLN 68 5.433 -15.483 -9.537 559 HA GLN 68 HA GLN 68 6.161 -17.770 -8.100 560 HB2 GLN 68 2HB GLN 68 4.021 -15.759 -7.470 561 HB3 GLN 68 1HB GLN 68 4.545 -17.012 -6.350 562 HG2 GLN 68 2HG GLN 68 6.773 -16.094 -6.301 563 HG3 GLN 68 1HG GLN 68 6.333 -14.910 -7.530 564 HE21 GLN 68 1HE2 GLN 68 6.878 -13.263 -6.194 565 HE22 GLN 68 2HE2 GLN 68 5.907 -12.752 -4.849 566 H GLU 69 H GLU 69 2.968 -17.040 -9.573 567 HA GLU 69 HA GLU 69 2.048 -19.575 -8.682 568 HB2 GLU 69 2HB GLU 69 0.715 -17.727 -10.644 569 HB3 GLU 69 1HB GLU 69 0.032 -19.261 -10.139 570 HG2 GLU 69 2HG GLU 69 0.302 -18.291 -7.745 571 HG3 GLU 69 1HG GLU 69 0.388 -16.741 -8.590 572 H MET 70 H MET 70 3.469 -18.499 -11.652 573 HA MET 70 HA MET 70 2.892 -20.891 -13.090 574 HB2 MET 70 2HB MET 70 5.189 -18.959 -13.477 575 HB3 MET 70 1HB MET 70 4.759 -20.237 -14.599 576 HG2 MET 70 2HG MET 70 3.071 -17.856 -13.858 577 HG3 MET 70 1HG MET 70 3.943 -18.091 -15.367 578 HE1 MET 70 3HE MET 70 1.960 -21.101 -16.967 579 HE2 MET 70 1HE MET 70 3.389 -21.216 -15.942 580 HE3 MET 70 2HE MET 70 3.291 -19.966 -17.180 581 H LEU 71 H LEU 71 5.552 -19.876 -11.069 582 HA LEU 71 HA LEU 71 7.071 -22.225 -11.303 583 HB2 LEU 71 2HB LEU 71 8.090 -20.235 -10.682 584 HB3 LEU 71 1HB LEU 71 7.004 -19.887 -9.381 585 HG LEU 71 HG LEU 71 8.039 -21.838 -8.158 586 HD11 LEU 71 1HD1 LEU 71 10.164 -22.717 -8.971 587 HD12 LEU 71 2HD1 LEU 71 10.013 -21.750 -10.441 588 HD13 LEU 71 3HD1 LEU 71 8.865 -23.048 -10.117 589 HD21 LEU 71 3HD2 LEU 71 8.738 -19.565 -7.706 590 HD22 LEU 71 1HD2 LEU 71 9.894 -19.636 -9.037 591 HD23 LEU 71 2HD2 LEU 71 10.120 -20.659 -7.618 592 H LYS 72 H LYS 72 4.370 -21.281 -9.331 593 HA LYS 72 HA LYS 72 4.462 -23.511 -7.521 594 HB2 LYS 72 2HB LYS 72 3.308 -21.399 -6.964 595 HB3 LYS 72 1HB LYS 72 2.203 -21.682 -8.298 596 HG2 LYS 72 2HG LYS 72 1.303 -23.640 -7.169 597 HG3 LYS 72 1HG LYS 72 2.444 -23.411 -5.844 598 HD2 LYS 72 2HD LYS 72 0.254 -22.524 -5.250 599 HD3 LYS 72 1HD LYS 72 1.460 -21.238 -5.359 600 HE2 LYS 72 2HE LYS 72 0.635 -20.669 -7.619 601 HE3 LYS 72 1HE LYS 72 -0.570 -21.949 -7.485 602 HZ1 LYS 72 3HZ LYS 72 -1.476 -19.746 -7.002 603 HZ2 LYS 72 1HZ LYS 72 -0.393 -19.568 -5.721 604 HZ3 LYS 72 2HZ LYS 72 -1.571 -20.757 -5.657 605 H ASN 73 H ASN 73 2.850 -22.742 -10.552 606 HA ASN 73 HA ASN 73 1.182 -24.960 -10.875 607 HB2 ASN 73 2HB ASN 73 1.020 -23.010 -12.333 608 HB3 ASN 73 1HB ASN 73 2.639 -23.294 -12.946 609 HD21 ASN 73 1HD2 ASN 73 2.953 -24.852 -14.534 610 HD22 ASN 73 2HD2 ASN 73 1.635 -25.638 -15.331 611 H GLU 74 H GLU 74 4.543 -24.462 -11.684 612 HA GLU 74 HA GLU 74 4.857 -27.203 -12.506 613 HB2 GLU 74 2HB GLU 74 6.941 -25.075 -11.962 614 HB3 GLU 74 1HB GLU 74 7.239 -26.628 -12.729 615 HG2 GLU 74 2HG GLU 74 5.771 -25.968 -14.592 616 HG3 GLU 74 1HG GLU 74 5.531 -24.403 -13.825 617 H LYS 75 H LYS 75 4.052 -28.134 -10.617 618 HA LYS 75 HA LYS 75 5.410 -27.538 -8.110 619 HB2 LYS 75 2HB LYS 75 2.951 -27.367 -8.279 620 HB3 LYS 75 1HB LYS 75 2.873 -29.091 -8.590 621 HG2 LYS 75 2HG LYS 75 3.807 -29.533 -6.369 622 HG3 LYS 75 1HG LYS 75 3.910 -27.798 -6.067 623 HD2 LYS 75 2HD LYS 75 1.381 -29.389 -6.550 624 HD3 LYS 75 1HD LYS 75 1.915 -28.719 -5.009 625 HE2 LYS 75 2HE LYS 75 1.735 -26.427 -5.986 626 HE3 LYS 75 1HE LYS 75 1.150 -27.146 -7.479 627 HZ1 LYS 75 3HZ LYS 75 -0.781 -27.980 -6.284 628 HZ2 LYS 75 1HZ LYS 75 -0.647 -26.316 -6.147 629 HZ3 LYS 75 2HZ LYS 75 -0.229 -27.303 -4.844 630 H VAL 76 H VAL 76 7.200 -28.698 -8.041 631 HA VAL 76 HA VAL 76 6.989 -31.595 -8.437 632 HB VAL 76 HB VAL 76 9.499 -29.892 -8.315 633 HG11 VAL 76 1HG1 VAL 76 10.630 -31.885 -9.189 634 HG12 VAL 76 2HG1 VAL 76 9.113 -32.778 -9.092 635 HG13 VAL 76 3HG1 VAL 76 9.883 -32.184 -7.620 636 HG21 VAL 76 3HG2 VAL 76 8.111 -31.058 -10.733 637 HG22 VAL 76 1HG2 VAL 76 9.678 -30.249 -10.746 638 HG23 VAL 76 2HG2 VAL 76 8.223 -29.347 -10.320 639 H ALA 77 H ALA 77 8.807 -29.256 -6.459 640 HA ALA 77 HA ALA 77 7.980 -30.670 -4.075 641 HB1 ALA 77 1HB ALA 77 10.876 -30.027 -4.657 642 HB2 ALA 77 2HB ALA 77 10.167 -31.643 -4.660 643 HB3 ALA 77 3HB ALA 77 10.237 -30.711 -3.163 644 H ALA 78 H ALA 78 6.749 -29.037 -3.479 645 HA ALA 78 HA ALA 78 8.066 -26.739 -2.358 646 HB1 ALA 78 1HB ALA 78 5.869 -26.367 -4.413 647 HB2 ALA 78 2HB ALA 78 7.563 -25.939 -4.630 648 HB3 ALA 78 3HB ALA 78 6.583 -25.084 -3.434 649 H LYS 79 H LYS 79 4.677 -27.222 -3.244 650 HA LYS 79 HA LYS 79 2.793 -27.288 -2.063 651 HB2 LYS 79 2HB LYS 79 3.359 -29.631 -2.240 652 HB3 LYS 79 1HB LYS 79 4.283 -29.511 -0.741 653 HG2 LYS 79 2HG LYS 79 2.285 -29.093 0.530 654 HG3 LYS 79 1HG LYS 79 1.335 -29.000 -0.943 655 HD2 LYS 79 2HD LYS 79 0.926 -31.117 0.134 656 HD3 LYS 79 1HD LYS 79 1.797 -31.350 -1.375 657 HE2 LYS 79 2HE LYS 79 3.167 -31.306 1.315 658 HE3 LYS 79 1HE LYS 79 2.521 -32.778 0.606 659 HZ1 LYS 79 3HZ LYS 79 4.851 -32.591 0.184 660 HZ2 LYS 79 1HZ LYS 79 4.697 -31.087 -0.556 661 HZ3 LYS 79 2HZ LYS 79 4.023 -32.458 -1.269 662 H MET 80 H MET 80 2.700 -25.302 -1.022 663 HA MET 80 HA MET 80 3.439 -25.442 1.787 664 HB2 MET 80 2HB MET 80 3.986 -23.346 0.427 665 HB3 MET 80 1HB MET 80 2.268 -23.036 0.322 666 HG2 MET 80 2HG MET 80 3.844 -23.149 2.907 667 HG3 MET 80 1HG MET 80 3.450 -21.678 2.041 668 HE1 MET 80 3HE MET 80 1.254 -21.493 5.299 669 HE2 MET 80 1HE MET 80 2.477 -20.679 4.320 670 HE3 MET 80 2HE MET 80 2.872 -22.183 5.152 671 H LEU 81 H LEU 81 0.619 -23.738 0.464 672 HA LEU 81 HA LEU 81 -1.454 -25.396 0.648 673 HB2 LEU 81 2HB LEU 81 -0.715 -25.860 3.036 674 HB3 LEU 81 1HB LEU 81 -1.000 -24.176 3.394 675 HG LEU 81 HG LEU 81 -3.398 -24.477 2.991 676 HD11 LEU 81 1HD1 LEU 81 -2.673 -27.365 2.502 677 HD12 LEU 81 2HD1 LEU 81 -3.293 -26.238 1.295 678 HD13 LEU 81 3HD1 LEU 81 -4.307 -26.727 2.648 679 HD21 LEU 81 3HD2 LEU 81 -2.546 -24.827 5.230 680 HD22 LEU 81 1HD2 LEU 81 -2.199 -26.516 4.853 681 HD23 LEU 81 2HD2 LEU 81 -3.863 -25.954 4.886 682 H GLU 82 H GLU 82 -3.491 -24.121 0.707 683 HA GLU 82 HA GLU 82 -3.055 -21.276 0.910 684 HB2 GLU 82 2HB GLU 82 -4.522 -20.925 -1.090 685 HB3 GLU 82 1HB GLU 82 -2.944 -21.611 -1.436 686 HG2 GLU 82 2HG GLU 82 -4.035 -23.842 -1.565 687 HG3 GLU 82 1HG GLU 82 -5.593 -23.031 -1.382 688 H LYS 83 H LYS 83 -4.407 -20.307 2.140 689 HA LYS 83 HA LYS 83 -6.791 -21.785 3.074 690 HB2 LYS 83 2HB LYS 83 -5.111 -19.717 4.495 691 HB3 LYS 83 1HB LYS 83 -6.484 -20.577 5.168 692 HG2 LYS 83 2HG LYS 83 -5.261 -22.656 5.104 693 HG3 LYS 83 1HG LYS 83 -3.912 -21.871 4.282 694 HD2 LYS 83 2HD LYS 83 -3.598 -20.403 6.226 695 HD3 LYS 83 1HD LYS 83 -4.931 -21.213 7.044 696 HE2 LYS 83 2HE LYS 83 -2.375 -22.541 6.136 697 HE3 LYS 83 1HE LYS 83 -2.706 -22.008 7.780 698 HZ1 LYS 83 3HZ LYS 83 -4.238 -24.102 6.306 699 HZ2 LYS 83 1HZ LYS 83 -4.544 -23.567 7.871 700 HZ3 LYS 83 2HZ LYS 83 -3.111 -24.359 7.530 701 H ASP 84 H ASP 84 -6.173 -19.527 0.947 702 HA ASP 84 HA ASP 84 -7.500 -17.248 2.022 703 HB2 ASP 84 2HB ASP 84 -6.612 -17.792 -0.790 704 HB3 ASP 84 1HB ASP 84 -7.375 -16.291 -0.289 705 H ALA 85 H ALA 85 -9.379 -17.770 2.672 706 HA ALA 85 HA ALA 85 -11.531 -17.286 0.976 707 HB1 ALA 85 1HB ALA 85 -12.746 -19.435 1.141 708 HB2 ALA 85 2HB ALA 85 -11.346 -20.171 1.920 709 HB3 ALA 85 3HB ALA 85 -11.236 -19.632 0.250 710 H THR 86 H THR 86 -11.341 -19.552 3.681 711 HA THR 86 HA THR 86 -12.435 -19.644 5.623 712 HB THR 86 HB THR 86 -11.450 -16.785 5.977 713 HG1 THR 86 1HG THR 86 -9.627 -17.801 5.478 714 HG21 THR 86 3HG2 THR 86 -11.268 -17.433 8.344 715 HG22 THR 86 1HG2 THR 86 -11.832 -19.059 7.949 716 HG23 THR 86 2HG2 THR 86 -12.918 -17.688 7.768 717 H GLU 87 H GLU 87 -14.453 -19.756 4.533 718 HA GLU 87 HA GLU 87 -15.923 -17.316 4.180 719 HB2 GLU 87 2HB GLU 87 -16.771 -20.155 3.638 720 HB3 GLU 87 1HB GLU 87 -17.651 -18.708 3.166 721 HG2 GLU 87 2HG GLU 87 -15.752 -18.024 1.768 722 HG3 GLU 87 1HG GLU 87 -14.915 -19.510 2.202 723 H VAL 88 H VAL 88 -16.703 -16.439 5.864 724 HA VAL 88 HA VAL 88 -18.037 -18.023 7.914 725 HB VAL 88 HB VAL 88 -16.423 -16.291 8.673 726 HG11 VAL 88 1HG1 VAL 88 -16.915 -13.893 8.421 727 HG12 VAL 88 2HG1 VAL 88 -18.253 -14.300 7.347 728 HG13 VAL 88 3HG1 VAL 88 -16.597 -14.696 6.883 729 HG21 VAL 88 3HG2 VAL 88 -19.281 -15.625 9.388 730 HG22 VAL 88 1HG2 VAL 88 -17.861 -15.113 10.299 731 HG23 VAL 88 2HG2 VAL 88 -18.251 -16.823 10.175 732 H GLY 89 H GLY 89 -20.267 -17.638 8.348 733 HA2 GLY 89 2HA GLY 89 -21.684 -15.766 6.667 734 HA3 GLY 89 1HA GLY 89 -21.966 -17.459 6.305 735 H VAL 90 H VAL 90 -22.737 -14.863 8.338 736 HA VAL 90 HA VAL 90 -23.880 -16.484 10.399 737 HB VAL 90 HB VAL 90 -23.111 -14.229 10.995 738 HG11 VAL 90 1HG1 VAL 90 -25.273 -13.162 9.197 739 HG12 VAL 90 2HG1 VAL 90 -23.536 -13.029 8.939 740 HG13 VAL 90 3HG1 VAL 90 -24.293 -12.198 10.300 741 HG21 VAL 90 3HG2 VAL 90 -25.075 -13.433 12.251 742 HG22 VAL 90 1HG2 VAL 90 -24.868 -15.182 12.366 743 HG23 VAL 90 2HG2 VAL 90 -26.100 -14.508 11.300 744 H LYS 91 H LYS 91 -25.494 -17.746 10.045 745 HA LYS 91 HA LYS 91 -27.874 -16.744 8.738 746 HB2 LYS 91 2HB LYS 91 -26.410 -17.571 6.965 747 HB3 LYS 91 1HB LYS 91 -26.357 -19.139 7.753 748 HG2 LYS 91 2HG LYS 91 -28.747 -19.394 7.402 749 HG3 LYS 91 1HG LYS 91 -28.805 -17.799 6.644 750 HD2 LYS 91 2HD LYS 91 -27.179 -18.536 5.023 751 HD3 LYS 91 1HD LYS 91 -27.222 -20.166 5.703 752 HE2 LYS 91 2HE LYS 91 -28.654 -20.091 3.755 753 HE3 LYS 91 1HE LYS 91 -29.661 -20.240 5.196 754 HZ1 LYS 91 3HZ LYS 91 -30.531 -18.617 3.639 755 HZ2 LYS 91 1HZ LYS 91 -29.099 -17.742 3.710 756 HZ3 LYS 91 2HZ LYS 91 -30.095 -17.848 5.074 757 H ALA 92 H ALA 92 -29.059 -17.111 10.573 758 HA ALA 92 HA ALA 92 -29.186 -19.901 11.404 759 HB1 ALA 92 1HB ALA 92 -29.631 -17.479 13.155 760 HB2 ALA 92 2HB ALA 92 -28.207 -18.518 13.191 761 HB3 ALA 92 3HB ALA 92 -29.783 -19.159 13.664 762 H ALA 93 H ALA 93 -30.798 -20.393 9.995 763 HA ALA 93 HA ALA 93 -33.231 -18.845 10.067 764 HB1 ALA 93 1HB ALA 93 -32.426 -19.726 7.919 765 HB2 ALA 93 2HB ALA 93 -34.022 -20.353 8.331 766 HB3 ALA 93 3HB ALA 93 -32.595 -21.368 8.541 767 H LEU 94 H LEU 94 -34.412 -19.136 11.790 768 HA LEU 94 HA LEU 94 -35.052 -21.860 12.443 769 HB2 LEU 94 2HB LEU 94 -35.186 -21.263 14.879 770 HB3 LEU 94 1HB LEU 94 -33.574 -21.306 14.218 771 HG LEU 94 HG LEU 94 -33.720 -18.748 14.132 772 HD11 LEU 94 1HD1 LEU 94 -36.101 -18.482 14.363 773 HD12 LEU 94 2HD1 LEU 94 -35.257 -17.674 15.690 774 HD13 LEU 94 3HD1 LEU 94 -36.057 -19.224 15.963 775 HD21 LEU 94 3HD2 LEU 94 -33.765 -20.148 16.796 776 HD22 LEU 94 1HD2 LEU 94 -33.137 -18.525 16.500 777 HD23 LEU 94 2HD2 LEU 94 -32.366 -19.923 15.749 778 H GLU 95 H GLU 95 -37.085 -22.350 12.471 779 HA GLU 95 HA GLU 95 -39.021 -20.165 12.528 780 HB2 GLU 95 2HB GLU 95 -38.907 -22.401 10.500 781 HB3 GLU 95 1HB GLU 95 -40.172 -21.192 10.621 782 HG2 GLU 95 2HG GLU 95 -38.601 -19.450 10.018 783 HG3 GLU 95 1HG GLU 95 -37.286 -20.621 10.001 784 H GLU 96 H GLU 96 -40.697 -20.696 13.810 785 HA GLU 96 HA GLU 96 -41.380 -23.496 14.070 786 HB2 GLU 96 2HB GLU 96 -39.928 -22.983 16.012 787 HB3 GLU 96 1HB GLU 96 -41.026 -21.690 16.475 788 HG2 GLU 96 2HG GLU 96 -42.822 -23.394 16.707 789 HG3 GLU 96 1HG GLU 96 -41.613 -24.633 16.400 790 H ALA 97 H ALA 97 -43.057 -22.941 12.742 791 HA ALA 97 HA ALA 97 -45.026 -21.096 13.843 792 HB1 ALA 97 1HB ALA 97 -44.799 -22.241 11.062 793 HB2 ALA 97 2HB ALA 97 -44.276 -20.634 11.558 794 HB3 ALA 97 3HB ALA 97 -45.990 -21.054 11.598 795 H LYS 98 H LYS 98 -46.505 -22.054 15.020 796 HA LYS 98 HA LYS 98 -47.175 -24.837 14.628 797 HB2 LYS 98 2HB LYS 98 -48.400 -22.786 16.483 798 HB3 LYS 98 1HB LYS 98 -48.754 -24.503 16.498 799 HG2 LYS 98 2HG LYS 98 -46.420 -24.955 17.139 800 HG3 LYS 98 1HG LYS 98 -46.111 -23.215 17.151 801 HD2 LYS 98 2HD LYS 98 -47.837 -22.922 18.869 802 HD3 LYS 98 1HD LYS 98 -48.141 -24.656 18.843 803 HE2 LYS 98 2HE LYS 98 -45.813 -25.043 19.592 804 HE3 LYS 98 1HE LYS 98 -45.570 -23.302 19.644 805 HZ1 LYS 98 3HZ LYS 98 -47.274 -23.120 21.320 806 HZ2 LYS 98 1HZ LYS 98 -46.099 -24.200 21.841 807 HZ3 LYS 98 2HZ LYS 98 -47.581 -24.768 21.277 808 H LYS 99 H LYS 99 -48.116 -24.926 12.609 809 HA LYS 99 HA LYS 99 -50.591 -23.408 12.393 810 HB2 LYS 99 2HB LYS 99 -48.820 -24.333 10.129 811 HB3 LYS 99 1HB LYS 99 -50.341 -23.478 9.949 812 HG2 LYS 99 2HG LYS 99 -49.345 -21.569 11.219 813 HG3 LYS 99 1HG LYS 99 -47.811 -22.426 11.204 814 HD2 LYS 99 2HD LYS 99 -47.671 -20.887 9.418 815 HD3 LYS 99 1HD LYS 99 -48.024 -22.430 8.658 816 HE2 LYS 99 2HE LYS 99 -50.056 -20.277 9.269 817 HE3 LYS 99 1HE LYS 99 -49.321 -20.539 7.692 818 HZ1 LYS 99 3HZ LYS 99 -51.234 -22.334 9.130 819 HZ2 LYS 99 1HZ LYS 99 -50.422 -22.778 7.713 820 HZ3 LYS 99 2HZ LYS 99 -51.465 -21.487 7.717 821 H VAL 100 H VAL 100 -52.021 -24.766 13.097 822 HA VAL 100 HA VAL 100 -52.689 -26.987 11.520 823 HB VAL 100 HB VAL 100 -50.987 -28.137 12.823 824 HG11 VAL 100 1HG1 VAL 100 -51.095 -28.377 15.259 825 HG12 VAL 100 2HG1 VAL 100 -52.442 -27.240 15.305 826 HG13 VAL 100 3HG1 VAL 100 -50.852 -26.701 14.764 827 HG21 VAL 100 3HG2 VAL 100 -52.970 -29.428 12.276 828 HG22 VAL 100 1HG2 VAL 100 -53.748 -28.904 13.770 829 HG23 VAL 100 2HG2 VAL 100 -52.320 -29.939 13.832 830 H GLN 101 H GLN 101 -54.764 -26.836 11.351 831 HA GLN 101 HA GLN 101 -56.553 -26.844 13.508 832 HB2 GLN 101 2HB GLN 101 -55.926 -24.469 13.704 833 HB3 GLN 101 1HB GLN 101 -56.335 -24.210 12.018 834 HG2 GLN 101 2HG GLN 101 -58.676 -24.781 12.514 835 HG3 GLN 101 1HG GLN 101 -58.253 -25.013 14.201 836 HE21 GLN 101 1HE2 GLN 101 -56.932 -22.464 12.190 837 HE22 GLN 101 2HE2 GLN 101 -57.701 -21.166 12.998 838 H ILE 102 H ILE 102 -57.798 -28.316 12.560 839 HA ILE 102 HA ILE 102 -58.849 -27.600 9.948 840 HB ILE 102 HB ILE 102 -57.516 -29.609 9.695 841 HG12 ILE 102 2HG1 ILE 102 -60.466 -30.281 9.679 842 HG13 ILE 102 1HG1 ILE 102 -59.582 -29.454 8.404 843 HG21 ILE 102 1HG2 ILE 102 -59.191 -30.827 11.881 844 HG22 ILE 102 2HG2 ILE 102 -57.480 -30.403 11.982 845 HG23 ILE 102 3HG2 ILE 102 -58.010 -31.688 10.894 846 HD11 ILE 102 3HD1 ILE 102 -59.117 -32.274 9.328 847 HD12 ILE 102 1HD1 ILE 102 -58.246 -31.451 8.038 848 HD13 ILE 102 2HD1 ILE 102 -59.972 -31.780 7.864 849 H GLU 103 H GLU 103 -60.929 -27.306 9.811 850 HA GLU 103 HA GLU 103 -62.506 -27.905 12.189 851 HB2 GLU 103 2HB GLU 103 -62.295 -25.535 11.666 852 HB3 GLU 103 1HB GLU 103 -62.917 -25.816 10.053 853 HG2 GLU 103 2HG GLU 103 -65.069 -26.455 10.978 854 HG3 GLU 103 1HG GLU 103 -64.439 -26.232 12.612 855 H LEU 104 H LEU 104 -63.405 -29.812 11.867 856 HA LEU 104 HA LEU 104 -64.803 -30.280 9.352 857 HB2 LEU 104 2HB LEU 104 -62.916 -31.821 9.822 858 HB3 LEU 104 1HB LEU 104 -63.640 -32.244 11.348 859 HG LEU 104 HG LEU 104 -64.952 -32.883 8.688 860 HD11 LEU 104 1HD1 LEU 104 -62.760 -33.926 8.795 861 HD12 LEU 104 2HD1 LEU 104 -64.036 -35.131 8.999 862 HD13 LEU 104 3HD1 LEU 104 -63.125 -34.564 10.396 863 HD21 LEU 104 3HD2 LEU 104 -66.141 -34.558 10.003 864 HD22 LEU 104 1HD2 LEU 104 -66.418 -32.945 10.662 865 HD23 LEU 104 2HD2 LEU 104 -65.285 -34.040 11.457 866 H ASP 105 H ASP 105 -66.879 -30.017 9.528 867 HA ASP 105 HA ASP 105 -68.099 -29.868 12.140 868 HB2 ASP 105 2HB ASP 105 -69.310 -29.422 9.399 869 HB3 ASP 105 1HB ASP 105 -70.143 -29.163 10.924 870 H THR 106 H THR 106 -68.395 -31.900 9.249 871 HA THR 106 HA THR 106 -69.177 -34.045 10.930 872 HB THR 106 HB THR 106 -71.365 -33.071 10.653 873 HG1 THR 106 1HG THR 106 -72.330 -34.881 10.117 874 HG21 THR 106 3HG2 THR 106 -70.986 -31.750 8.623 875 HG22 THR 106 1HG2 THR 106 -72.416 -32.766 8.432 876 HG23 THR 106 2HG2 THR 106 -70.897 -33.224 7.665 877 H SER 107 H SER 107 -68.640 -35.964 10.080 878 HA SER 107 HA SER 107 -67.280 -35.989 7.529 879 HB2 SER 107 2HB SER 107 -67.583 -38.107 9.676 880 HB3 SER 107 1HB SER 107 -66.602 -38.287 8.221 881 HG SER 107 HG SER 107 -65.368 -36.552 8.880 882 H LEU 108 H LEU 108 -70.328 -36.487 8.717 883 HA LEU 108 HA LEU 108 -72.253 -37.154 7.924 884 HB2 LEU 108 2HB LEU 108 -70.824 -37.685 5.312 885 HB3 LEU 108 1HB LEU 108 -72.529 -37.982 5.549 886 HG LEU 108 HG LEU 108 -72.810 -35.573 6.058 887 HD11 LEU 108 1HD1 LEU 108 -70.007 -35.330 4.978 888 HD12 LEU 108 2HD1 LEU 108 -70.505 -35.016 6.630 889 HD13 LEU 108 3HD1 LEU 108 -71.102 -33.986 5.320 890 HD21 LEU 108 3HD2 LEU 108 -71.750 -36.295 3.343 891 HD22 LEU 108 1HD2 LEU 108 -72.740 -34.884 3.714 892 HD23 LEU 108 2HD2 LEU 108 -73.402 -36.507 3.920 893 H SER 109 H SER 109 -73.573 -38.849 7.783 894 HA SER 109 HA SER 109 -72.472 -41.497 7.603 895 HB2 SER 109 2HB SER 109 -73.964 -40.521 10.065 896 HB3 SER 109 1HB SER 109 -73.557 -42.206 9.731 897 HG SER 109 HG SER 109 -71.344 -41.291 9.509 898 H TYR 110 H TYR 110 -73.645 -41.777 5.780 899 HA TYR 110 HA TYR 110 -76.529 -42.020 6.149 900 HB2 TYR 110 2HB TYR 110 -76.062 -39.990 4.782 901 HB3 TYR 110 1HB TYR 110 -75.116 -40.967 3.671 902 HD1 TYR 110 1HD TYR 110 -78.516 -40.123 4.802 903 HD2 TYR 110 2HD TYR 110 -76.218 -42.393 2.028 904 HE1 TYR 110 1HE TYR 110 -80.529 -40.520 3.464 905 HE2 TYR 110 2HE TYR 110 -78.231 -42.795 0.684 906 HH TYR 110 HH TYR 110 -80.610 -42.834 0.980 907 H ILE 111 H ILE 111 -76.445 -44.180 6.441 908 HA ILE 111 HA ILE 111 -76.240 -45.810 4.210 909 HB ILE 111 HB ILE 111 -73.852 -45.686 4.409 910 HG12 ILE 111 2HG1 ILE 111 -73.181 -48.040 4.914 911 HG13 ILE 111 1HG1 ILE 111 -74.783 -48.309 5.593 912 HG21 ILE 111 1HG2 ILE 111 -72.572 -46.254 6.410 913 HG22 ILE 111 2HG2 ILE 111 -74.085 -46.343 7.314 914 HG23 ILE 111 3HG2 ILE 111 -73.577 -44.816 6.594 915 HD11 ILE 111 3HD1 ILE 111 -74.603 -49.180 3.334 916 HD12 ILE 111 1HD1 ILE 111 -74.178 -47.576 2.736 917 HD13 ILE 111 2HD1 ILE 111 -75.780 -47.869 3.415 Start of MODEL 3 1 H1 GLY -1 1HT GLY -1 -5.645 -4.164 -30.921 2 H2 GLY -1 2HT GLY -1 -6.532 -2.897 -31.603 3 H3 GLY -1 3HT GLY -1 -6.753 -3.331 -29.967 4 HA2 GLY -1 1HA GLY -1 -4.282 -2.211 -31.100 5 HA3 GLY -1 2HA GLY -1 -5.462 -1.338 -30.130 6 H SER 0 H SER 0 -4.093 -0.931 -28.411 7 HA SER 0 HA SER 0 -2.777 -3.150 -27.159 8 HB2 SER 0 2HB SER 0 -2.869 -0.206 -26.489 9 HB3 SER 0 1HB SER 0 -1.908 -1.398 -25.609 10 HG SER 0 HG SER 0 -0.558 -1.525 -27.168 11 H MET 1 H MET 1 -3.357 -4.063 -25.263 12 HA MET 1 HA MET 1 -6.118 -3.924 -24.582 13 HB2 MET 1 2HB MET 1 -3.857 -5.316 -23.136 14 HB3 MET 1 1HB MET 1 -5.573 -5.592 -22.879 15 HG2 MET 1 2HG MET 1 -5.766 -6.440 -25.170 16 HG3 MET 1 1HG MET 1 -4.042 -6.166 -25.401 17 HE1 MET 1 3HE MET 1 -3.646 -8.643 -26.165 18 HE2 MET 1 1HE MET 1 -5.378 -8.929 -26.009 19 HE3 MET 1 2HE MET 1 -4.232 -10.052 -25.278 20 H THR 2 H THR 2 -6.938 -2.369 -23.423 21 HA THR 2 HA THR 2 -5.280 -0.996 -21.469 22 HB THR 2 HB THR 2 -7.989 -0.239 -22.595 23 HG1 THR 2 1HG THR 2 -5.907 -0.378 -23.960 24 HG21 THR 2 3HG2 THR 2 -7.431 0.805 -20.433 25 HG22 THR 2 1HG2 THR 2 -7.410 1.996 -21.738 26 HG23 THR 2 2HG2 THR 2 -5.895 1.357 -21.099 27 H VAL 3 H VAL 3 -5.532 -1.607 -19.436 28 HA VAL 3 HA VAL 3 -8.056 -2.917 -18.647 29 HB VAL 3 HB VAL 3 -5.358 -3.342 -17.371 30 HG11 VAL 3 1HG1 VAL 3 -7.169 -3.842 -15.935 31 HG12 VAL 3 2HG1 VAL 3 -6.380 -5.335 -16.515 32 HG13 VAL 3 3HG1 VAL 3 -7.914 -4.834 -17.203 33 HG21 VAL 3 3HG2 VAL 3 -6.670 -5.136 -19.400 34 HG22 VAL 3 1HG2 VAL 3 -5.315 -5.527 -18.347 35 HG23 VAL 3 2HG2 VAL 3 -5.119 -4.265 -19.585 36 H TYR 4 H TYR 4 -9.074 -2.064 -16.859 37 HA TYR 4 HA TYR 4 -7.718 0.136 -15.495 38 HB2 TYR 4 2HB TYR 4 -10.667 -0.530 -15.655 39 HB3 TYR 4 1HB TYR 4 -9.960 0.871 -14.852 40 HD1 TYR 4 2HD TYR 4 -10.689 -0.666 -18.116 41 HD2 TYR 4 1HD TYR 4 -9.171 2.772 -16.134 42 HE1 TYR 4 2HE TYR 4 -10.793 0.583 -20.214 43 HE2 TYR 4 1HE TYR 4 -9.277 4.035 -18.231 44 HH TYR 4 HH TYR 4 -10.953 2.885 -20.938 45 H ILE 5 H ILE 5 -7.386 0.073 -13.352 46 HA ILE 5 HA ILE 5 -8.170 -2.387 -11.865 47 HB ILE 5 HB ILE 5 -5.825 -0.563 -11.287 48 HG12 ILE 5 2HG1 ILE 5 -4.321 -2.231 -11.825 49 HG13 ILE 5 1HG1 ILE 5 -5.455 -3.439 -12.288 50 HG21 ILE 5 1HG2 ILE 5 -6.697 -1.594 -9.305 51 HG22 ILE 5 2HG2 ILE 5 -5.115 -2.285 -9.679 52 HG23 ILE 5 3HG2 ILE 5 -6.584 -3.184 -10.048 53 HD11 ILE 5 3HD1 ILE 5 -4.683 -0.892 -13.764 54 HD12 ILE 5 1HD1 ILE 5 -6.052 -1.888 -14.248 55 HD13 ILE 5 2HD1 ILE 5 -4.425 -2.558 -14.279 56 H CYS 6 H CYS 6 -9.725 -1.841 -10.375 57 HA CYS 6 HA CYS 6 -9.206 0.577 -8.844 58 HB2 CYS 6 2HB CYS 6 -11.182 1.032 -10.258 59 HB3 CYS 6 1HB CYS 6 -11.954 -0.411 -9.621 60 HG CYS 6 HG CYS 6 -12.771 2.274 -8.688 61 HA PRO 7 HA PRO 7 -8.898 -2.934 -5.964 62 HB2 PRO 7 2HB PRO 7 -7.866 -0.701 -4.283 63 HB3 PRO 7 1HB PRO 7 -7.167 -2.295 -4.578 64 HG2 PRO 7 2HG PRO 7 -6.115 -0.142 -5.729 65 HG3 PRO 7 1HG PRO 7 -6.249 -1.668 -6.618 66 HD2 PRO 7 2HD PRO 7 -7.933 0.794 -6.816 67 HD3 PRO 7 1HD PRO 7 -7.341 -0.290 -8.097 68 H GLU 8 H GLU 8 -10.424 0.117 -5.745 69 HA GLU 8 HA GLU 8 -11.625 -0.053 -3.178 70 HB2 GLU 8 2HB GLU 8 -12.547 1.489 -5.590 71 HB3 GLU 8 1HB GLU 8 -13.021 1.760 -3.922 72 HG2 GLU 8 2HG GLU 8 -10.282 2.003 -5.022 73 HG3 GLU 8 1HG GLU 8 -11.394 3.360 -4.783 74 H THR 9 H THR 9 -13.310 -0.028 -6.305 75 HA THR 9 HA THR 9 -15.387 -1.639 -5.047 76 HB THR 9 HB THR 9 -16.898 -0.583 -6.744 77 HG1 THR 9 1HG THR 9 -15.097 1.483 -7.130 78 HG21 THR 9 3HG2 THR 9 -15.374 1.292 -4.925 79 HG22 THR 9 1HG2 THR 9 -16.720 0.269 -4.434 80 HG23 THR 9 2HG2 THR 9 -16.986 1.588 -5.580 81 H GLY 10 H GLY 10 -12.922 -1.950 -7.303 82 HA2 GLY 10 2HA GLY 10 -14.528 -3.644 -9.000 83 HA3 GLY 10 1HA GLY 10 -12.860 -3.316 -9.344 84 H ASP 11 H ASP 11 -12.512 -5.549 -9.612 85 HA ASP 11 HA ASP 11 -11.754 -7.051 -7.350 86 HB2 ASP 11 2HB ASP 11 -14.267 -7.263 -7.168 87 HB3 ASP 11 1HB ASP 11 -14.254 -8.058 -8.742 88 H ASP 12 H ASP 12 -10.562 -8.792 -8.023 89 HA ASP 12 HA ASP 12 -9.648 -8.689 -10.706 90 HB2 ASP 12 2HB ASP 12 -8.987 -10.720 -8.584 91 HB3 ASP 12 1HB ASP 12 -8.269 -10.721 -10.188 92 H GLY 13 H GLY 13 -12.340 -10.288 -9.532 93 HA2 GLY 13 2HA GLY 13 -12.248 -12.382 -11.543 94 HA3 GLY 13 1HA GLY 13 -13.557 -12.073 -10.408 95 H ASN 14 H ASN 14 -12.596 -9.253 -11.874 96 HA ASN 14 HA ASN 14 -14.968 -9.199 -13.543 97 HB2 ASN 14 2HB ASN 14 -13.014 -7.125 -12.673 98 HB3 ASN 14 1HB ASN 14 -14.260 -6.786 -13.864 99 HD21 ASN 14 1HD2 ASN 14 -13.879 -5.620 -11.262 100 HD22 ASN 14 2HD2 ASN 14 -15.297 -5.984 -10.343 101 H ASP 15 H ASP 15 -14.629 -7.705 -15.570 102 HA ASP 15 HA ASP 15 -12.908 -9.198 -17.371 103 HB2 ASP 15 2HB ASP 15 -14.965 -7.045 -17.875 104 HB3 ASP 15 1HB ASP 15 -14.039 -7.829 -19.144 105 H GLY 16 H GLY 16 -12.358 -6.620 -15.433 106 HA2 GLY 16 2HA GLY 16 -10.872 -4.969 -15.393 107 HA3 GLY 16 1HA GLY 16 -10.073 -5.781 -16.727 108 H SER 17 H SER 17 -13.280 -4.524 -16.795 109 HA SER 17 HA SER 17 -12.593 -2.701 -18.962 110 HB2 SER 17 2HB SER 17 -15.266 -3.264 -17.642 111 HB3 SER 17 1HB SER 17 -14.998 -2.484 -19.202 112 HG SER 17 HG SER 17 -13.774 -4.692 -19.476 113 H GLU 18 H GLU 18 -13.796 -0.373 -18.634 114 HA GLU 18 HA GLU 18 -12.787 0.715 -16.279 115 HB2 GLU 18 2HB GLU 18 -13.106 2.016 -18.371 116 HB3 GLU 18 1HB GLU 18 -14.849 1.887 -18.181 117 HG2 GLU 18 2HG GLU 18 -14.661 3.112 -16.041 118 HG3 GLU 18 1HG GLU 18 -12.926 3.222 -16.370 119 H LEU 19 H LEU 19 -15.933 -0.535 -17.257 120 HA LEU 19 HA LEU 19 -17.329 0.300 -14.922 121 HB2 LEU 19 2HB LEU 19 -18.038 -1.641 -17.106 122 HB3 LEU 19 1HB LEU 19 -19.096 -1.257 -15.771 123 HG LEU 19 HG LEU 19 -19.807 -0.094 -17.649 124 HD11 LEU 19 1HD1 LEU 19 -20.036 1.122 -15.597 125 HD12 LEU 19 2HD1 LEU 19 -19.736 2.246 -16.921 126 HD13 LEU 19 3HD1 LEU 19 -18.437 1.839 -15.803 127 HD21 LEU 19 3HD2 LEU 19 -17.818 -0.060 -19.031 128 HD22 LEU 19 1HD2 LEU 19 -17.048 1.088 -17.938 129 HD23 LEU 19 2HD2 LEU 19 -18.456 1.580 -18.879 130 H LYS 20 H LYS 20 -15.371 -2.409 -15.766 131 HA LYS 20 HA LYS 20 -15.908 -3.643 -13.108 132 HB2 LYS 20 2HB LYS 20 -15.286 -5.312 -15.535 133 HB3 LYS 20 1HB LYS 20 -15.770 -5.781 -13.932 134 HG2 LYS 20 2HG LYS 20 -18.026 -5.051 -14.254 135 HG3 LYS 20 1HG LYS 20 -17.633 -4.462 -15.878 136 HD2 LYS 20 2HD LYS 20 -16.952 -6.720 -16.530 137 HD3 LYS 20 1HD LYS 20 -17.377 -7.310 -14.926 138 HE2 LYS 20 2HE LYS 20 -19.695 -6.732 -15.317 139 HE3 LYS 20 1HE LYS 20 -19.282 -6.062 -16.896 140 HZ1 LYS 20 3HZ LYS 20 -18.449 -8.317 -17.497 141 HZ2 LYS 20 1HZ LYS 20 -20.113 -8.264 -17.196 142 HZ3 LYS 20 2HZ LYS 20 -19.063 -8.888 -16.046 143 HA PRO 21 HA PRO 21 -11.483 -2.996 -13.909 144 HB2 PRO 21 2HB PRO 21 -10.938 -1.594 -11.678 145 HB3 PRO 21 1HB PRO 21 -11.609 -0.822 -13.118 146 HG2 PRO 21 2HG PRO 21 -13.019 -1.703 -10.629 147 HG3 PRO 21 1HG PRO 21 -13.211 -0.193 -11.543 148 HD2 PRO 21 2HD PRO 21 -14.874 -2.332 -11.724 149 HD3 PRO 21 1HD PRO 21 -14.610 -1.176 -13.045 150 H LEU 22 H LEU 22 -9.746 -4.193 -12.859 151 HA LEU 22 HA LEU 22 -10.674 -6.234 -11.107 152 HB2 LEU 22 2HB LEU 22 -7.853 -5.582 -11.907 153 HB3 LEU 22 1HB LEU 22 -8.414 -7.077 -11.204 154 HG LEU 22 HG LEU 22 -8.142 -7.627 -13.381 155 HD11 LEU 22 1HD1 LEU 22 -10.990 -6.882 -13.264 156 HD12 LEU 22 2HD1 LEU 22 -10.238 -8.395 -12.747 157 HD13 LEU 22 3HD1 LEU 22 -10.244 -7.946 -14.453 158 HD21 LEU 22 3HD2 LEU 22 -8.724 -6.293 -15.282 159 HD22 LEU 22 1HD2 LEU 22 -7.580 -5.482 -14.219 160 HD23 LEU 22 2HD2 LEU 22 -9.275 -5.000 -14.225 161 H ARG 23 H ARG 23 -8.850 -6.680 -9.264 162 HA ARG 23 HA ARG 23 -8.919 -4.170 -7.900 163 HB2 ARG 23 2HB ARG 23 -9.266 -5.272 -5.735 164 HB3 ARG 23 1HB ARG 23 -10.520 -5.561 -6.874 165 HG2 ARG 23 2HG ARG 23 -10.212 -7.421 -5.562 166 HG3 ARG 23 1HG ARG 23 -9.611 -7.833 -7.166 167 HD2 ARG 23 2HD ARG 23 -7.455 -8.006 -6.471 168 HD3 ARG 23 1HD ARG 23 -7.648 -6.851 -5.144 169 HE ARG 23 HE ARG 23 -9.001 -8.678 -4.083 170 HH11 ARG 23 1HH1 ARG 23 -6.541 -9.660 -6.414 171 HH12 ARG 23 2HH1 ARG 23 -5.989 -10.989 -5.487 172 HH21 ARG 23 1HH2 ARG 23 -8.269 -10.570 -2.842 173 HH22 ARG 23 2HH2 ARG 23 -7.006 -11.527 -3.454 174 H THR 24 H THR 24 -6.819 -6.232 -9.290 175 HA THR 24 HA THR 24 -4.629 -4.914 -7.889 176 HB THR 24 HB THR 24 -3.228 -6.952 -8.214 177 HG1 THR 24 1HG THR 24 -5.680 -8.300 -8.691 178 HG21 THR 24 3HG2 THR 24 -4.113 -8.268 -6.311 179 HG22 THR 24 1HG2 THR 24 -5.620 -7.347 -6.405 180 HG23 THR 24 2HG2 THR 24 -4.116 -6.536 -5.993 181 H LEU 25 H LEU 25 -2.714 -4.792 -9.232 182 HA LEU 25 HA LEU 25 -3.330 -4.323 -12.000 183 HB2 LEU 25 2HB LEU 25 -1.839 -2.851 -10.737 184 HB3 LEU 25 1HB LEU 25 -0.760 -4.185 -10.423 185 HG LEU 25 HG LEU 25 -0.129 -4.288 -12.770 186 HD11 LEU 25 1HD1 LEU 25 -2.259 -3.581 -13.761 187 HD12 LEU 25 2HD1 LEU 25 -0.908 -2.631 -14.360 188 HD13 LEU 25 3HD1 LEU 25 -2.000 -1.943 -13.159 189 HD21 LEU 25 3HD2 LEU 25 1.004 -2.112 -12.887 190 HD22 LEU 25 1HD2 LEU 25 1.092 -2.843 -11.288 191 HD23 LEU 25 2HD2 LEU 25 -0.046 -1.531 -11.595 192 H TYR 26 H TYR 26 -2.145 -6.784 -10.050 193 HA TYR 26 HA TYR 26 -0.697 -8.367 -11.869 194 HB2 TYR 26 2HB TYR 26 -0.502 -8.723 -9.478 195 HB3 TYR 26 1HB TYR 26 -2.221 -9.044 -9.346 196 HD1 TYR 26 1HD TYR 26 -0.234 -10.488 -12.073 197 HD2 TYR 26 2HD TYR 26 -1.819 -11.157 -8.177 198 HE1 TYR 26 1HE TYR 26 0.153 -12.900 -12.304 199 HE2 TYR 26 2HE TYR 26 -1.446 -13.486 -8.419 200 HH TYR 26 HH TYR 26 -1.236 -15.118 -10.169 201 H GLN 27 H GLN 27 -4.195 -8.455 -11.105 202 HA GLN 27 HA GLN 27 -4.624 -10.578 -12.911 203 HB2 GLN 27 2HB GLN 27 -6.297 -10.048 -11.228 204 HB3 GLN 27 1HB GLN 27 -6.585 -8.482 -11.970 205 HG2 GLN 27 2HG GLN 27 -8.358 -10.106 -12.513 206 HG3 GLN 27 1HG GLN 27 -7.507 -9.536 -13.943 207 HE21 GLN 27 1HE2 GLN 27 -8.170 -11.324 -15.100 208 HE22 GLN 27 2HE2 GLN 27 -7.491 -12.877 -14.933 209 H ALA 28 H ALA 28 -4.478 -7.092 -13.410 210 HA ALA 28 HA ALA 28 -5.427 -6.937 -15.955 211 HB1 ALA 28 1HB ALA 28 -4.869 -5.071 -14.438 212 HB2 ALA 28 2HB ALA 28 -4.152 -4.846 -16.036 213 HB3 ALA 28 3HB ALA 28 -3.168 -5.395 -14.672 214 H MET 29 H MET 29 -2.148 -7.846 -14.789 215 HA MET 29 HA MET 29 -1.196 -8.189 -17.401 216 HB2 MET 29 2HB MET 29 -0.122 -8.925 -14.724 217 HB3 MET 29 1HB MET 29 0.612 -9.545 -16.191 218 HG2 MET 29 2HG MET 29 0.913 -7.152 -16.946 219 HG3 MET 29 1HG MET 29 0.362 -6.641 -15.362 220 HE1 MET 29 3HE MET 29 4.174 -5.987 -15.451 221 HE2 MET 29 1HE MET 29 2.572 -5.269 -15.296 222 HE3 MET 29 2HE MET 29 3.089 -5.924 -16.849 223 H ILE 30 H ILE 30 -2.827 -10.314 -15.182 224 HA ILE 30 HA ILE 30 -2.237 -12.717 -16.609 225 HB ILE 30 HB ILE 30 -4.613 -12.117 -14.811 226 HG12 ILE 30 2HG1 ILE 30 -1.984 -13.482 -14.222 227 HG13 ILE 30 1HG1 ILE 30 -2.463 -11.883 -13.660 228 HG21 ILE 30 1HG2 ILE 30 -4.837 -14.562 -14.599 229 HG22 ILE 30 2HG2 ILE 30 -3.540 -14.777 -15.772 230 HG23 ILE 30 3HG2 ILE 30 -5.061 -14.034 -16.268 231 HD11 ILE 30 3HD1 ILE 30 -4.260 -12.906 -12.346 232 HD12 ILE 30 1HD1 ILE 30 -2.670 -13.541 -11.907 233 HD13 ILE 30 2HD1 ILE 30 -3.750 -14.496 -12.922 234 H ILE 31 H ILE 31 -4.752 -10.310 -16.925 235 HA ILE 31 HA ILE 31 -6.276 -11.758 -18.806 236 HB ILE 31 HB ILE 31 -6.213 -8.768 -18.290 237 HG12 ILE 31 2HG1 ILE 31 -8.000 -10.948 -17.206 238 HG13 ILE 31 1HG1 ILE 31 -6.766 -10.082 -16.302 239 HG21 ILE 31 1HG2 ILE 31 -7.199 -9.424 -20.448 240 HG22 ILE 31 2HG2 ILE 31 -8.424 -8.797 -19.313 241 HG23 ILE 31 3HG2 ILE 31 -8.247 -10.543 -19.544 242 HD11 ILE 31 3HD1 ILE 31 -8.002 -8.012 -16.602 243 HD12 ILE 31 1HD1 ILE 31 -8.988 -9.257 -15.814 244 HD13 ILE 31 2HD1 ILE 31 -9.217 -8.891 -17.531 245 H THR 32 H THR 32 -3.557 -9.512 -19.047 246 HA THR 32 HA THR 32 -3.885 -9.258 -21.886 247 HB THR 32 HB THR 32 -1.895 -7.739 -21.681 248 HG1 THR 32 1HG THR 32 -2.211 -7.674 -18.945 249 HG21 THR 32 3HG2 THR 32 -4.163 -7.114 -19.740 250 HG22 THR 32 1HG2 THR 32 -4.209 -6.852 -21.483 251 HG23 THR 32 2HG2 THR 32 -3.080 -5.955 -20.473 252 H LYS 33 H LYS 33 -1.624 -10.718 -19.577 253 HA LYS 33 HA LYS 33 -0.005 -12.252 -19.685 254 HB2 LYS 33 2HB LYS 33 -1.225 -12.989 -22.347 255 HB3 LYS 33 1HB LYS 33 -0.003 -13.939 -21.520 256 HG2 LYS 33 2HG LYS 33 -1.599 -14.243 -19.637 257 HG3 LYS 33 1HG LYS 33 -2.817 -13.394 -20.590 258 HD2 LYS 33 2HD LYS 33 -1.415 -15.954 -21.390 259 HD3 LYS 33 1HD LYS 33 -3.055 -15.841 -20.763 260 HE2 LYS 33 2HE LYS 33 -2.073 -14.597 -23.345 261 HE3 LYS 33 1HE LYS 33 -2.986 -16.088 -23.208 262 HZ1 LYS 33 3HZ LYS 33 -4.824 -14.854 -22.271 263 HZ2 LYS 33 1HZ LYS 33 -4.429 -14.254 -23.775 264 HZ3 LYS 33 2HZ LYS 33 -3.995 -13.404 -22.391 265 H SER 34 H SER 34 0.133 -9.608 -21.200 266 HA SER 34 HA SER 34 2.379 -10.285 -22.974 267 HB2 SER 34 2HB SER 34 0.507 -9.050 -23.999 268 HB3 SER 34 1HB SER 34 0.745 -7.734 -22.857 269 HG SER 34 HG SER 34 2.773 -8.635 -24.614 270 H SER 35 H SER 35 1.811 -9.029 -19.878 271 HA SER 35 HA SER 35 3.054 -7.920 -18.289 272 HB2 SER 35 2HB SER 35 5.372 -8.329 -20.200 273 HB3 SER 35 1HB SER 35 5.501 -7.957 -18.482 274 HG SER 35 HG SER 35 4.608 -10.329 -19.734 275 H LYS 36 H LYS 36 1.918 -6.632 -20.786 276 HA LYS 36 HA LYS 36 2.999 -4.047 -20.628 277 HB2 LYS 36 2HB LYS 36 3.088 -5.676 -23.186 278 HB3 LYS 36 1HB LYS 36 3.288 -3.939 -23.106 279 HG2 LYS 36 2HG LYS 36 5.361 -4.235 -21.845 280 HG3 LYS 36 1HG LYS 36 5.139 -5.986 -21.883 281 HD2 LYS 36 2HD LYS 36 5.256 -5.945 -24.320 282 HD3 LYS 36 1HD LYS 36 5.437 -4.197 -24.288 283 HE2 LYS 36 2HE LYS 36 7.569 -5.315 -24.603 284 HE3 LYS 36 1HE LYS 36 7.546 -4.409 -23.091 285 HZ1 LYS 36 3HZ LYS 36 8.567 -6.574 -22.821 286 HZ2 LYS 36 1HZ LYS 36 7.193 -7.361 -23.361 287 HZ3 LYS 36 2HZ LYS 36 7.175 -6.506 -21.913 288 H GLY 37 H GLY 37 1.557 -2.751 -21.613 289 HA2 GLY 37 2HA GLY 37 -0.541 -3.004 -23.217 290 HA3 GLY 37 1HA GLY 37 -1.162 -3.722 -21.723 291 H ASP 38 H ASP 38 -2.612 -1.740 -22.000 292 HA ASP 38 HA ASP 38 -1.161 0.483 -20.777 293 HB2 ASP 38 2HB ASP 38 -2.403 0.958 -22.944 294 HB3 ASP 38 1HB ASP 38 -3.895 0.645 -22.053 295 H PHE 39 H PHE 39 -1.355 0.560 -18.717 296 HA PHE 39 HA PHE 39 -3.715 -0.709 -17.540 297 HB2 PHE 39 2HB PHE 39 -0.919 -0.543 -16.420 298 HB3 PHE 39 1HB PHE 39 -2.298 -1.302 -15.639 299 HD1 PHE 39 1HD PHE 39 -3.452 -3.175 -17.002 300 HD2 PHE 39 2HD PHE 39 0.525 -1.872 -17.717 301 HE1 PHE 39 1HE PHE 39 -2.948 -5.312 -18.124 302 HE2 PHE 39 2HE PHE 39 1.025 -3.981 -18.839 303 HZ PHE 39 HZ PHE 39 -0.706 -5.712 -19.041 304 H LEU 40 H LEU 40 -4.996 0.616 -16.548 305 HA LEU 40 HA LEU 40 -3.849 3.067 -15.393 306 HB2 LEU 40 2HB LEU 40 -6.646 2.830 -16.559 307 HB3 LEU 40 1HB LEU 40 -5.849 4.210 -15.844 308 HG LEU 40 HG LEU 40 -4.972 2.940 -18.427 309 HD11 LEU 40 1HD1 LEU 40 -6.566 5.443 -17.910 310 HD12 LEU 40 2HD1 LEU 40 -7.139 3.971 -18.704 311 HD13 LEU 40 3HD1 LEU 40 -5.895 4.961 -19.465 312 HD21 LEU 40 3HD2 LEU 40 -3.152 4.041 -17.241 313 HD22 LEU 40 1HD2 LEU 40 -4.132 5.500 -17.057 314 HD23 LEU 40 2HD2 LEU 40 -3.622 4.971 -18.660 315 H ILE 41 H ILE 41 -4.145 3.291 -13.320 316 HA ILE 41 HA ILE 41 -6.043 1.484 -12.010 317 HB ILE 41 HB ILE 41 -3.466 2.639 -10.906 318 HG12 ILE 41 2HG1 ILE 41 -4.181 -0.102 -11.992 319 HG13 ILE 41 1HG1 ILE 41 -2.994 1.023 -12.588 320 HG21 ILE 41 1HG2 ILE 41 -5.387 0.642 -9.681 321 HG22 ILE 41 2HG2 ILE 41 -5.154 2.305 -9.168 322 HG23 ILE 41 3HG2 ILE 41 -3.835 1.136 -8.987 323 HD11 ILE 41 3HD1 ILE 41 -1.583 0.615 -10.688 324 HD12 ILE 41 1HD1 ILE 41 -2.116 -0.915 -11.462 325 HD13 ILE 41 2HD1 ILE 41 -2.859 -0.400 -9.970 326 H ARG 42 H ARG 42 -7.419 2.253 -10.523 327 HA ARG 42 HA ARG 42 -8.152 4.997 -10.694 328 HB2 ARG 42 2HB ARG 42 -9.666 2.990 -10.258 329 HB3 ARG 42 1HB ARG 42 -9.083 3.047 -8.605 330 HG2 ARG 42 2HG ARG 42 -11.217 4.220 -8.716 331 HG3 ARG 42 1HG ARG 42 -9.921 5.361 -8.444 332 HD2 ARG 42 2HD ARG 42 -10.119 6.336 -10.423 333 HD3 ARG 42 1HD ARG 42 -10.618 4.856 -11.287 334 HE ARG 42 HE ARG 42 -12.585 5.784 -9.511 335 HH11 ARG 42 1HH1 ARG 42 -11.025 6.594 -12.579 336 HH12 ARG 42 2HH1 ARG 42 -12.379 7.424 -13.203 337 HH21 ARG 42 1HH2 ARG 42 -14.467 6.916 -10.412 338 HH22 ARG 42 2HH2 ARG 42 -14.360 7.578 -11.967 339 H THR 43 H THR 43 -7.522 6.570 -9.505 340 HA THR 43 HA THR 43 -6.125 6.033 -7.005 341 HB THR 43 HB THR 43 -4.488 6.499 -8.882 342 HG1 THR 43 1HG THR 43 -3.381 7.216 -7.317 343 HG21 THR 43 3HG2 THR 43 -5.792 9.220 -8.856 344 HG22 THR 43 1HG2 THR 43 -5.818 8.065 -10.187 345 HG23 THR 43 2HG2 THR 43 -4.297 8.820 -9.702 346 H LYS 44 H LYS 44 -6.236 7.824 -5.529 347 HA LYS 44 HA LYS 44 -8.596 9.506 -6.012 348 HB2 LYS 44 2HB LYS 44 -7.251 8.732 -3.410 349 HB3 LYS 44 1HB LYS 44 -8.701 9.714 -3.553 350 HG2 LYS 44 2HG LYS 44 -9.900 7.852 -4.505 351 HG3 LYS 44 1HG LYS 44 -8.453 6.840 -4.422 352 HD2 LYS 44 2HD LYS 44 -8.483 7.106 -1.974 353 HD3 LYS 44 1HD LYS 44 -9.961 8.065 -2.124 354 HE2 LYS 44 2HE LYS 44 -11.095 6.173 -3.165 355 HE3 LYS 44 1HE LYS 44 -9.630 5.213 -3.048 356 HZ1 LYS 44 3HZ LYS 44 -11.103 4.629 -1.318 357 HZ2 LYS 44 1HZ LYS 44 -11.256 6.231 -0.781 358 HZ3 LYS 44 2HZ LYS 44 -9.798 5.395 -0.609 359 H LYS 45 H LYS 45 -8.031 11.396 -6.664 360 HA LYS 45 HA LYS 45 -5.578 12.647 -5.650 361 HB2 LYS 45 2HB LYS 45 -5.225 11.644 -7.951 362 HB3 LYS 45 1HB LYS 45 -6.583 12.588 -8.478 363 HG2 LYS 45 2HG LYS 45 -5.406 14.606 -8.163 364 HG3 LYS 45 1HG LYS 45 -4.064 13.755 -7.397 365 HD2 LYS 45 2HD LYS 45 -5.055 13.106 -10.097 366 HD3 LYS 45 1HD LYS 45 -3.748 14.318 -9.884 367 HE2 LYS 45 2HE LYS 45 -2.464 12.454 -8.772 368 HE3 LYS 45 1HE LYS 45 -3.770 11.349 -9.185 369 HZ1 LYS 45 3HZ LYS 45 -2.037 11.164 -10.797 370 HZ2 LYS 45 1HZ LYS 45 -2.034 12.822 -11.096 371 HZ3 LYS 45 2HZ LYS 45 -3.350 11.874 -11.542 372 H ASP 46 H ASP 46 -6.286 14.347 -4.555 373 HA ASP 46 HA ASP 46 -7.288 16.290 -3.976 374 HB2 ASP 46 2HB ASP 46 -7.755 16.525 -6.959 375 HB3 ASP 46 1HB ASP 46 -8.091 17.811 -5.812 376 H GLY 47 H GLY 47 -8.829 13.874 -3.935 377 HA2 GLY 47 2HA GLY 47 -10.959 13.539 -3.080 378 HA3 GLY 47 1HA GLY 47 -11.438 15.116 -3.678 379 H LYS 48 H LYS 48 -9.952 13.721 -6.214 380 HA LYS 48 HA LYS 48 -12.482 12.677 -7.304 381 HB2 LYS 48 2HB LYS 48 -10.041 13.779 -8.682 382 HB3 LYS 48 1HB LYS 48 -11.412 13.047 -9.492 383 HG2 LYS 48 2HG LYS 48 -12.846 14.815 -8.778 384 HG3 LYS 48 1HG LYS 48 -11.561 15.517 -7.781 385 HD2 LYS 48 2HD LYS 48 -11.832 16.706 -9.921 386 HD3 LYS 48 1HD LYS 48 -10.243 15.954 -9.785 387 HE2 LYS 48 2HE LYS 48 -11.037 14.082 -11.186 388 HE3 LYS 48 1HE LYS 48 -12.610 14.866 -11.325 389 HZ1 LYS 48 3HZ LYS 48 -11.201 15.267 -13.244 390 HZ2 LYS 48 1HZ LYS 48 -10.027 15.976 -12.272 391 HZ3 LYS 48 2HZ LYS 48 -11.532 16.714 -12.447 392 H GLN 49 H GLN 49 -12.530 10.553 -8.025 393 HA GLN 49 HA GLN 49 -10.035 9.157 -7.935 394 HB2 GLN 49 2HB GLN 49 -12.859 8.148 -8.353 395 HB3 GLN 49 1HB GLN 49 -11.426 7.148 -8.369 396 HG2 GLN 49 2HG GLN 49 -10.928 7.808 -6.090 397 HG3 GLN 49 1HG GLN 49 -12.428 8.737 -6.031 398 HE21 GLN 49 1HE2 GLN 49 -13.245 7.497 -4.374 399 HE22 GLN 49 2HE2 GLN 49 -13.785 5.876 -4.575 400 H VAL 50 H VAL 50 -8.981 8.757 -9.604 401 HA VAL 50 HA VAL 50 -10.167 9.085 -12.258 402 HB VAL 50 HB VAL 50 -8.206 10.431 -13.024 403 HG11 VAL 50 1HG1 VAL 50 -8.868 12.576 -12.027 404 HG12 VAL 50 2HG1 VAL 50 -9.758 11.707 -10.777 405 HG13 VAL 50 3HG1 VAL 50 -10.268 11.591 -12.459 406 HG21 VAL 50 3HG2 VAL 50 -6.766 11.540 -11.360 407 HG22 VAL 50 1HG2 VAL 50 -6.591 9.783 -11.308 408 HG23 VAL 50 2HG2 VAL 50 -7.544 10.611 -10.083 409 H TRP 51 H TRP 51 -8.423 8.444 -13.926 410 HA TRP 51 HA TRP 51 -7.304 5.957 -12.951 411 HB2 TRP 51 2HB TRP 51 -7.761 6.980 -15.760 412 HB3 TRP 51 1HB TRP 51 -7.090 5.427 -15.418 413 HD1 TRP 51 HD TRP 51 -10.099 6.935 -16.311 414 HE1 TRP 51 1HE TRP 51 -12.176 5.438 -15.808 415 HE3 TRP 51 3HE TRP 51 -7.912 3.639 -13.113 416 HZ2 TRP 51 2HZ TRP 51 -12.751 3.162 -14.212 417 HZ3 TRP 51 3HZ TRP 51 -9.269 1.847 -12.148 418 HH2 TRP 51 HH TRP 51 -11.636 1.613 -12.680 419 H GLU 52 H GLU 52 -5.209 5.689 -12.715 420 HA GLU 52 HA GLU 52 -3.370 7.814 -13.592 421 HB2 GLU 52 2HB GLU 52 -3.717 7.478 -11.134 422 HB3 GLU 52 1HB GLU 52 -3.131 5.834 -11.319 423 HG2 GLU 52 2HG GLU 52 -1.363 7.172 -10.465 424 HG3 GLU 52 1HG GLU 52 -0.983 6.765 -12.138 425 H ALA 53 H ALA 53 -1.555 7.112 -14.681 426 HA ALA 53 HA ALA 53 -1.664 4.537 -15.893 427 HB1 ALA 53 1HB ALA 53 0.523 6.611 -15.948 428 HB2 ALA 53 2HB ALA 53 -0.814 6.491 -17.090 429 HB3 ALA 53 3HB ALA 53 0.395 5.212 -17.014 430 H ALA 54 H ALA 54 -0.711 2.715 -15.280 431 HA ALA 54 HA ALA 54 0.605 2.383 -12.830 432 HB1 ALA 54 1HB ALA 54 0.699 0.609 -15.269 433 HB2 ALA 54 2HB ALA 54 -0.538 0.563 -14.011 434 HB3 ALA 54 3HB ALA 54 1.125 0.134 -13.626 435 H SER 55 H SER 55 2.861 1.440 -12.640 436 HA SER 55 HA SER 55 4.718 2.869 -14.385 437 HB2 SER 55 2HB SER 55 4.542 4.009 -12.208 438 HB3 SER 55 1HB SER 55 4.860 2.493 -11.371 439 HG SER 55 HG SER 55 6.560 4.213 -12.697 440 H LYS 56 H LYS 56 6.795 1.792 -14.551 441 HA LYS 56 HA LYS 56 6.608 -0.948 -14.971 442 HB2 LYS 56 2HB LYS 56 9.037 -1.030 -15.304 443 HB3 LYS 56 1HB LYS 56 8.347 0.354 -16.107 444 HG2 LYS 56 2HG LYS 56 9.832 0.464 -13.470 445 HG3 LYS 56 1HG LYS 56 10.557 0.771 -15.041 446 HD2 LYS 56 2HD LYS 56 8.962 2.651 -15.344 447 HD3 LYS 56 1HD LYS 56 8.353 2.354 -13.716 448 HE2 LYS 56 2HE LYS 56 10.581 2.795 -12.802 449 HE3 LYS 56 1HE LYS 56 11.195 3.079 -14.431 450 HZ1 LYS 56 3HZ LYS 56 10.700 5.180 -13.358 451 HZ2 LYS 56 1HZ LYS 56 9.136 4.704 -13.021 452 HZ3 LYS 56 2HZ LYS 56 9.612 4.939 -14.615 453 H THR 57 H THR 57 7.501 0.735 -12.061 454 HA THR 57 HA THR 57 8.582 -1.462 -10.696 455 HB THR 57 HB THR 57 7.931 -0.037 -8.665 456 HG1 THR 57 1HG THR 57 6.900 1.824 -9.044 457 HG21 THR 57 3HG2 THR 57 9.623 1.183 -10.861 458 HG22 THR 57 1HG2 THR 57 10.172 0.003 -9.676 459 HG23 THR 57 2HG2 THR 57 9.694 1.621 -9.154 460 H ALA 58 H ALA 58 5.355 -0.005 -10.616 461 HA ALA 58 HA ALA 58 4.198 -1.934 -8.906 462 HB1 ALA 58 1HB ALA 58 2.812 -0.163 -10.925 463 HB2 ALA 58 2HB ALA 58 3.211 0.296 -9.269 464 HB3 ALA 58 3HB ALA 58 2.043 -0.994 -9.571 465 H LEU 59 H LEU 59 4.513 -1.752 -12.399 466 HA LEU 59 HA LEU 59 2.903 -3.964 -13.006 467 HB2 LEU 59 2HB LEU 59 5.232 -2.715 -14.487 468 HB3 LEU 59 1HB LEU 59 4.178 -4.003 -15.109 469 HG LEU 59 HG LEU 59 3.131 -1.285 -14.321 470 HD11 LEU 59 1HD1 LEU 59 4.773 -1.031 -16.121 471 HD12 LEU 59 2HD1 LEU 59 3.133 -0.782 -16.723 472 HD13 LEU 59 3HD1 LEU 59 3.969 -2.303 -17.041 473 HD21 LEU 59 3HD2 LEU 59 1.244 -1.937 -15.615 474 HD22 LEU 59 1HD2 LEU 59 1.544 -3.211 -14.443 475 HD23 LEU 59 2HD2 LEU 59 2.020 -3.420 -16.139 476 H LYS 60 H LYS 60 6.418 -3.648 -12.402 477 HA LYS 60 HA LYS 60 7.066 -6.338 -12.820 478 HB2 LYS 60 2HB LYS 60 8.666 -4.459 -12.754 479 HB3 LYS 60 1HB LYS 60 8.381 -4.300 -11.030 480 HG2 LYS 60 2HG LYS 60 9.321 -6.505 -10.657 481 HG3 LYS 60 1HG LYS 60 9.556 -6.701 -12.400 482 HD2 LYS 60 2HD LYS 60 10.976 -4.736 -12.410 483 HD3 LYS 60 1HD LYS 60 10.797 -4.601 -10.658 484 HE2 LYS 60 2HE LYS 60 11.811 -6.834 -10.397 485 HE3 LYS 60 1HE LYS 60 12.006 -6.942 -12.144 486 HZ1 LYS 60 3HZ LYS 60 13.462 -4.971 -12.018 487 HZ2 LYS 60 1HZ LYS 60 14.071 -6.252 -11.117 488 HZ3 LYS 60 2HZ LYS 60 13.310 -4.961 -10.360 489 H LYS 61 H LYS 61 5.896 -4.571 -9.989 490 HA LYS 61 HA LYS 61 6.228 -6.489 -7.993 491 HB2 LYS 61 2HB LYS 61 5.757 -4.147 -7.613 492 HB3 LYS 61 1HB LYS 61 4.253 -4.286 -8.486 493 HG2 LYS 61 2HG LYS 61 3.406 -5.760 -6.709 494 HG3 LYS 61 1HG LYS 61 4.904 -5.473 -5.805 495 HD2 LYS 61 2HD LYS 61 4.506 -3.105 -5.846 496 HD3 LYS 61 1HD LYS 61 3.054 -3.342 -6.802 497 HE2 LYS 61 2HE LYS 61 2.061 -4.638 -4.931 498 HE3 LYS 61 1HE LYS 61 3.505 -4.315 -3.970 499 HZ1 LYS 61 3HZ LYS 61 3.002 -1.942 -4.077 500 HZ2 LYS 61 1HZ LYS 61 1.685 -2.790 -3.455 501 HZ3 LYS 61 2HZ LYS 61 1.666 -2.256 -5.044 502 H SER 62 H SER 62 3.762 -5.957 -10.426 503 HA SER 62 HA SER 62 1.910 -7.800 -9.266 504 HB2 SER 62 2HB SER 62 1.948 -6.370 -11.922 505 HB3 SER 62 1HB SER 62 0.575 -7.224 -11.215 506 HG SER 62 HG SER 62 1.812 -4.844 -10.353 507 H TRP 63 H TRP 63 4.202 -7.773 -12.004 508 HA TRP 63 HA TRP 63 3.463 -10.316 -12.889 509 HB2 TRP 63 2HB TRP 63 4.577 -8.620 -14.315 510 HB3 TRP 63 1HB TRP 63 6.040 -8.800 -13.349 511 HD1 TRP 63 HD TRP 63 7.546 -10.736 -13.842 512 HE1 TRP 63 1HE TRP 63 7.570 -12.666 -15.636 513 HE3 TRP 63 3HE TRP 63 2.857 -10.150 -15.676 514 HZ2 TRP 63 2HZ TRP 63 5.769 -13.736 -17.543 515 HZ3 TRP 63 3HZ TRP 63 2.047 -11.654 -17.456 516 HH2 TRP 63 HH TRP 63 3.486 -13.403 -18.372 517 H LYS 64 H LYS 64 5.554 -9.125 -10.412 518 HA LYS 64 HA LYS 64 7.235 -11.246 -9.960 519 HB2 LYS 64 2HB LYS 64 7.365 -9.130 -8.731 520 HB3 LYS 64 1HB LYS 64 5.835 -9.474 -7.949 521 HG2 LYS 64 2HG LYS 64 7.667 -9.867 -6.423 522 HG3 LYS 64 1HG LYS 64 6.866 -11.386 -6.809 523 HD2 LYS 64 2HD LYS 64 8.608 -11.923 -8.415 524 HD3 LYS 64 1HD LYS 64 9.400 -10.381 -8.083 525 HE2 LYS 64 2HE LYS 64 9.738 -11.041 -5.778 526 HE3 LYS 64 1HE LYS 64 8.926 -12.577 -6.084 527 HZ1 LYS 64 3HZ LYS 64 11.328 -12.815 -6.131 528 HZ2 LYS 64 1HZ LYS 64 11.439 -11.657 -7.366 529 HZ3 LYS 64 2HZ LYS 64 10.678 -13.138 -7.649 530 H ARG 65 H ARG 65 3.849 -10.790 -8.934 531 HA ARG 65 HA ARG 65 3.701 -13.190 -7.379 532 HB2 ARG 65 2HB ARG 65 1.893 -11.247 -7.258 533 HB3 ARG 65 1HB ARG 65 1.368 -11.915 -8.766 534 HG2 ARG 65 2HG ARG 65 0.003 -12.781 -7.078 535 HG3 ARG 65 1HG ARG 65 1.011 -14.078 -7.723 536 HD2 ARG 65 2HD ARG 65 2.555 -13.510 -5.725 537 HD3 ARG 65 1HD ARG 65 1.105 -12.614 -5.205 538 HE ARG 65 HE ARG 65 0.588 -15.344 -5.895 539 HH11 ARG 65 1HH1 ARG 65 1.492 -13.199 -3.220 540 HH12 ARG 65 2HH1 ARG 65 0.973 -14.285 -2.025 541 HH21 ARG 65 1HH2 ARG 65 -0.067 -16.812 -4.272 542 HH22 ARG 65 2HH2 ARG 65 0.057 -16.400 -2.617 543 H TYR 66 H TYR 66 3.262 -12.360 -10.714 544 HA TYR 66 HA TYR 66 1.682 -14.478 -11.675 545 HB2 TYR 66 2HB TYR 66 2.510 -12.326 -12.850 546 HB3 TYR 66 1HB TYR 66 3.951 -13.258 -13.226 547 HD1 TYR 66 1HD TYR 66 3.573 -15.485 -14.518 548 HD2 TYR 66 2HD TYR 66 0.666 -12.412 -14.197 549 HE1 TYR 66 1HE TYR 66 2.417 -16.380 -16.479 550 HE2 TYR 66 2HE TYR 66 -0.495 -13.262 -16.120 551 HH TYR 66 HH TYR 66 0.100 -16.330 -17.398 552 H GLU 67 H GLU 67 5.176 -14.119 -11.557 553 HA GLU 67 HA GLU 67 5.949 -16.770 -12.379 554 HB2 GLU 67 2HB GLU 67 7.416 -14.934 -10.503 555 HB3 GLU 67 1HB GLU 67 8.093 -16.167 -11.562 556 HG2 GLU 67 2HG GLU 67 6.747 -13.643 -12.417 557 HG3 GLU 67 1HG GLU 67 8.490 -13.905 -12.397 558 H GLN 68 H GLN 68 5.400 -15.333 -9.274 559 HA GLN 68 HA GLN 68 6.125 -17.561 -7.748 560 HB2 GLN 68 2HB GLN 68 4.107 -15.409 -7.116 561 HB3 GLN 68 1HB GLN 68 4.673 -16.598 -5.953 562 HG2 GLN 68 2HG GLN 68 6.931 -15.753 -6.133 563 HG3 GLN 68 1HG GLN 68 6.428 -14.620 -7.387 564 HE21 GLN 68 1HE2 GLN 68 7.645 -14.142 -4.790 565 HE22 GLN 68 2HE2 GLN 68 6.562 -13.072 -3.956 566 H GLU 69 H GLU 69 2.935 -16.661 -9.019 567 HA GLU 69 HA GLU 69 1.709 -18.987 -7.990 568 HB2 GLU 69 2HB GLU 69 0.764 -17.031 -10.048 569 HB3 GLU 69 1HB GLU 69 -0.205 -18.402 -9.518 570 HG2 GLU 69 2HG GLU 69 0.822 -16.175 -7.787 571 HG3 GLU 69 1HG GLU 69 -0.828 -16.360 -8.383 572 H MET 70 H MET 70 3.084 -18.214 -11.123 573 HA MET 70 HA MET 70 2.237 -20.556 -12.469 574 HB2 MET 70 2HB MET 70 4.708 -18.870 -12.928 575 HB3 MET 70 1HB MET 70 4.254 -20.209 -13.965 576 HG2 MET 70 2HG MET 70 2.603 -17.744 -13.463 577 HG3 MET 70 1HG MET 70 3.611 -18.030 -14.878 578 HE1 MET 70 3HE MET 70 1.756 -20.994 -16.648 579 HE2 MET 70 1HE MET 70 3.098 -21.115 -15.510 580 HE3 MET 70 2HE MET 70 3.092 -19.844 -16.735 581 H LEU 71 H LEU 71 5.019 -19.896 -10.485 582 HA LEU 71 HA LEU 71 6.173 -22.487 -10.777 583 HB2 LEU 71 2HB LEU 71 7.541 -20.663 -10.442 584 HB3 LEU 71 1HB LEU 71 6.707 -20.059 -9.052 585 HG LEU 71 HG LEU 71 7.557 -22.138 -7.844 586 HD11 LEU 71 1HD1 LEU 71 9.467 -23.305 -8.869 587 HD12 LEU 71 2HD1 LEU 71 9.212 -22.397 -10.356 588 HD13 LEU 71 3HD1 LEU 71 7.983 -23.530 -9.796 589 HD21 LEU 71 3HD2 LEU 71 8.619 -19.973 -7.550 590 HD22 LEU 71 1HD2 LEU 71 9.602 -20.241 -8.988 591 HD23 LEU 71 2HD2 LEU 71 9.833 -21.253 -7.565 592 H LYS 72 H LYS 72 3.956 -20.959 -8.622 593 HA LYS 72 HA LYS 72 3.858 -22.824 -6.487 594 HB2 LYS 72 2HB LYS 72 3.109 -20.483 -6.341 595 HB3 LYS 72 1HB LYS 72 1.948 -20.803 -7.595 596 HG2 LYS 72 2HG LYS 72 1.718 -22.135 -4.926 597 HG3 LYS 72 1HG LYS 72 1.172 -20.479 -5.172 598 HD2 LYS 72 2HD LYS 72 -0.188 -21.403 -7.126 599 HD3 LYS 72 1HD LYS 72 0.172 -23.002 -6.459 600 HE2 LYS 72 2HE LYS 72 -1.987 -22.182 -5.674 601 HE3 LYS 72 1HE LYS 72 -0.841 -22.336 -4.335 602 HZ1 LYS 72 3HZ LYS 72 -1.472 -19.757 -5.726 603 HZ2 LYS 72 1HZ LYS 72 -0.497 -19.959 -4.378 604 HZ3 LYS 72 2HZ LYS 72 -2.134 -20.263 -4.267 605 H ASN 73 H ASN 73 2.379 -22.639 -9.602 606 HA ASN 73 HA ASN 73 0.890 -25.130 -9.105 607 HB2 ASN 73 2HB ASN 73 0.571 -23.049 -11.293 608 HB3 ASN 73 1HB ASN 73 -0.270 -24.589 -11.282 609 HD21 ASN 73 1HD2 ASN 73 -0.037 -21.434 -9.878 610 HD22 ASN 73 2HD2 ASN 73 -1.535 -21.472 -9.028 611 H GLU 74 H GLU 74 0.764 -26.353 -11.391 612 HA GLU 74 HA GLU 74 3.513 -26.442 -12.367 613 HB2 GLU 74 2HB GLU 74 1.398 -28.600 -12.479 614 HB3 GLU 74 1HB GLU 74 3.038 -28.755 -13.087 615 HG2 GLU 74 2HG GLU 74 3.868 -28.424 -10.792 616 HG3 GLU 74 1HG GLU 74 2.203 -28.379 -10.222 617 H LYS 75 H LYS 75 0.347 -27.437 -13.678 618 HA LYS 75 HA LYS 75 0.695 -25.499 -15.831 619 HB2 LYS 75 2HB LYS 75 -0.093 -28.392 -16.244 620 HB3 LYS 75 1HB LYS 75 -0.013 -27.155 -17.486 621 HG2 LYS 75 2HG LYS 75 2.434 -27.006 -17.127 622 HG3 LYS 75 1HG LYS 75 2.309 -28.306 -15.945 623 HD2 LYS 75 2HD LYS 75 1.607 -28.489 -18.884 624 HD3 LYS 75 1HD LYS 75 3.039 -29.163 -18.112 625 HE2 LYS 75 2HE LYS 75 1.608 -30.620 -16.752 626 HE3 LYS 75 1HE LYS 75 0.183 -29.952 -17.539 627 HZ1 LYS 75 3HZ LYS 75 1.055 -30.806 -19.668 628 HZ2 LYS 75 1HZ LYS 75 0.774 -32.023 -18.529 629 HZ3 LYS 75 2HZ LYS 75 2.342 -31.518 -18.829 630 H VAL 76 H VAL 76 -0.995 -24.215 -15.244 631 HA VAL 76 HA VAL 76 -3.469 -25.290 -14.262 632 HB VAL 76 HB VAL 76 -2.930 -22.501 -15.351 633 HG11 VAL 76 1HG1 VAL 76 -4.888 -21.824 -14.049 634 HG12 VAL 76 2HG1 VAL 76 -5.150 -23.499 -13.568 635 HG13 VAL 76 3HG1 VAL 76 -5.306 -23.032 -15.262 636 HG21 VAL 76 3HG2 VAL 76 -2.651 -21.821 -13.006 637 HG22 VAL 76 1HG2 VAL 76 -1.441 -23.009 -13.488 638 HG23 VAL 76 2HG2 VAL 76 -2.821 -23.499 -12.504 639 H ALA 77 H ALA 77 -2.873 -23.309 -17.119 640 HA ALA 77 HA ALA 77 -4.150 -25.283 -18.795 641 HB1 ALA 77 1HB ALA 77 -5.530 -23.548 -19.903 642 HB2 ALA 77 2HB ALA 77 -5.000 -22.366 -18.710 643 HB3 ALA 77 3HB ALA 77 -5.986 -23.739 -18.210 644 H ALA 78 H ALA 78 -3.062 -21.924 -18.921 645 HA ALA 78 HA ALA 78 -1.691 -20.813 -20.284 646 HB1 ALA 78 1HB ALA 78 0.646 -21.381 -20.029 647 HB2 ALA 78 2HB ALA 78 0.220 -23.014 -19.518 648 HB3 ALA 78 3HB ALA 78 -0.202 -21.635 -18.501 649 H LYS 79 H LYS 79 -2.877 -21.186 -22.143 650 HA LYS 79 HA LYS 79 -2.025 -23.291 -23.890 651 HB2 LYS 79 2HB LYS 79 -3.932 -21.017 -24.430 652 HB3 LYS 79 1HB LYS 79 -3.673 -22.412 -25.472 653 HG2 LYS 79 2HG LYS 79 -4.494 -23.887 -23.684 654 HG3 LYS 79 1HG LYS 79 -4.788 -22.472 -22.673 655 HD2 LYS 79 2HD LYS 79 -6.328 -21.609 -24.379 656 HD3 LYS 79 1HD LYS 79 -6.050 -23.074 -25.330 657 HE2 LYS 79 2HE LYS 79 -6.950 -24.422 -23.468 658 HE3 LYS 79 1HE LYS 79 -7.241 -22.944 -22.563 659 HZ1 LYS 79 3HZ LYS 79 -8.495 -23.593 -25.170 660 HZ2 LYS 79 1HZ LYS 79 -8.791 -22.228 -24.248 661 HZ3 LYS 79 2HZ LYS 79 -9.250 -23.740 -23.671 662 H MET 80 H MET 80 0.100 -22.822 -24.143 663 HA MET 80 HA MET 80 1.973 -22.033 -25.066 664 HB2 MET 80 2HB MET 80 0.804 -22.377 -27.193 665 HB3 MET 80 1HB MET 80 0.094 -20.778 -27.068 666 HG2 MET 80 2HG MET 80 2.318 -19.776 -27.258 667 HG3 MET 80 1HG MET 80 3.026 -21.384 -27.395 668 HE1 MET 80 3HE MET 80 3.388 -19.935 -31.027 669 HE2 MET 80 1HE MET 80 4.233 -20.681 -29.667 670 HE3 MET 80 2HE MET 80 3.543 -19.066 -29.499 671 H LEU 81 H LEU 81 2.715 -20.810 -23.454 672 HA LEU 81 HA LEU 81 1.920 -18.064 -23.165 673 HB2 LEU 81 2HB LEU 81 2.592 -19.397 -21.201 674 HB3 LEU 81 1HB LEU 81 4.186 -19.613 -21.888 675 HG LEU 81 HG LEU 81 4.589 -17.179 -21.684 676 HD11 LEU 81 1HD1 LEU 81 3.078 -15.808 -20.337 677 HD12 LEU 81 2HD1 LEU 81 1.922 -17.141 -20.275 678 HD13 LEU 81 3HD1 LEU 81 2.305 -16.372 -21.816 679 HD21 LEU 81 3HD2 LEU 81 5.327 -18.690 -19.923 680 HD22 LEU 81 1HD2 LEU 81 3.762 -18.544 -19.122 681 HD23 LEU 81 2HD2 LEU 81 4.824 -17.141 -19.245 682 H GLU 82 H GLU 82 2.505 -16.772 -24.774 683 HA GLU 82 HA GLU 82 4.841 -17.363 -26.303 684 HB2 GLU 82 2HB GLU 82 4.214 -15.470 -27.723 685 HB3 GLU 82 1HB GLU 82 2.878 -16.584 -27.491 686 HG2 GLU 82 2HG GLU 82 1.867 -15.060 -25.895 687 HG3 GLU 82 1HG GLU 82 3.239 -13.969 -26.043 688 H LYS 83 H LYS 83 6.728 -16.540 -26.192 689 HA LYS 83 HA LYS 83 7.174 -13.955 -25.021 690 HB2 LYS 83 2HB LYS 83 9.153 -14.815 -23.720 691 HB3 LYS 83 1HB LYS 83 7.590 -15.320 -23.095 692 HG2 LYS 83 2HG LYS 83 7.878 -17.528 -23.979 693 HG3 LYS 83 1HG LYS 83 9.335 -17.043 -24.843 694 HD2 LYS 83 2HD LYS 83 9.907 -18.264 -22.837 695 HD3 LYS 83 1HD LYS 83 10.441 -16.590 -22.707 696 HE2 LYS 83 2HE LYS 83 8.398 -16.112 -21.361 697 HE3 LYS 83 1HE LYS 83 8.007 -17.833 -21.428 698 HZ1 LYS 83 3HZ LYS 83 10.424 -16.623 -20.217 699 HZ2 LYS 83 1HZ LYS 83 10.151 -18.279 -20.314 700 HZ3 LYS 83 2HZ LYS 83 9.150 -17.315 -19.377 701 H ASP 84 H ASP 84 7.791 -13.040 -26.792 702 HA ASP 84 HA ASP 84 9.751 -14.414 -28.502 703 HB2 ASP 84 2HB ASP 84 7.749 -12.270 -29.171 704 HB3 ASP 84 1HB ASP 84 9.009 -12.813 -30.268 705 H ALA 85 H ALA 85 9.550 -12.043 -26.222 706 HA ALA 85 HA ALA 85 10.764 -10.265 -25.591 707 HB1 ALA 85 1HB ALA 85 12.676 -11.837 -25.811 708 HB2 ALA 85 2HB ALA 85 13.143 -10.183 -26.186 709 HB3 ALA 85 3HB ALA 85 12.874 -11.339 -27.492 710 H THR 86 H THR 86 9.730 -8.511 -26.192 711 HA THR 86 HA THR 86 9.042 -7.839 -28.753 712 HB THR 86 HB THR 86 7.978 -6.822 -26.746 713 HG1 THR 86 1HG THR 86 8.017 -5.831 -28.939 714 HG21 THR 86 3HG2 THR 86 10.525 -5.210 -26.628 715 HG22 THR 86 1HG2 THR 86 9.942 -6.320 -25.400 716 HG23 THR 86 2HG2 THR 86 9.082 -4.799 -25.718 717 H GLU 87 H GLU 87 9.980 -6.911 -30.409 718 HA GLU 87 HA GLU 87 12.799 -6.422 -30.191 719 HB2 GLU 87 2HB GLU 87 11.712 -7.826 -32.008 720 HB3 GLU 87 1HB GLU 87 11.054 -6.343 -32.660 721 HG2 GLU 87 2HG GLU 87 14.003 -6.986 -32.412 722 HG3 GLU 87 1HG GLU 87 13.046 -7.166 -33.870 723 H VAL 88 H VAL 88 13.121 -4.525 -29.288 724 HA VAL 88 HA VAL 88 12.036 -2.145 -30.602 725 HB VAL 88 HB VAL 88 12.022 -0.958 -28.414 726 HG11 VAL 88 1HG1 VAL 88 9.937 -1.912 -29.197 727 HG12 VAL 88 2HG1 VAL 88 10.036 -2.017 -27.441 728 HG13 VAL 88 3HG1 VAL 88 10.330 -3.449 -28.428 729 HG21 VAL 88 3HG2 VAL 88 13.687 -2.295 -27.229 730 HG22 VAL 88 1HG2 VAL 88 12.589 -3.673 -27.220 731 HG23 VAL 88 2HG2 VAL 88 12.184 -2.218 -26.307 732 H GLY 89 H GLY 89 13.478 -0.414 -30.775 733 HA2 GLY 89 2HA GLY 89 16.120 -0.656 -29.667 734 HA3 GLY 89 1HA GLY 89 16.029 -0.900 -31.406 735 H VAL 90 H VAL 90 16.004 1.355 -28.864 736 HA VAL 90 HA VAL 90 15.161 3.482 -30.636 737 HB VAL 90 HB VAL 90 15.344 4.990 -28.660 738 HG11 VAL 90 1HG1 VAL 90 13.725 2.495 -28.181 739 HG12 VAL 90 2HG1 VAL 90 13.234 3.900 -29.129 740 HG13 VAL 90 3HG1 VAL 90 13.473 4.052 -27.387 741 HG21 VAL 90 3HG2 VAL 90 15.725 4.039 -26.420 742 HG22 VAL 90 1HG2 VAL 90 17.143 3.840 -27.451 743 HG23 VAL 90 2HG2 VAL 90 16.072 2.471 -27.142 744 H LYS 91 H LYS 91 16.443 4.865 -31.611 745 HA LYS 91 HA LYS 91 19.138 5.319 -30.784 746 HB2 LYS 91 2HB LYS 91 20.203 4.665 -32.905 747 HB3 LYS 91 1HB LYS 91 19.469 3.262 -32.155 748 HG2 LYS 91 2HG LYS 91 18.289 4.827 -34.467 749 HG3 LYS 91 1HG LYS 91 19.205 3.330 -34.621 750 HD2 LYS 91 2HD LYS 91 17.508 2.142 -33.354 751 HD3 LYS 91 1HD LYS 91 16.637 3.644 -33.078 752 HE2 LYS 91 2HE LYS 91 16.242 3.859 -35.464 753 HE3 LYS 91 1HE LYS 91 17.121 2.353 -35.757 754 HZ1 LYS 91 3HZ LYS 91 15.474 1.199 -34.434 755 HZ2 LYS 91 1HZ LYS 91 14.716 2.011 -35.695 756 HZ3 LYS 91 2HZ LYS 91 14.654 2.624 -34.131 757 H ALA 92 H ALA 92 19.777 7.292 -31.430 758 HA ALA 92 HA ALA 92 17.886 8.752 -33.125 759 HB1 ALA 92 1HB ALA 92 19.734 9.819 -30.983 760 HB2 ALA 92 2HB ALA 92 17.999 9.572 -30.810 761 HB3 ALA 92 3HB ALA 92 18.605 10.775 -31.947 762 H ALA 93 H ALA 93 18.687 8.763 -35.096 763 HA ALA 93 HA ALA 93 21.446 8.514 -35.707 764 HB1 ALA 93 1HB ALA 93 19.687 7.785 -37.257 765 HB2 ALA 93 2HB ALA 93 20.777 8.931 -38.030 766 HB3 ALA 93 3HB ALA 93 19.187 9.463 -37.482 767 H LEU 94 H LEU 94 19.193 11.203 -35.824 768 HA LEU 94 HA LEU 94 19.379 13.419 -35.866 769 HB2 LEU 94 2HB LEU 94 21.878 12.900 -34.268 770 HB3 LEU 94 1HB LEU 94 21.074 14.448 -34.405 771 HG LEU 94 HG LEU 94 19.960 11.965 -33.105 772 HD11 LEU 94 1HD1 LEU 94 20.885 14.576 -31.924 773 HD12 LEU 94 2HD1 LEU 94 21.707 13.022 -31.791 774 HD13 LEU 94 3HD1 LEU 94 20.133 13.253 -31.034 775 HD21 LEU 94 3HD2 LEU 94 18.170 13.240 -34.136 776 HD22 LEU 94 1HD2 LEU 94 18.767 14.722 -33.383 777 HD23 LEU 94 2HD2 LEU 94 18.110 13.424 -32.385 778 H GLU 95 H GLU 95 19.595 13.852 -37.993 779 HA GLU 95 HA GLU 95 22.294 14.641 -38.724 780 HB2 GLU 95 2HB GLU 95 21.773 14.181 -41.089 781 HB3 GLU 95 1HB GLU 95 21.732 12.730 -40.106 782 HG2 GLU 95 2HG GLU 95 19.317 12.743 -40.137 783 HG3 GLU 95 1HG GLU 95 19.311 14.280 -41.008 784 H GLU 96 H GLU 96 22.528 16.552 -39.818 785 HA GLU 96 HA GLU 96 20.116 18.147 -40.052 786 HB2 GLU 96 2HB GLU 96 21.129 18.755 -37.939 787 HB3 GLU 96 1HB GLU 96 22.691 18.960 -38.703 788 HG2 GLU 96 2HG GLU 96 21.875 20.878 -39.925 789 HG3 GLU 96 1HG GLU 96 20.262 20.639 -39.253 790 H ALA 97 H ALA 97 19.967 18.335 -42.131 791 HA ALA 97 HA ALA 97 22.206 19.557 -43.532 792 HB1 ALA 97 1HB ALA 97 21.630 18.276 -45.546 793 HB2 ALA 97 2HB ALA 97 20.394 17.403 -44.642 794 HB3 ALA 97 3HB ALA 97 22.099 17.206 -44.227 795 H LYS 98 H LYS 98 21.289 21.526 -43.262 796 HA LYS 98 HA LYS 98 18.911 22.026 -44.859 797 HB2 LYS 98 2HB LYS 98 18.014 23.518 -43.113 798 HB3 LYS 98 1HB LYS 98 18.078 21.844 -42.585 799 HG2 LYS 98 2HG LYS 98 20.092 22.309 -41.302 800 HG3 LYS 98 1HG LYS 98 20.068 23.982 -41.863 801 HD2 LYS 98 2HD LYS 98 17.898 24.297 -40.798 802 HD3 LYS 98 1HD LYS 98 17.936 22.627 -40.221 803 HE2 LYS 98 2HE LYS 98 19.908 23.096 -38.924 804 HE3 LYS 98 1HE LYS 98 19.969 24.740 -39.542 805 HZ1 LYS 98 3HZ LYS 98 17.819 25.152 -38.460 806 HZ2 LYS 98 1HZ LYS 98 19.004 24.680 -37.361 807 HZ3 LYS 98 2HZ LYS 98 17.828 23.581 -37.832 808 H LYS 99 H LYS 99 18.647 24.433 -45.112 809 HA LYS 99 HA LYS 99 19.406 26.255 -46.089 810 HB2 LYS 99 2HB LYS 99 21.576 26.089 -43.995 811 HB3 LYS 99 1HB LYS 99 21.320 27.491 -45.023 812 HG2 LYS 99 2HG LYS 99 19.377 26.366 -43.000 813 HG3 LYS 99 1HG LYS 99 20.347 27.826 -42.813 814 HD2 LYS 99 2HD LYS 99 18.184 27.391 -44.896 815 HD3 LYS 99 1HD LYS 99 18.032 28.353 -43.432 816 HE2 LYS 99 2HE LYS 99 19.786 29.860 -44.226 817 HE3 LYS 99 1HE LYS 99 19.971 28.887 -45.681 818 HZ1 LYS 99 3HZ LYS 99 17.507 30.334 -44.894 819 HZ2 LYS 99 1HZ LYS 99 17.716 29.426 -46.302 820 HZ3 LYS 99 2HZ LYS 99 18.607 30.850 -46.054 821 H VAL 100 H VAL 100 19.643 24.716 -47.702 822 HA VAL 100 HA VAL 100 22.052 25.181 -49.102 823 HB VAL 100 HB VAL 100 22.798 23.196 -47.899 824 HG11 VAL 100 1HG1 VAL 100 20.683 22.235 -47.233 825 HG12 VAL 100 2HG1 VAL 100 21.661 21.018 -48.048 826 HG13 VAL 100 3HG1 VAL 100 20.328 21.794 -48.901 827 HG21 VAL 100 3HG2 VAL 100 23.285 21.660 -49.765 828 HG22 VAL 100 1HG2 VAL 100 23.514 23.350 -50.221 829 HG23 VAL 100 2HG2 VAL 100 22.070 22.485 -50.741 830 H GLN 101 H GLN 101 21.013 26.112 -50.684 831 HA GLN 101 HA GLN 101 18.649 24.833 -51.725 832 HB2 GLN 101 2HB GLN 101 18.381 26.913 -53.113 833 HB3 GLN 101 1HB GLN 101 18.310 27.172 -51.383 834 HG2 GLN 101 2HG GLN 101 20.601 27.996 -51.409 835 HG3 GLN 101 1HG GLN 101 20.686 27.719 -53.150 836 HE21 GLN 101 1HE2 GLN 101 20.998 30.173 -51.657 837 HE22 GLN 101 2HE2 GLN 101 19.822 31.270 -52.264 838 H ILE 102 H ILE 102 19.276 23.133 -52.811 839 HA ILE 102 HA ILE 102 21.156 23.596 -54.956 840 HB ILE 102 HB ILE 102 21.686 21.681 -53.493 841 HG12 ILE 102 2HG1 ILE 102 22.420 21.489 -55.872 842 HG13 ILE 102 1HG1 ILE 102 22.170 19.928 -55.120 843 HG21 ILE 102 1HG2 ILE 102 19.084 20.467 -54.289 844 HG22 ILE 102 2HG2 ILE 102 19.588 21.012 -52.686 845 HG23 ILE 102 3HG2 ILE 102 20.377 19.624 -53.439 846 HD11 ILE 102 3HD1 ILE 102 21.413 19.958 -57.434 847 HD12 ILE 102 1HD1 ILE 102 20.315 21.290 -57.075 848 HD13 ILE 102 2HD1 ILE 102 20.047 19.709 -56.343 849 H GLU 103 H GLU 103 20.059 24.668 -56.307 850 HA GLU 103 HA GLU 103 17.808 23.361 -57.596 851 HB2 GLU 103 2HB GLU 103 16.829 25.665 -57.899 852 HB3 GLU 103 1HB GLU 103 16.790 25.044 -56.255 853 HG2 GLU 103 2HG GLU 103 18.701 26.428 -55.679 854 HG3 GLU 103 1HG GLU 103 18.801 27.010 -57.338 855 H LEU 104 H LEU 104 17.429 24.418 -59.770 856 HA LEU 104 HA LEU 104 19.660 25.658 -60.981 857 HB2 LEU 104 2HB LEU 104 20.170 23.901 -62.618 858 HB3 LEU 104 1HB LEU 104 20.569 23.415 -60.992 859 HG LEU 104 HG LEU 104 18.150 22.442 -62.552 860 HD11 LEU 104 1HD1 LEU 104 19.428 20.349 -62.730 861 HD12 LEU 104 2HD1 LEU 104 20.801 21.156 -61.959 862 HD13 LEU 104 3HD1 LEU 104 20.228 21.700 -63.533 863 HD21 LEU 104 3HD2 LEU 104 19.356 21.428 -59.967 864 HD22 LEU 104 1HD2 LEU 104 17.980 20.729 -60.817 865 HD23 LEU 104 2HD2 LEU 104 17.852 22.338 -60.096 866 H ASP 105 H ASP 105 19.101 26.675 -62.810 867 HA ASP 105 HA ASP 105 16.303 26.996 -63.223 868 HB2 ASP 105 2HB ASP 105 17.909 28.870 -63.494 869 HB3 ASP 105 1HB ASP 105 18.610 28.049 -64.881 870 H THR 106 H THR 106 18.941 25.737 -65.185 871 HA THR 106 HA THR 106 16.913 24.393 -66.762 872 HB THR 106 HB THR 106 18.393 25.713 -68.147 873 HG1 THR 106 1HG THR 106 17.851 24.034 -69.245 874 HG21 THR 106 3HG2 THR 106 20.394 25.819 -66.750 875 HG22 THR 106 1HG2 THR 106 20.819 25.228 -68.356 876 HG23 THR 106 2HG2 THR 106 20.692 24.101 -67.004 877 H SER 107 H SER 107 16.434 22.424 -66.064 878 HA SER 107 HA SER 107 18.323 20.933 -64.533 879 HB2 SER 107 2HB SER 107 16.402 19.264 -64.530 880 HB3 SER 107 1HB SER 107 16.054 20.838 -63.809 881 HG SER 107 HG SER 107 14.817 19.632 -65.819 882 H LEU 108 H LEU 108 16.666 20.645 -67.611 883 HA LEU 108 HA LEU 108 17.053 19.598 -69.537 884 HB2 LEU 108 2HB LEU 108 19.156 21.025 -69.295 885 HB3 LEU 108 1HB LEU 108 19.976 19.584 -68.751 886 HG LEU 108 HG LEU 108 20.490 20.136 -71.100 887 HD11 LEU 108 1HD1 LEU 108 20.057 17.994 -72.151 888 HD12 LEU 108 2HD1 LEU 108 18.908 17.594 -70.872 889 HD13 LEU 108 3HD1 LEU 108 20.617 17.805 -70.492 890 HD21 LEU 108 3HD2 LEU 108 17.565 19.666 -71.602 891 HD22 LEU 108 1HD2 LEU 108 18.801 19.930 -72.827 892 HD23 LEU 108 2HD2 LEU 108 18.397 21.216 -71.684 893 H SER 109 H SER 109 16.137 17.670 -69.580 894 HA SER 109 HA SER 109 17.299 15.482 -68.119 895 HB2 SER 109 2HB SER 109 15.220 14.306 -68.984 896 HB3 SER 109 1HB SER 109 14.938 15.648 -67.887 897 HG SER 109 HG SER 109 14.072 15.323 -70.381 898 H TYR 110 H TYR 110 18.185 13.695 -69.051 899 HA TYR 110 HA TYR 110 18.689 13.856 -71.932 900 HB2 TYR 110 2HB TYR 110 20.303 12.540 -69.747 901 HB3 TYR 110 1HB TYR 110 20.601 12.295 -71.459 902 HD1 TYR 110 1HD TYR 110 21.325 14.218 -72.853 903 HD2 TYR 110 2HD TYR 110 21.112 14.465 -68.616 904 HE1 TYR 110 1HE TYR 110 22.808 16.172 -72.906 905 HE2 TYR 110 2HE TYR 110 22.598 16.428 -68.656 906 HH TYR 110 HH TYR 110 24.266 17.356 -70.105 907 H ILE 111 H ILE 111 18.392 12.074 -73.205 908 HA ILE 111 HA ILE 111 17.553 9.628 -71.986 909 HB ILE 111 HB ILE 111 15.415 10.714 -72.236 910 HG12 ILE 111 2HG1 ILE 111 15.769 8.662 -74.424 911 HG13 ILE 111 1HG1 ILE 111 15.588 8.305 -72.713 912 HG21 ILE 111 1HG2 ILE 111 14.509 11.456 -74.396 913 HG22 ILE 111 2HG2 ILE 111 16.080 11.156 -75.141 914 HG23 ILE 111 3HG2 ILE 111 15.922 12.388 -73.896 915 HD11 ILE 111 3HD1 ILE 111 13.404 9.302 -72.730 916 HD12 ILE 111 1HD1 ILE 111 13.514 7.980 -73.899 917 HD13 ILE 111 2HD1 ILE 111 13.570 9.666 -74.455 Start of MODEL 4 1 H1 GLY -1 1HT GLY -1 -5.451 -5.900 -31.093 2 H2 GLY -1 2HT GLY -1 -4.722 -6.224 -29.598 3 H3 GLY -1 3HT GLY -1 -4.097 -5.017 -30.565 4 HA2 GLY -1 1HA GLY -1 -6.093 -3.715 -30.245 5 HA3 GLY -1 2HA GLY -1 -6.703 -5.007 -29.210 6 H SER 0 H SER 0 -6.133 -2.246 -28.497 7 HA SER 0 HA SER 0 -3.665 -2.234 -27.084 8 HB2 SER 0 2HB SER 0 -6.029 -0.347 -27.002 9 HB3 SER 0 1HB SER 0 -4.423 -0.032 -26.342 10 HG SER 0 HG SER 0 -4.103 0.778 -28.209 11 H MET 1 H MET 1 -3.410 -3.310 -25.246 12 HA MET 1 HA MET 1 -5.664 -4.149 -23.683 13 HB2 MET 1 2HB MET 1 -2.698 -4.483 -23.364 14 HB3 MET 1 1HB MET 1 -3.828 -4.968 -22.114 15 HG2 MET 1 2HG MET 1 -3.826 -5.992 -24.937 16 HG3 MET 1 1HG MET 1 -3.133 -6.833 -23.544 17 HE1 MET 1 3HE MET 1 -5.209 -8.284 -25.354 18 HE2 MET 1 1HE MET 1 -6.281 -8.997 -24.143 19 HE3 MET 1 2HE MET 1 -4.539 -8.976 -23.878 20 H THR 2 H THR 2 -6.684 -2.580 -22.627 21 HA THR 2 HA THR 2 -5.064 -1.023 -20.781 22 HB THR 2 HB THR 2 -7.708 -0.264 -22.060 23 HG1 THR 2 1HG THR 2 -5.130 -0.025 -22.869 24 HG21 THR 2 3HG2 THR 2 -7.379 0.659 -19.810 25 HG22 THR 2 1HG2 THR 2 -7.293 1.927 -21.034 26 HG23 THR 2 2HG2 THR 2 -5.813 1.305 -20.298 27 H VAL 3 H VAL 3 -5.361 -1.731 -18.800 28 HA VAL 3 HA VAL 3 -7.932 -3.014 -18.122 29 HB VAL 3 HB VAL 3 -5.292 -3.368 -16.690 30 HG11 VAL 3 1HG1 VAL 3 -7.198 -3.805 -15.293 31 HG12 VAL 3 2HG1 VAL 3 -6.363 -5.318 -15.742 32 HG13 VAL 3 3HG1 VAL 3 -7.857 -4.877 -16.543 33 HG21 VAL 3 3HG2 VAL 3 -6.559 -5.255 -18.665 34 HG22 VAL 3 1HG2 VAL 3 -5.178 -5.581 -17.617 35 HG23 VAL 3 2HG2 VAL 3 -5.045 -4.351 -18.887 36 H TYR 4 H TYR 4 -9.090 -2.093 -16.496 37 HA TYR 4 HA TYR 4 -7.849 0.146 -15.116 38 HB2 TYR 4 2HB TYR 4 -10.768 -0.580 -15.438 39 HB3 TYR 4 1HB TYR 4 -10.119 0.854 -14.634 40 HD1 TYR 4 2HD TYR 4 -10.606 -0.777 -17.913 41 HD2 TYR 4 1HD TYR 4 -9.319 2.723 -15.893 42 HE1 TYR 4 2HE TYR 4 -10.604 0.436 -20.037 43 HE2 TYR 4 1HE TYR 4 -9.313 3.955 -18.011 44 HH TYR 4 HH TYR 4 -10.778 2.766 -20.797 45 H ILE 5 H ILE 5 -7.366 -0.039 -13.064 46 HA ILE 5 HA ILE 5 -8.308 -2.386 -11.516 47 HB ILE 5 HB ILE 5 -5.969 -0.570 -10.884 48 HG12 ILE 5 2HG1 ILE 5 -4.431 -2.271 -11.369 49 HG13 ILE 5 1HG1 ILE 5 -5.571 -3.472 -11.822 50 HG21 ILE 5 1HG2 ILE 5 -6.950 -1.581 -8.926 51 HG22 ILE 5 2HG2 ILE 5 -5.338 -2.250 -9.208 52 HG23 ILE 5 3HG2 ILE 5 -6.767 -3.178 -9.639 53 HD11 ILE 5 3HD1 ILE 5 -4.743 -0.967 -13.317 54 HD12 ILE 5 1HD1 ILE 5 -6.101 -1.967 -13.824 55 HD13 ILE 5 2HD1 ILE 5 -4.475 -2.644 -13.791 56 H CYS 6 H CYS 6 -9.873 -1.835 -10.059 57 HA CYS 6 HA CYS 6 -9.445 0.638 -8.595 58 HB2 CYS 6 2HB CYS 6 -11.490 0.953 -9.936 59 HB3 CYS 6 1HB CYS 6 -12.137 -0.563 -9.317 60 HG CYS 6 HG CYS 6 -12.863 2.260 -8.269 61 HA PRO 7 HA PRO 7 -9.000 -2.871 -5.746 62 HB2 PRO 7 2HB PRO 7 -7.348 -1.635 -4.015 63 HB3 PRO 7 1HB PRO 7 -6.776 -2.241 -5.573 64 HG2 PRO 7 2HG PRO 7 -7.531 0.553 -4.797 65 HG3 PRO 7 1HG PRO 7 -6.121 -0.004 -5.718 66 HD2 PRO 7 2HD PRO 7 -8.334 1.033 -6.882 67 HD3 PRO 7 1HD PRO 7 -7.317 -0.189 -7.673 68 H GLU 8 H GLU 8 -11.063 -0.641 -5.701 69 HA GLU 8 HA GLU 8 -11.512 -0.515 -2.794 70 HB2 GLU 8 2HB GLU 8 -12.602 1.374 -4.858 71 HB3 GLU 8 1HB GLU 8 -12.628 1.551 -3.111 72 HG2 GLU 8 2HG GLU 8 -10.127 1.609 -3.186 73 HG3 GLU 8 1HG GLU 8 -10.347 1.616 -4.951 74 H THR 9 H THR 9 -13.216 -0.460 -5.923 75 HA THR 9 HA THR 9 -15.301 -2.008 -4.625 76 HB THR 9 HB THR 9 -16.058 0.240 -4.541 77 HG1 THR 9 1HG THR 9 -17.466 -0.796 -6.757 78 HG21 THR 9 3HG2 THR 9 -14.619 1.184 -6.243 79 HG22 THR 9 1HG2 THR 9 -16.300 1.662 -6.514 80 HG23 THR 9 2HG2 THR 9 -15.557 0.403 -7.510 81 H GLY 10 H GLY 10 -13.095 -2.226 -7.069 82 HA2 GLY 10 2HA GLY 10 -15.048 -3.454 -8.827 83 HA3 GLY 10 1HA GLY 10 -13.394 -3.395 -9.311 84 H ASP 11 H ASP 11 -12.938 -5.508 -9.585 85 HA ASP 11 HA ASP 11 -12.622 -7.283 -7.476 86 HB2 ASP 11 2HB ASP 11 -15.106 -7.436 -7.541 87 HB3 ASP 11 1HB ASP 11 -14.989 -7.999 -9.211 88 H ASP 12 H ASP 12 -11.124 -8.624 -8.108 89 HA ASP 12 HA ASP 12 -10.100 -8.595 -10.711 90 HB2 ASP 12 2HB ASP 12 -9.609 -10.635 -8.566 91 HB3 ASP 12 1HB ASP 12 -8.730 -10.591 -10.089 92 H GLY 13 H GLY 13 -12.865 -10.348 -9.736 93 HA2 GLY 13 2HA GLY 13 -12.521 -12.464 -11.615 94 HA3 GLY 13 1HA GLY 13 -13.996 -12.054 -10.741 95 H ASN 14 H ASN 14 -13.254 -9.251 -11.822 96 HA ASN 14 HA ASN 14 -15.171 -9.223 -13.933 97 HB2 ASN 14 2HB ASN 14 -13.392 -7.127 -12.747 98 HB3 ASN 14 1HB ASN 14 -14.465 -6.753 -14.072 99 HD21 ASN 14 1HD2 ASN 14 -14.424 -5.663 -11.428 100 HD22 ASN 14 2HD2 ASN 14 -15.956 -6.037 -10.700 101 H ASP 15 H ASP 15 -14.581 -7.745 -15.886 102 HA ASP 15 HA ASP 15 -12.613 -9.191 -17.441 103 HB2 ASP 15 2HB ASP 15 -14.489 -6.942 -18.178 104 HB3 ASP 15 1HB ASP 15 -13.394 -7.718 -19.310 105 H GLY 16 H GLY 16 -12.531 -6.493 -15.492 106 HA2 GLY 16 2HA GLY 16 -10.880 -5.016 -15.067 107 HA3 GLY 16 1HA GLY 16 -9.917 -5.732 -16.354 108 H SER 17 H SER 17 -13.045 -4.676 -17.109 109 HA SER 17 HA SER 17 -12.077 -2.537 -18.784 110 HB2 SER 17 2HB SER 17 -14.909 -3.384 -18.121 111 HB3 SER 17 1HB SER 17 -14.384 -2.395 -19.489 112 HG SER 17 HG SER 17 -13.060 -4.285 -20.073 113 H GLU 18 H GLU 18 -13.557 -0.306 -18.511 114 HA GLU 18 HA GLU 18 -12.851 0.661 -16.014 115 HB2 GLU 18 2HB GLU 18 -12.970 2.096 -17.974 116 HB3 GLU 18 1HB GLU 18 -14.701 1.793 -18.099 117 HG2 GLU 18 2HG GLU 18 -15.041 2.895 -15.945 118 HG3 GLU 18 1HG GLU 18 -13.288 3.151 -15.896 119 H LEU 19 H LEU 19 -15.923 -0.445 -17.396 120 HA LEU 19 HA LEU 19 -17.496 0.293 -15.159 121 HB2 LEU 19 2HB LEU 19 -18.078 -1.595 -17.430 122 HB3 LEU 19 1HB LEU 19 -19.235 -1.145 -16.204 123 HG LEU 19 HG LEU 19 -19.721 0.041 -18.124 124 HD11 LEU 19 1HD1 LEU 19 -20.020 1.307 -16.116 125 HD12 LEU 19 2HD1 LEU 19 -19.557 2.385 -17.433 126 HD13 LEU 19 3HD1 LEU 19 -18.368 1.919 -16.219 127 HD21 LEU 19 3HD2 LEU 19 -17.649 -0.074 -19.370 128 HD22 LEU 19 1HD2 LEU 19 -16.877 1.035 -18.235 129 HD23 LEU 19 2HD2 LEU 19 -18.179 1.603 -19.278 130 H LYS 20 H LYS 20 -15.395 -2.281 -15.776 131 HA LYS 20 HA LYS 20 -16.258 -3.769 -13.315 132 HB2 LYS 20 2HB LYS 20 -15.169 -5.243 -15.667 133 HB3 LYS 20 1HB LYS 20 -16.172 -5.811 -14.355 134 HG2 LYS 20 2HG LYS 20 -18.152 -4.848 -15.382 135 HG3 LYS 20 1HG LYS 20 -17.166 -4.211 -16.704 136 HD2 LYS 20 2HD LYS 20 -16.403 -6.581 -17.118 137 HD3 LYS 20 1HD LYS 20 -17.658 -7.092 -15.997 138 HE2 LYS 20 2HE LYS 20 -19.344 -6.025 -17.440 139 HE3 LYS 20 1HE LYS 20 -18.062 -5.568 -18.562 140 HZ1 LYS 20 3HZ LYS 20 -19.001 -7.570 -19.389 141 HZ2 LYS 20 1HZ LYS 20 -19.021 -8.264 -17.874 142 HZ3 LYS 20 2HZ LYS 20 -17.543 -8.059 -18.652 143 HA PRO 21 HA PRO 21 -11.872 -2.730 -13.674 144 HB2 PRO 21 2HB PRO 21 -11.577 -1.516 -11.280 145 HB3 PRO 21 1HB PRO 21 -12.103 -0.654 -12.728 146 HG2 PRO 21 2HG PRO 21 -13.718 -1.636 -10.423 147 HG3 PRO 21 1HG PRO 21 -13.904 -0.155 -11.377 148 HD2 PRO 21 2HD PRO 21 -15.423 -2.434 -11.705 149 HD3 PRO 21 1HD PRO 21 -15.168 -1.201 -12.953 150 H LEU 22 H LEU 22 -10.205 -3.761 -12.679 151 HA LEU 22 HA LEU 22 -10.899 -6.087 -11.099 152 HB2 LEU 22 2HB LEU 22 -8.202 -5.022 -11.913 153 HB3 LEU 22 1HB LEU 22 -8.538 -6.618 -11.269 154 HG LEU 22 HG LEU 22 -9.456 -5.554 -13.920 155 HD11 LEU 22 1HD1 LEU 22 -7.943 -7.233 -14.821 156 HD12 LEU 22 2HD1 LEU 22 -7.390 -7.578 -13.179 157 HD13 LEU 22 3HD1 LEU 22 -7.126 -5.987 -13.873 158 HD21 LEU 22 3HD2 LEU 22 -9.822 -8.297 -12.714 159 HD22 LEU 22 1HD2 LEU 22 -10.261 -7.812 -14.348 160 HD23 LEU 22 2HD2 LEU 22 -11.095 -7.103 -12.970 161 H ARG 23 H ARG 23 -9.067 -6.412 -9.256 162 HA ARG 23 HA ARG 23 -8.894 -3.910 -7.967 163 HB2 ARG 23 2HB ARG 23 -9.486 -5.279 -5.725 164 HB3 ARG 23 1HB ARG 23 -10.685 -4.334 -6.645 165 HG2 ARG 23 2HG ARG 23 -11.645 -6.272 -6.053 166 HG3 ARG 23 1HG ARG 23 -10.981 -6.571 -7.664 167 HD2 ARG 23 2HD ARG 23 -9.225 -7.892 -6.807 168 HD3 ARG 23 1HD ARG 23 -9.592 -7.415 -5.135 169 HE ARG 23 HE ARG 23 -11.919 -8.437 -5.939 170 HH11 ARG 23 1HH1 ARG 23 -8.701 -9.871 -6.145 171 HH12 ARG 23 2HH1 ARG 23 -9.268 -11.467 -5.935 172 HH21 ARG 23 1HH2 ARG 23 -12.690 -10.543 -5.790 173 HH22 ARG 23 2HH2 ARG 23 -11.658 -11.887 -5.751 174 H THR 24 H THR 24 -7.111 -6.349 -8.950 175 HA THR 24 HA THR 24 -5.017 -5.264 -7.274 176 HB THR 24 HB THR 24 -3.803 -7.445 -7.431 177 HG1 THR 24 1HG THR 24 -6.270 -8.581 -8.175 178 HG21 THR 24 3HG2 THR 24 -5.104 -8.674 -5.736 179 HG22 THR 24 1HG2 THR 24 -6.497 -7.646 -6.071 180 HG23 THR 24 2HG2 THR 24 -5.035 -6.948 -5.377 181 H LEU 25 H LEU 25 -2.997 -5.121 -8.390 182 HA LEU 25 HA LEU 25 -3.292 -4.575 -11.187 183 HB2 LEU 25 2HB LEU 25 -1.832 -3.249 -9.713 184 HB3 LEU 25 1HB LEU 25 -0.839 -4.658 -9.419 185 HG LEU 25 HG LEU 25 -0.085 -4.636 -11.743 186 HD11 LEU 25 1HD1 LEU 25 -2.119 -3.740 -12.790 187 HD12 LEU 25 2HD1 LEU 25 -0.702 -2.804 -13.241 188 HD13 LEU 25 3HD1 LEU 25 -1.820 -2.172 -12.043 189 HD21 LEU 25 3HD2 LEU 25 1.182 -2.524 -11.632 190 HD22 LEU 25 1HD2 LEU 25 1.129 -3.355 -10.070 191 HD23 LEU 25 2HD2 LEU 25 0.086 -1.970 -10.369 192 H TYR 26 H TYR 26 -2.422 -7.145 -9.230 193 HA TYR 26 HA TYR 26 -0.892 -8.844 -10.783 194 HB2 TYR 26 2HB TYR 26 -1.286 -9.179 -8.434 195 HB3 TYR 26 1HB TYR 26 -3.009 -9.361 -8.706 196 HD1 TYR 26 1HD TYR 26 0.144 -10.865 -9.976 197 HD2 TYR 26 2HD TYR 26 -3.794 -11.496 -8.533 198 HE1 TYR 26 1HE TYR 26 0.493 -13.238 -10.133 199 HE2 TYR 26 2HE TYR 26 -3.473 -13.917 -8.704 200 HH TYR 26 HH TYR 26 -0.413 -15.309 -9.221 201 H GLN 27 H GLN 27 -4.473 -8.685 -10.528 202 HA GLN 27 HA GLN 27 -4.904 -10.759 -12.392 203 HB2 GLN 27 2HB GLN 27 -6.620 -10.148 -10.805 204 HB3 GLN 27 1HB GLN 27 -6.743 -8.539 -11.487 205 HG2 GLN 27 2HG GLN 27 -8.637 -9.897 -12.183 206 HG3 GLN 27 1HG GLN 27 -7.663 -9.505 -13.574 207 HE21 GLN 27 1HE2 GLN 27 -8.450 -11.158 -14.716 208 HE22 GLN 27 2HE2 GLN 27 -8.063 -12.813 -14.483 209 H ALA 28 H ALA 28 -4.439 -7.317 -12.814 210 HA ALA 28 HA ALA 28 -5.289 -7.043 -15.422 211 HB1 ALA 28 1HB ALA 28 -4.725 -5.213 -13.868 212 HB2 ALA 28 2HB ALA 28 -3.925 -5.027 -15.424 213 HB3 ALA 28 3HB ALA 28 -3.023 -5.611 -14.018 214 H MET 29 H MET 29 -2.172 -8.103 -14.095 215 HA MET 29 HA MET 29 -0.919 -8.437 -16.595 216 HB2 MET 29 2HB MET 29 -0.332 -9.341 -13.818 217 HB3 MET 29 1HB MET 29 0.613 -9.936 -15.164 218 HG2 MET 29 2HG MET 29 0.251 -7.031 -14.474 219 HG3 MET 29 1HG MET 29 1.661 -7.998 -14.017 220 HE1 MET 29 3HE MET 29 3.336 -6.376 -15.067 221 HE2 MET 29 1HE MET 29 1.945 -5.349 -15.321 222 HE3 MET 29 2HE MET 29 3.100 -5.589 -16.637 223 H ILE 30 H ILE 30 -2.897 -10.471 -14.587 224 HA ILE 30 HA ILE 30 -2.258 -12.946 -15.789 225 HB ILE 30 HB ILE 30 -4.865 -12.140 -14.468 226 HG12 ILE 30 2HG1 ILE 30 -2.415 -13.486 -13.291 227 HG13 ILE 30 1HG1 ILE 30 -2.943 -11.838 -12.981 228 HG21 ILE 30 1HG2 ILE 30 -5.205 -14.537 -14.091 229 HG22 ILE 30 2HG2 ILE 30 -3.735 -14.890 -14.989 230 HG23 ILE 30 3HG2 ILE 30 -5.119 -14.168 -15.817 231 HD11 ILE 30 3HD1 ILE 30 -4.969 -12.707 -11.935 232 HD12 ILE 30 1HD1 ILE 30 -3.507 -13.341 -11.171 233 HD13 ILE 30 2HD1 ILE 30 -4.419 -14.343 -12.292 234 H ILE 31 H ILE 31 -4.783 -10.600 -16.442 235 HA ILE 31 HA ILE 31 -6.057 -12.082 -18.468 236 HB ILE 31 HB ILE 31 -6.146 -9.098 -17.999 237 HG12 ILE 31 2HG1 ILE 31 -7.888 -11.333 -16.943 238 HG13 ILE 31 1HG1 ILE 31 -6.790 -10.317 -16.011 239 HG21 ILE 31 1HG2 ILE 31 -6.950 -9.799 -20.192 240 HG22 ILE 31 2HG2 ILE 31 -8.290 -9.256 -19.150 241 HG23 ILE 31 3HG2 ILE 31 -7.995 -10.987 -19.393 242 HD11 ILE 31 3HD1 ILE 31 -8.147 -8.373 -16.543 243 HD12 ILE 31 1HD1 ILE 31 -9.091 -9.626 -15.719 244 HD13 ILE 31 2HD1 ILE 31 -9.231 -9.411 -17.468 245 H THR 32 H THR 32 -3.606 -9.496 -18.515 246 HA THR 32 HA THR 32 -3.791 -9.329 -21.374 247 HB THR 32 HB THR 32 -2.129 -7.513 -21.150 248 HG1 THR 32 1HG THR 32 -2.392 -7.631 -18.353 249 HG21 THR 32 3HG2 THR 32 -4.438 -7.298 -19.186 250 HG22 THR 32 1HG2 THR 32 -4.550 -7.024 -20.926 251 HG23 THR 32 2HG2 THR 32 -3.577 -5.961 -19.909 252 H LYS 33 H LYS 33 -1.403 -10.469 -18.926 253 HA LYS 33 HA LYS 33 0.538 -11.423 -19.021 254 HB2 LYS 33 2HB LYS 33 -0.971 -13.132 -20.114 255 HB3 LYS 33 1HB LYS 33 -0.393 -12.545 -21.667 256 HG2 LYS 33 2HG LYS 33 1.903 -13.079 -20.934 257 HG3 LYS 33 1HG LYS 33 1.212 -13.801 -19.486 258 HD2 LYS 33 2HD LYS 33 0.653 -14.685 -22.321 259 HD3 LYS 33 1HD LYS 33 1.707 -15.522 -21.181 260 HE2 LYS 33 2HE LYS 33 -0.226 -15.868 -19.688 261 HE3 LYS 33 1HE LYS 33 -1.259 -15.056 -20.858 262 HZ1 LYS 33 3HZ LYS 33 0.238 -17.569 -21.349 263 HZ2 LYS 33 1HZ LYS 33 -0.806 -16.799 -22.444 264 HZ3 LYS 33 2HZ LYS 33 -1.399 -17.441 -21.005 265 H SER 34 H SER 34 0.186 -8.782 -20.294 266 HA SER 34 HA SER 34 1.975 -8.914 -22.621 267 HB2 SER 34 2HB SER 34 -0.125 -7.687 -22.899 268 HB3 SER 34 1HB SER 34 0.307 -6.621 -21.570 269 HG SER 34 HG SER 34 1.227 -6.724 -24.177 270 H SER 35 H SER 35 2.027 -7.940 -19.305 271 HA SER 35 HA SER 35 3.583 -7.047 -17.940 272 HB2 SER 35 2HB SER 35 5.529 -7.887 -20.097 273 HB3 SER 35 1HB SER 35 5.879 -7.639 -18.381 274 HG SER 35 HG SER 35 5.085 -9.534 -17.944 275 H LYS 36 H LYS 36 2.588 -5.306 -20.361 276 HA LYS 36 HA LYS 36 4.238 -2.975 -19.887 277 HB2 LYS 36 2HB LYS 36 5.022 -2.701 -22.206 278 HB3 LYS 36 1HB LYS 36 5.696 -4.133 -21.435 279 HG2 LYS 36 2HG LYS 36 4.024 -5.515 -22.564 280 HG3 LYS 36 1HG LYS 36 3.381 -4.077 -23.346 281 HD2 LYS 36 2HD LYS 36 5.451 -3.748 -24.529 282 HD3 LYS 36 1HD LYS 36 6.196 -5.097 -23.658 283 HE2 LYS 36 2HE LYS 36 5.476 -5.816 -25.870 284 HE3 LYS 36 1HE LYS 36 4.561 -6.607 -24.578 285 HZ1 LYS 36 3HZ LYS 36 3.583 -4.294 -26.172 286 HZ2 LYS 36 1HZ LYS 36 2.699 -5.110 -25.000 287 HZ3 LYS 36 2HZ LYS 36 3.127 -5.885 -26.408 288 H GLY 37 H GLY 37 1.310 -4.190 -20.443 289 HA2 GLY 37 2HA GLY 37 0.298 -2.517 -22.530 290 HA3 GLY 37 1HA GLY 37 -0.636 -3.529 -21.446 291 H ASP 38 H ASP 38 -2.002 -1.464 -21.690 292 HA ASP 38 HA ASP 38 -1.084 0.666 -19.967 293 HB2 ASP 38 2HB ASP 38 -3.667 0.320 -21.509 294 HB3 ASP 38 1HB ASP 38 -3.276 1.723 -20.521 295 H PHE 39 H PHE 39 -1.274 0.393 -17.898 296 HA PHE 39 HA PHE 39 -3.630 -1.038 -16.921 297 HB2 PHE 39 2HB PHE 39 -0.880 -0.873 -15.665 298 HB3 PHE 39 1HB PHE 39 -2.264 -1.733 -15.003 299 HD1 PHE 39 1HD PHE 39 -3.264 -3.568 -16.470 300 HD2 PHE 39 2HD PHE 39 0.616 -1.990 -17.054 301 HE1 PHE 39 1HE PHE 39 -2.630 -5.603 -17.719 302 HE2 PHE 39 2HE PHE 39 1.264 -3.999 -18.308 303 HZ PHE 39 HZ PHE 39 -0.360 -5.814 -18.639 304 H LEU 40 H LEU 40 -4.985 0.368 -16.135 305 HA LEU 40 HA LEU 40 -3.879 2.858 -15.033 306 HB2 LEU 40 2HB LEU 40 -6.625 2.423 -16.223 307 HB3 LEU 40 1HB LEU 40 -5.901 3.908 -15.632 308 HG LEU 40 HG LEU 40 -4.954 2.400 -18.069 309 HD11 LEU 40 1HD1 LEU 40 -6.558 4.934 -17.848 310 HD12 LEU 40 2HD1 LEU 40 -7.137 3.377 -18.440 311 HD13 LEU 40 3HD1 LEU 40 -5.899 4.263 -19.336 312 HD21 LEU 40 3HD2 LEU 40 -3.164 3.644 -16.997 313 HD22 LEU 40 1HD2 LEU 40 -4.167 5.090 -16.962 314 HD23 LEU 40 2HD2 LEU 40 -3.637 4.422 -18.507 315 H ILE 41 H ILE 41 -4.177 3.141 -12.974 316 HA ILE 41 HA ILE 41 -6.164 1.472 -11.645 317 HB ILE 41 HB ILE 41 -3.623 2.665 -10.476 318 HG12 ILE 41 2HG1 ILE 41 -4.299 -0.134 -11.471 319 HG13 ILE 41 1HG1 ILE 41 -3.036 0.939 -11.985 320 HG21 ILE 41 1HG2 ILE 41 -5.671 0.797 -9.277 321 HG22 ILE 41 2HG2 ILE 41 -5.407 2.479 -8.834 322 HG23 ILE 41 3HG2 ILE 41 -4.153 1.272 -8.495 323 HD11 ILE 41 3HD1 ILE 41 -1.754 0.541 -10.021 324 HD12 ILE 41 1HD1 ILE 41 -2.395 -1.033 -10.618 325 HD13 ILE 41 2HD1 ILE 41 -3.145 -0.253 -9.259 326 H ARG 42 H ARG 42 -7.606 2.358 -10.328 327 HA ARG 42 HA ARG 42 -8.309 5.071 -10.744 328 HB2 ARG 42 2HB ARG 42 -9.834 3.094 -10.187 329 HB3 ARG 42 1HB ARG 42 -9.329 3.332 -8.521 330 HG2 ARG 42 2HG ARG 42 -11.424 4.497 -8.785 331 HG3 ARG 42 1HG ARG 42 -10.137 5.663 -8.693 332 HD2 ARG 42 2HD ARG 42 -10.322 6.348 -10.798 333 HD3 ARG 42 1HD ARG 42 -10.894 4.775 -11.447 334 HE ARG 42 HE ARG 42 -12.799 5.914 -9.774 335 HH11 ARG 42 1HH1 ARG 42 -11.335 6.555 -12.944 336 HH12 ARG 42 2HH1 ARG 42 -12.641 7.454 -13.525 337 HH21 ARG 42 1HH2 ARG 42 -14.583 7.163 -10.565 338 HH22 ARG 42 2HH2 ARG 42 -14.540 7.833 -12.126 339 H THR 43 H THR 43 -7.640 6.707 -9.734 340 HA THR 43 HA THR 43 -6.399 6.484 -7.106 341 HB THR 43 HB THR 43 -4.601 6.412 -8.824 342 HG1 THR 43 1HG THR 43 -4.250 7.401 -6.801 343 HG21 THR 43 3HG2 THR 43 -5.585 9.169 -9.553 344 HG22 THR 43 1HG2 THR 43 -5.650 7.733 -10.574 345 HG23 THR 43 2HG2 THR 43 -4.088 8.436 -10.134 346 H LYS 44 H LYS 44 -6.321 8.585 -6.000 347 HA LYS 44 HA LYS 44 -8.569 10.212 -6.938 348 HB2 LYS 44 2HB LYS 44 -7.490 9.867 -4.142 349 HB3 LYS 44 1HB LYS 44 -8.806 10.942 -4.589 350 HG2 LYS 44 2HG LYS 44 -10.120 9.049 -5.312 351 HG3 LYS 44 1HG LYS 44 -8.804 7.953 -4.873 352 HD2 LYS 44 2HD LYS 44 -8.994 8.714 -2.540 353 HD3 LYS 44 1HD LYS 44 -10.333 9.766 -3.006 354 HE2 LYS 44 2HE LYS 44 -11.163 7.686 -2.026 355 HE3 LYS 44 1HE LYS 44 -11.614 7.815 -3.724 356 HZ1 LYS 44 3HZ LYS 44 -10.774 5.571 -3.149 357 HZ2 LYS 44 1HZ LYS 44 -9.306 6.249 -2.710 358 HZ3 LYS 44 2HZ LYS 44 -9.821 6.336 -4.303 359 H LYS 45 H LYS 45 -8.084 12.020 -7.728 360 HA LYS 45 HA LYS 45 -5.852 13.574 -6.677 361 HB2 LYS 45 2HB LYS 45 -6.493 13.043 -9.563 362 HB3 LYS 45 1HB LYS 45 -5.379 14.289 -9.124 363 HG2 LYS 45 2HG LYS 45 -3.987 12.523 -8.034 364 HG3 LYS 45 1HG LYS 45 -5.084 11.335 -8.753 365 HD2 LYS 45 2HD LYS 45 -3.275 11.587 -10.324 366 HD3 LYS 45 1HD LYS 45 -4.724 12.466 -10.880 367 HE2 LYS 45 2HE LYS 45 -2.650 13.755 -11.246 368 HE3 LYS 45 1HE LYS 45 -3.826 14.579 -10.240 369 HZ1 LYS 45 3HZ LYS 45 -2.511 13.866 -8.287 370 HZ2 LYS 45 1HZ LYS 45 -1.636 14.825 -9.336 371 HZ3 LYS 45 2HZ LYS 45 -1.384 13.166 -9.325 372 H ASP 46 H ASP 46 -6.511 15.496 -6.127 373 HA ASP 46 HA ASP 46 -7.671 17.411 -5.918 374 HB2 ASP 46 2HB ASP 46 -8.386 16.792 -8.785 375 HB3 ASP 46 1HB ASP 46 -8.842 18.291 -7.980 376 H GLY 47 H GLY 47 -8.884 14.925 -5.136 377 HA2 GLY 47 2HA GLY 47 -10.829 14.550 -3.910 378 HA3 GLY 47 1HA GLY 47 -11.508 16.006 -4.613 379 H LYS 48 H LYS 48 -10.251 13.997 -7.005 380 HA LYS 48 HA LYS 48 -12.839 12.674 -7.394 381 HB2 LYS 48 2HB LYS 48 -11.173 14.036 -9.522 382 HB3 LYS 48 1HB LYS 48 -12.603 13.057 -9.824 383 HG2 LYS 48 2HG LYS 48 -13.961 14.642 -8.582 384 HG3 LYS 48 1HG LYS 48 -12.535 15.624 -8.254 385 HD2 LYS 48 2HD LYS 48 -12.253 15.976 -10.674 386 HD3 LYS 48 1HD LYS 48 -13.697 15.004 -10.968 387 HE2 LYS 48 2HE LYS 48 -13.596 17.570 -9.384 388 HE3 LYS 48 1HE LYS 48 -14.184 17.417 -11.037 389 HZ1 LYS 48 3HZ LYS 48 -15.941 15.951 -10.215 390 HZ2 LYS 48 1HZ LYS 48 -16.001 17.443 -9.471 391 HZ3 LYS 48 2HZ LYS 48 -15.397 16.120 -8.629 392 H GLN 49 H GLN 49 -12.731 10.656 -8.542 393 HA GLN 49 HA GLN 49 -10.163 9.407 -8.291 394 HB2 GLN 49 2HB GLN 49 -12.930 8.338 -8.839 395 HB3 GLN 49 1HB GLN 49 -11.496 7.346 -8.887 396 HG2 GLN 49 2HG GLN 49 -12.649 6.973 -6.843 397 HG3 GLN 49 1HG GLN 49 -11.151 7.810 -6.476 398 HE21 GLN 49 1HE2 GLN 49 -14.580 7.981 -6.598 399 HE22 GLN 49 2HE2 GLN 49 -14.793 9.392 -5.648 400 H VAL 50 H VAL 50 -9.015 8.881 -9.971 401 HA VAL 50 HA VAL 50 -10.138 9.128 -12.661 402 HB VAL 50 HB VAL 50 -8.079 10.284 -13.449 403 HG11 VAL 50 1HG1 VAL 50 -8.540 12.511 -12.526 404 HG12 VAL 50 2HG1 VAL 50 -9.501 11.772 -11.247 405 HG13 VAL 50 3HG1 VAL 50 -10.024 11.647 -12.925 406 HG21 VAL 50 3HG2 VAL 50 -6.515 11.288 -11.835 407 HG22 VAL 50 1HG2 VAL 50 -6.539 9.531 -11.692 408 HG23 VAL 50 2HG2 VAL 50 -7.396 10.517 -10.516 409 H TRP 51 H TRP 51 -8.433 8.219 -14.261 410 HA TRP 51 HA TRP 51 -7.365 5.772 -13.078 411 HB2 TRP 51 2HB TRP 51 -8.016 6.524 -15.911 412 HB3 TRP 51 1HB TRP 51 -7.366 4.981 -15.490 413 HD1 TRP 51 HD TRP 51 -10.369 6.550 -16.284 414 HE1 TRP 51 1HE TRP 51 -12.435 5.183 -15.564 415 HE3 TRP 51 3HE TRP 51 -8.073 3.426 -13.038 416 HZ2 TRP 51 2HZ TRP 51 -12.986 3.026 -13.794 417 HZ3 TRP 51 3HZ TRP 51 -9.417 1.724 -11.862 418 HH2 TRP 51 HH TRP 51 -11.822 1.536 -12.231 419 H GLU 52 H GLU 52 -5.205 5.828 -12.713 420 HA GLU 52 HA GLU 52 -3.590 7.299 -14.657 421 HB2 GLU 52 2HB GLU 52 -3.576 8.465 -12.505 422 HB3 GLU 52 1HB GLU 52 -3.080 6.987 -11.693 423 HG2 GLU 52 2HG GLU 52 -1.191 8.499 -11.988 424 HG3 GLU 52 1HG GLU 52 -1.001 6.999 -12.903 425 H ALA 53 H ALA 53 -1.706 6.346 -15.299 426 HA ALA 53 HA ALA 53 -1.831 3.517 -15.432 427 HB1 ALA 53 1HB ALA 53 0.350 5.365 -16.370 428 HB2 ALA 53 2HB ALA 53 -1.061 4.879 -17.309 429 HB3 ALA 53 3HB ALA 53 0.137 3.677 -16.833 430 H ALA 54 H ALA 54 -0.572 2.046 -14.639 431 HA ALA 54 HA ALA 54 0.749 2.528 -12.162 432 HB1 ALA 54 1HB ALA 54 0.676 0.037 -13.862 433 HB2 ALA 54 2HB ALA 54 -0.461 0.440 -12.572 434 HB3 ALA 54 3HB ALA 54 1.230 0.120 -12.188 435 H SER 55 H SER 55 3.002 1.440 -11.913 436 HA SER 55 HA SER 55 4.734 2.752 -13.892 437 HB2 SER 55 2HB SER 55 5.323 1.887 -11.047 438 HB3 SER 55 1HB SER 55 6.398 2.812 -12.092 439 HG SER 55 HG SER 55 3.963 3.936 -11.954 440 H LYS 56 H LYS 56 6.487 1.549 -14.754 441 HA LYS 56 HA LYS 56 5.903 -1.189 -15.102 442 HB2 LYS 56 2HB LYS 56 8.256 0.464 -15.984 443 HB3 LYS 56 1HB LYS 56 8.221 -1.271 -16.253 444 HG2 LYS 56 2HG LYS 56 7.514 -0.048 -18.244 445 HG3 LYS 56 1HG LYS 56 6.200 -1.031 -17.615 446 HD2 LYS 56 2HD LYS 56 5.247 0.974 -16.549 447 HD3 LYS 56 1HD LYS 56 6.558 1.939 -17.224 448 HE2 LYS 56 2HE LYS 56 4.528 0.376 -18.831 449 HE3 LYS 56 1HE LYS 56 4.468 2.108 -18.536 450 HZ1 LYS 56 3HZ LYS 56 6.616 0.678 -20.014 451 HZ2 LYS 56 1HZ LYS 56 6.567 2.336 -19.737 452 HZ3 LYS 56 2HZ LYS 56 5.399 1.614 -20.698 453 H THR 57 H THR 57 7.876 0.436 -12.838 454 HA THR 57 HA THR 57 9.347 -1.766 -11.921 455 HB THR 57 HB THR 57 9.441 -0.351 -9.807 456 HG1 THR 57 1HG THR 57 8.353 1.501 -9.761 457 HG21 THR 57 3HG2 THR 57 10.176 0.962 -12.428 458 HG22 THR 57 1HG2 THR 57 11.167 -0.209 -11.555 459 HG23 THR 57 2HG2 THR 57 10.847 1.378 -10.853 460 H ALA 58 H ALA 58 6.310 -0.304 -10.880 461 HA ALA 58 HA ALA 58 5.704 -2.203 -8.839 462 HB1 ALA 58 1HB ALA 58 3.831 -0.359 -10.333 463 HB2 ALA 58 2HB ALA 58 4.743 0.060 -8.885 464 HB3 ALA 58 3HB ALA 58 3.487 -1.173 -8.807 465 H LEU 59 H LEU 59 4.850 -1.915 -12.223 466 HA LEU 59 HA LEU 59 3.068 -4.034 -12.453 467 HB2 LEU 59 2HB LEU 59 4.995 -2.735 -14.307 468 HB3 LEU 59 1HB LEU 59 3.935 -4.070 -14.861 469 HG LEU 59 HG LEU 59 3.081 -1.356 -13.798 470 HD11 LEU 59 1HD1 LEU 59 4.176 -1.175 -16.006 471 HD12 LEU 59 2HD1 LEU 59 2.440 -0.906 -16.128 472 HD13 LEU 59 3HD1 LEU 59 3.123 -2.453 -16.617 473 HD21 LEU 59 3HD2 LEU 59 0.886 -1.982 -14.525 474 HD22 LEU 59 1HD2 LEU 59 1.487 -3.244 -13.442 475 HD23 LEU 59 2HD2 LEU 59 1.513 -3.492 -15.183 476 H LYS 60 H LYS 60 6.562 -3.994 -12.259 477 HA LYS 60 HA LYS 60 6.950 -6.634 -13.149 478 HB2 LYS 60 2HB LYS 60 8.824 -5.062 -13.006 479 HB3 LYS 60 1HB LYS 60 8.688 -5.032 -11.235 480 HG2 LYS 60 2HG LYS 60 10.525 -6.380 -11.929 481 HG3 LYS 60 1HG LYS 60 9.264 -7.426 -11.271 482 HD2 LYS 60 2HD LYS 60 8.498 -7.902 -13.567 483 HD3 LYS 60 1HD LYS 60 9.814 -6.903 -14.191 484 HE2 LYS 60 2HE LYS 60 10.102 -9.259 -12.433 485 HE3 LYS 60 1HE LYS 60 10.278 -9.329 -14.205 486 HZ1 LYS 60 3HZ LYS 60 12.166 -7.777 -13.950 487 HZ2 LYS 60 1HZ LYS 60 12.428 -9.212 -13.096 488 HZ3 LYS 60 2HZ LYS 60 11.993 -7.819 -12.274 489 H LYS 61 H LYS 61 6.129 -5.258 -10.018 490 HA LYS 61 HA LYS 61 6.466 -7.698 -8.588 491 HB2 LYS 61 2HB LYS 61 4.999 -5.163 -7.843 492 HB3 LYS 61 1HB LYS 61 5.015 -6.571 -6.798 493 HG2 LYS 61 2HG LYS 61 6.647 -4.988 -6.021 494 HG3 LYS 61 1HG LYS 61 7.492 -6.383 -6.679 495 HD2 LYS 61 2HD LYS 61 7.918 -5.147 -8.742 496 HD3 LYS 61 1HD LYS 61 7.045 -3.760 -8.096 497 HE2 LYS 61 2HE LYS 61 8.683 -3.606 -6.273 498 HE3 LYS 61 1HE LYS 61 9.568 -4.966 -6.964 499 HZ1 LYS 61 3HZ LYS 61 10.563 -2.871 -7.612 500 HZ2 LYS 61 1HZ LYS 61 9.112 -2.325 -8.233 501 HZ3 LYS 61 2HZ LYS 61 9.914 -3.610 -8.980 502 H SER 62 H SER 62 3.750 -6.279 -10.319 503 HA SER 62 HA SER 62 1.908 -8.201 -9.336 504 HB2 SER 62 2HB SER 62 0.479 -7.365 -11.255 505 HB3 SER 62 1HB SER 62 1.017 -6.125 -10.125 506 HG SER 62 HG SER 62 2.666 -6.562 -12.356 507 H TRP 63 H TRP 63 4.093 -8.007 -12.047 508 HA TRP 63 HA TRP 63 3.140 -10.343 -13.362 509 HB2 TRP 63 2HB TRP 63 4.231 -8.567 -14.614 510 HB3 TRP 63 1HB TRP 63 5.676 -8.718 -13.627 511 HD1 TRP 63 HD TRP 63 7.483 -10.263 -14.505 512 HE1 TRP 63 1HE TRP 63 7.679 -11.973 -16.430 513 HE3 TRP 63 3HE TRP 63 2.607 -10.381 -15.956 514 HZ2 TRP 63 2HZ TRP 63 5.961 -13.210 -18.309 515 HZ3 TRP 63 3HZ TRP 63 1.962 -11.875 -17.818 516 HH2 TRP 63 HH TRP 63 3.608 -13.241 -18.964 517 H LYS 64 H LYS 64 5.476 -9.601 -10.903 518 HA LYS 64 HA LYS 64 6.968 -11.968 -11.041 519 HB2 LYS 64 2HB LYS 64 7.709 -9.926 -9.862 520 HB3 LYS 64 1HB LYS 64 6.488 -10.218 -8.633 521 HG2 LYS 64 2HG LYS 64 7.567 -12.307 -8.032 522 HG3 LYS 64 1HG LYS 64 8.789 -12.044 -9.278 523 HD2 LYS 64 2HD LYS 64 9.447 -9.965 -8.157 524 HD3 LYS 64 1HD LYS 64 8.271 -10.299 -6.879 525 HE2 LYS 64 2HE LYS 64 9.450 -12.399 -6.381 526 HE3 LYS 64 1HE LYS 64 10.630 -12.017 -7.630 527 HZ1 LYS 64 3HZ LYS 64 10.112 -10.432 -5.182 528 HZ2 LYS 64 1HZ LYS 64 11.223 -10.030 -6.397 529 HZ3 LYS 64 2HZ LYS 64 11.461 -11.420 -5.478 530 H ARG 65 H ARG 65 4.080 -11.105 -9.186 531 HA ARG 65 HA ARG 65 3.942 -13.522 -7.693 532 HB2 ARG 65 2HB ARG 65 2.595 -11.334 -7.300 533 HB3 ARG 65 1HB ARG 65 1.573 -11.903 -8.583 534 HG2 ARG 65 2HG ARG 65 0.998 -13.911 -7.340 535 HG3 ARG 65 1HG ARG 65 2.031 -13.405 -6.006 536 HD2 ARG 65 2HD ARG 65 -0.439 -12.006 -7.029 537 HD3 ARG 65 1HD ARG 65 -0.268 -12.855 -5.496 538 HE ARG 65 HE ARG 65 1.678 -10.927 -5.516 539 HH11 ARG 65 1HH1 ARG 65 -1.887 -11.009 -5.523 540 HH12 ARG 65 2HH1 ARG 65 -2.062 -9.442 -4.897 541 HH21 ARG 65 1HH2 ARG 65 1.391 -8.730 -4.678 542 HH22 ARG 65 2HH2 ARG 65 -0.191 -8.130 -4.423 543 H TYR 66 H TYR 66 2.846 -12.516 -10.833 544 HA TYR 66 HA TYR 66 1.196 -14.686 -11.572 545 HB2 TYR 66 2HB TYR 66 1.412 -12.470 -12.723 546 HB3 TYR 66 1HB TYR 66 3.000 -12.962 -13.279 547 HD1 TYR 66 2HD TYR 66 -0.557 -13.830 -13.412 548 HD2 TYR 66 1HD TYR 66 3.210 -14.153 -15.301 549 HE1 TYR 66 2HE TYR 66 -1.651 -14.754 -15.399 550 HE2 TYR 66 1HE TYR 66 2.155 -15.068 -17.288 551 HH TYR 66 HH TYR 66 0.158 -16.262 -17.871 552 H GLU 67 H GLU 67 4.632 -14.023 -12.147 553 HA GLU 67 HA GLU 67 5.468 -16.510 -13.257 554 HB2 GLU 67 2HB GLU 67 6.964 -14.632 -11.446 555 HB3 GLU 67 1HB GLU 67 7.667 -15.891 -12.456 556 HG2 GLU 67 2HG GLU 67 6.053 -13.644 -13.401 557 HG3 GLU 67 1HG GLU 67 7.824 -13.572 -13.365 558 H GLN 68 H GLN 68 5.437 -15.443 -9.985 559 HA GLN 68 HA GLN 68 6.429 -17.835 -8.891 560 HB2 GLN 68 2HB GLN 68 4.495 -15.952 -7.529 561 HB3 GLN 68 1HB GLN 68 5.396 -17.223 -6.720 562 HG2 GLN 68 2HG GLN 68 6.506 -14.759 -8.044 563 HG3 GLN 68 1HG GLN 68 6.489 -15.136 -6.322 564 HE21 GLN 68 1HE2 GLN 68 7.938 -16.705 -5.529 565 HE22 GLN 68 2HE2 GLN 68 9.318 -17.198 -6.466 566 H GLU 69 H GLU 69 3.049 -16.952 -9.457 567 HA GLU 69 HA GLU 69 2.000 -19.405 -8.577 568 HB2 GLU 69 2HB GLU 69 0.911 -17.249 -10.328 569 HB3 GLU 69 1HB GLU 69 0.022 -18.742 -10.080 570 HG2 GLU 69 2HG GLU 69 0.934 -16.889 -7.900 571 HG3 GLU 69 1HG GLU 69 -0.694 -16.959 -8.581 572 H MET 70 H MET 70 3.015 -18.354 -11.769 573 HA MET 70 HA MET 70 2.087 -20.722 -13.086 574 HB2 MET 70 2HB MET 70 4.268 -18.819 -13.982 575 HB3 MET 70 1HB MET 70 3.434 -19.976 -15.009 576 HG2 MET 70 2HG MET 70 2.238 -17.565 -13.659 577 HG3 MET 70 1HG MET 70 2.601 -17.730 -15.370 578 HE1 MET 70 3HE MET 70 -0.023 -20.312 -16.560 579 HE2 MET 70 1HE MET 70 1.646 -20.627 -16.061 580 HE3 MET 70 2HE MET 70 1.267 -19.188 -17.008 581 H LEU 71 H LEU 71 4.975 -19.824 -11.446 582 HA LEU 71 HA LEU 71 6.519 -22.080 -12.243 583 HB2 LEU 71 2HB LEU 71 7.626 -20.115 -11.744 584 HB3 LEU 71 1HB LEU 71 6.849 -19.858 -10.218 585 HG LEU 71 HG LEU 71 8.133 -21.882 -9.392 586 HD11 LEU 71 1HD1 LEU 71 10.067 -22.601 -10.738 587 HD12 LEU 71 2HD1 LEU 71 9.507 -21.579 -12.058 588 HD13 LEU 71 3HD1 LEU 71 8.531 -22.950 -11.537 589 HD21 LEU 71 3HD2 LEU 71 8.899 -19.622 -8.920 590 HD22 LEU 71 1HD2 LEU 71 9.745 -19.568 -10.466 591 HD23 LEU 71 2HD2 LEU 71 10.274 -20.689 -9.210 592 H LYS 72 H LYS 72 4.570 -21.196 -9.457 593 HA LYS 72 HA LYS 72 5.060 -23.535 -7.932 594 HB2 LYS 72 2HB LYS 72 4.290 -21.490 -6.847 595 HB3 LYS 72 1HB LYS 72 2.869 -21.434 -7.855 596 HG2 LYS 72 2HG LYS 72 3.325 -23.647 -5.864 597 HG3 LYS 72 1HG LYS 72 2.590 -22.116 -5.400 598 HD2 LYS 72 2HD LYS 72 0.816 -22.495 -7.062 599 HD3 LYS 72 1HD LYS 72 1.564 -24.020 -7.515 600 HE2 LYS 72 2HE LYS 72 1.213 -24.857 -5.242 601 HE3 LYS 72 1HE LYS 72 0.449 -23.333 -4.795 602 HZ1 LYS 72 3HZ LYS 72 -1.279 -23.770 -6.441 603 HZ2 LYS 72 1HZ LYS 72 -1.183 -25.027 -5.322 604 HZ3 LYS 72 2HZ LYS 72 -0.539 -25.223 -6.862 605 H ASN 73 H ASN 73 2.548 -22.565 -10.194 606 HA ASN 73 HA ASN 73 1.247 -25.119 -9.909 607 HB2 ASN 73 2HB ASN 73 -0.132 -23.104 -10.049 608 HB3 ASN 73 1HB ASN 73 0.535 -22.767 -11.646 609 HD21 ASN 73 1HD2 ASN 73 -1.343 -22.944 -12.738 610 HD22 ASN 73 2HD2 ASN 73 -2.211 -24.428 -12.915 611 H GLU 74 H GLU 74 2.343 -26.628 -10.824 612 HA GLU 74 HA GLU 74 3.293 -26.356 -13.578 613 HB2 GLU 74 2HB GLU 74 3.643 -28.512 -11.480 614 HB3 GLU 74 1HB GLU 74 4.351 -28.567 -13.091 615 HG2 GLU 74 2HG GLU 74 5.651 -26.594 -12.639 616 HG3 GLU 74 1HG GLU 74 4.880 -26.408 -11.069 617 H LYS 75 H LYS 75 0.602 -26.233 -13.049 618 HA LYS 75 HA LYS 75 -1.388 -26.896 -13.590 619 HB2 LYS 75 2HB LYS 75 -0.006 -28.921 -15.349 620 HB3 LYS 75 1HB LYS 75 -1.740 -28.621 -15.369 621 HG2 LYS 75 2HG LYS 75 -1.327 -26.303 -16.024 622 HG3 LYS 75 1HG LYS 75 0.409 -26.612 -16.002 623 HD2 LYS 75 2HD LYS 75 0.137 -28.277 -17.755 624 HD3 LYS 75 1HD LYS 75 -1.603 -27.995 -17.765 625 HE2 LYS 75 2HE LYS 75 -1.231 -25.673 -18.430 626 HE3 LYS 75 1HE LYS 75 0.512 -25.934 -18.398 627 HZ1 LYS 75 3HZ LYS 75 -0.394 -26.060 -20.620 628 HZ2 LYS 75 1HZ LYS 75 -1.411 -27.326 -20.161 629 HZ3 LYS 75 2HZ LYS 75 0.285 -27.535 -20.161 630 H VAL 76 H VAL 76 -1.192 -27.349 -11.399 631 HA VAL 76 HA VAL 76 -2.080 -30.089 -10.800 632 HB VAL 76 HB VAL 76 -0.350 -28.399 -8.966 633 HG11 VAL 76 1HG1 VAL 76 -1.306 -31.240 -8.683 634 HG12 VAL 76 2HG1 VAL 76 -1.862 -29.846 -7.759 635 HG13 VAL 76 3HG1 VAL 76 -0.202 -30.415 -7.579 636 HG21 VAL 76 3HG2 VAL 76 1.002 -29.205 -10.837 637 HG22 VAL 76 1HG2 VAL 76 0.441 -30.851 -10.545 638 HG23 VAL 76 2HG2 VAL 76 1.449 -30.037 -9.350 639 H ALA 77 H ALA 77 -1.851 -26.715 -9.629 640 HA ALA 77 HA ALA 77 -4.656 -26.591 -9.149 641 HB1 ALA 77 1HB ALA 77 -4.511 -26.118 -6.746 642 HB2 ALA 77 2HB ALA 77 -2.782 -26.460 -6.778 643 HB3 ALA 77 3HB ALA 77 -3.943 -27.748 -7.104 644 H ALA 78 H ALA 78 -5.143 -24.645 -9.821 645 HA ALA 78 HA ALA 78 -3.198 -22.476 -9.449 646 HB1 ALA 78 1HB ALA 78 -4.007 -21.530 -11.550 647 HB2 ALA 78 2HB ALA 78 -5.106 -22.895 -11.737 648 HB3 ALA 78 3HB ALA 78 -3.363 -23.155 -11.785 649 H LYS 79 H LYS 79 -4.328 -20.308 -9.692 650 HA LYS 79 HA LYS 79 -6.542 -20.177 -7.866 651 HB2 LYS 79 2HB LYS 79 -5.243 -17.974 -9.505 652 HB3 LYS 79 1HB LYS 79 -6.411 -17.739 -8.226 653 HG2 LYS 79 2HG LYS 79 -3.689 -18.964 -7.841 654 HG3 LYS 79 1HG LYS 79 -4.091 -17.275 -7.529 655 HD2 LYS 79 2HD LYS 79 -5.736 -17.978 -5.860 656 HD3 LYS 79 1HD LYS 79 -5.349 -19.667 -6.187 657 HE2 LYS 79 2HE LYS 79 -3.421 -17.594 -5.134 658 HE3 LYS 79 1HE LYS 79 -4.229 -18.819 -4.160 659 HZ1 LYS 79 3HZ LYS 79 -2.000 -19.497 -4.702 660 HZ2 LYS 79 1HZ LYS 79 -2.268 -19.346 -6.357 661 HZ3 LYS 79 2HZ LYS 79 -3.083 -20.527 -5.475 662 H MET 80 H MET 80 -5.964 -19.444 -11.270 663 HA MET 80 HA MET 80 -7.217 -19.357 -13.109 664 HB2 MET 80 2HB MET 80 -9.212 -20.962 -11.499 665 HB3 MET 80 1HB MET 80 -9.393 -20.610 -13.207 666 HG2 MET 80 2HG MET 80 -7.163 -22.201 -11.958 667 HG3 MET 80 1HG MET 80 -8.552 -22.871 -12.804 668 HE1 MET 80 3HE MET 80 -5.723 -23.651 -15.351 669 HE2 MET 80 1HE MET 80 -7.102 -24.286 -14.455 670 HE3 MET 80 2HE MET 80 -5.652 -23.765 -13.595 671 H LEU 81 H LEU 81 -9.943 -19.193 -10.880 672 HA LEU 81 HA LEU 81 -10.359 -16.398 -11.097 673 HB2 LEU 81 2HB LEU 81 -11.038 -17.166 -13.390 674 HB3 LEU 81 1HB LEU 81 -12.191 -18.257 -12.661 675 HG LEU 81 HG LEU 81 -13.398 -16.270 -11.739 676 HD11 LEU 81 1HD1 LEU 81 -11.465 -14.744 -13.465 677 HD12 LEU 81 2HD1 LEU 81 -11.599 -14.665 -11.704 678 HD13 LEU 81 3HD1 LEU 81 -12.919 -14.089 -12.726 679 HD21 LEU 81 3HD2 LEU 81 -13.057 -16.358 -14.738 680 HD22 LEU 81 1HD2 LEU 81 -14.395 -15.596 -13.876 681 HD23 LEU 81 2HD2 LEU 81 -14.165 -17.340 -13.779 682 H GLU 82 H GLU 82 -12.403 -15.913 -9.794 683 HA GLU 82 HA GLU 82 -12.678 -18.047 -7.899 684 HB2 GLU 82 2HB GLU 82 -13.805 -15.264 -7.741 685 HB3 GLU 82 1HB GLU 82 -13.928 -16.470 -6.467 686 HG2 GLU 82 2HG GLU 82 -11.428 -16.522 -6.386 687 HG3 GLU 82 1HG GLU 82 -11.421 -15.172 -7.518 688 H LYS 83 H LYS 83 -15.509 -15.986 -8.599 689 HA LYS 83 HA LYS 83 -16.663 -18.276 -9.868 690 HB2 LYS 83 2HB LYS 83 -18.636 -18.453 -8.346 691 HB3 LYS 83 1HB LYS 83 -17.117 -19.000 -7.677 692 HG2 LYS 83 2HG LYS 83 -18.288 -17.897 -5.951 693 HG3 LYS 83 1HG LYS 83 -17.008 -16.797 -6.446 694 HD2 LYS 83 2HD LYS 83 -18.642 -15.531 -7.783 695 HD3 LYS 83 1HD LYS 83 -19.911 -16.645 -7.279 696 HE2 LYS 83 2HE LYS 83 -19.559 -16.003 -4.947 697 HE3 LYS 83 1HE LYS 83 -18.276 -14.906 -5.443 698 HZ1 LYS 83 3HZ LYS 83 -20.364 -13.771 -5.064 699 HZ2 LYS 83 1HZ LYS 83 -21.135 -14.668 -6.236 700 HZ3 LYS 83 2HZ LYS 83 -19.918 -13.595 -6.665 701 H ASP 84 H ASP 84 -17.167 -14.855 -9.123 702 HA ASP 84 HA ASP 84 -18.770 -14.763 -11.532 703 HB2 ASP 84 2HB ASP 84 -20.511 -15.260 -9.936 704 HB3 ASP 84 1HB ASP 84 -19.951 -13.988 -8.860 705 H ALA 85 H ALA 85 -18.814 -12.855 -12.511 706 HA ALA 85 HA ALA 85 -17.372 -10.640 -11.273 707 HB1 ALA 85 1HB ALA 85 -17.105 -9.838 -13.588 708 HB2 ALA 85 2HB ALA 85 -17.925 -11.287 -14.170 709 HB3 ALA 85 3HB ALA 85 -16.370 -11.421 -13.344 710 H THR 86 H THR 86 -18.978 -9.544 -10.256 711 HA THR 86 HA THR 86 -21.594 -9.300 -11.324 712 HB THR 86 HB THR 86 -20.204 -7.786 -9.099 713 HG1 THR 86 1HG THR 86 -21.069 -10.317 -9.342 714 HG21 THR 86 3HG2 THR 86 -23.156 -8.079 -9.733 715 HG22 THR 86 1HG2 THR 86 -22.215 -6.599 -9.910 716 HG23 THR 86 2HG2 THR 86 -22.492 -7.285 -8.308 717 H GLU 87 H GLU 87 -22.340 -7.817 -12.782 718 HA GLU 87 HA GLU 87 -20.696 -5.468 -13.331 719 HB2 GLU 87 2HB GLU 87 -20.749 -5.967 -15.730 720 HB3 GLU 87 1HB GLU 87 -19.808 -7.129 -14.805 721 HG2 GLU 87 2HG GLU 87 -21.595 -8.744 -14.913 722 HG3 GLU 87 1HG GLU 87 -22.650 -7.564 -15.681 723 H VAL 88 H VAL 88 -21.811 -3.751 -14.012 724 HA VAL 88 HA VAL 88 -24.318 -4.136 -15.347 725 HB VAL 88 HB VAL 88 -25.248 -1.993 -14.284 726 HG11 VAL 88 1HG1 VAL 88 -26.103 -4.168 -13.631 727 HG12 VAL 88 2HG1 VAL 88 -26.047 -3.088 -12.242 728 HG13 VAL 88 3HG1 VAL 88 -24.810 -4.334 -12.446 729 HG21 VAL 88 3HG2 VAL 88 -23.168 -1.113 -13.345 730 HG22 VAL 88 1HG2 VAL 88 -23.061 -2.496 -12.256 731 HG23 VAL 88 2HG2 VAL 88 -24.375 -1.331 -12.077 732 H GLY 89 H GLY 89 -23.429 -3.896 -17.223 733 HA2 GLY 89 2HA GLY 89 -21.540 -1.824 -17.802 734 HA3 GLY 89 1HA GLY 89 -22.218 -2.971 -18.944 735 H VAL 90 H VAL 90 -22.558 0.070 -17.421 736 HA VAL 90 HA VAL 90 -24.943 0.753 -18.866 737 HB VAL 90 HB VAL 90 -24.726 2.977 -17.830 738 HG11 VAL 90 1HG1 VAL 90 -25.791 1.226 -16.528 739 HG12 VAL 90 2HG1 VAL 90 -24.897 2.317 -15.467 740 HG13 VAL 90 3HG1 VAL 90 -24.226 0.741 -15.878 741 HG21 VAL 90 3HG2 VAL 90 -22.892 3.478 -16.260 742 HG22 VAL 90 1HG2 VAL 90 -22.289 3.215 -17.897 743 HG23 VAL 90 2HG2 VAL 90 -22.122 1.951 -16.681 744 H LYS 91 H LYS 91 -25.045 2.240 -20.568 745 HA LYS 91 HA LYS 91 -22.578 2.395 -22.123 746 HB2 LYS 91 2HB LYS 91 -24.571 1.308 -23.159 747 HB3 LYS 91 1HB LYS 91 -25.492 2.773 -22.935 748 HG2 LYS 91 2HG LYS 91 -23.064 2.576 -24.740 749 HG3 LYS 91 1HG LYS 91 -24.711 2.294 -25.289 750 HD2 LYS 91 2HD LYS 91 -25.310 4.588 -24.683 751 HD3 LYS 91 1HD LYS 91 -23.683 4.857 -24.065 752 HE2 LYS 91 2HE LYS 91 -23.872 5.837 -26.249 753 HE3 LYS 91 1HE LYS 91 -22.798 4.445 -26.332 754 HZ1 LYS 91 3HZ LYS 91 -25.632 4.528 -27.212 755 HZ2 LYS 91 1HZ LYS 91 -24.633 3.161 -27.293 756 HZ3 LYS 91 2HZ LYS 91 -24.284 4.544 -28.190 757 H ALA 92 H ALA 92 -21.479 4.258 -22.108 758 HA ALA 92 HA ALA 92 -22.476 6.622 -20.934 759 HB1 ALA 92 1HB ALA 92 -20.073 6.095 -20.970 760 HB2 ALA 92 2HB ALA 92 -20.388 7.654 -21.720 761 HB3 ALA 92 3HB ALA 92 -20.066 6.241 -22.727 762 H ALA 93 H ALA 93 -24.091 7.666 -21.836 763 HA ALA 93 HA ALA 93 -24.610 7.514 -24.617 764 HB1 ALA 93 1HB ALA 93 -26.576 8.863 -24.171 765 HB2 ALA 93 2HB ALA 93 -25.988 9.212 -22.544 766 HB3 ALA 93 3HB ALA 93 -26.434 7.564 -22.987 767 H LEU 94 H LEU 94 -22.855 8.374 -25.564 768 HA LEU 94 HA LEU 94 -22.856 11.251 -25.460 769 HB2 LEU 94 2HB LEU 94 -20.497 11.170 -26.379 770 HB3 LEU 94 1HB LEU 94 -20.689 10.634 -24.736 771 HG LEU 94 HG LEU 94 -20.596 8.248 -25.695 772 HD11 LEU 94 1HD1 LEU 94 -19.383 7.959 -27.779 773 HD12 LEU 94 2HD1 LEU 94 -19.454 9.703 -28.054 774 HD13 LEU 94 3HD1 LEU 94 -20.944 8.756 -28.015 775 HD21 LEU 94 3HD2 LEU 94 -18.165 10.016 -25.825 776 HD22 LEU 94 1HD2 LEU 94 -18.149 8.256 -25.711 777 HD23 LEU 94 2HD2 LEU 94 -18.813 9.217 -24.390 778 H GLU 95 H GLU 95 -23.781 12.197 -26.993 779 HA GLU 95 HA GLU 95 -23.742 10.935 -29.576 780 HB2 GLU 95 2HB GLU 95 -26.187 11.611 -29.875 781 HB3 GLU 95 1HB GLU 95 -25.855 10.232 -28.848 782 HG2 GLU 95 2HG GLU 95 -27.615 11.542 -27.866 783 HG3 GLU 95 1HG GLU 95 -26.175 11.688 -26.867 784 H GLU 96 H GLU 96 -24.849 12.541 -31.202 785 HA GLU 96 HA GLU 96 -23.912 15.213 -30.642 786 HB2 GLU 96 2HB GLU 96 -22.609 15.239 -32.748 787 HB3 GLU 96 1HB GLU 96 -21.953 14.156 -31.535 788 HG2 GLU 96 2HG GLU 96 -22.956 12.245 -32.671 789 HG3 GLU 96 1HG GLU 96 -23.636 13.325 -33.885 790 H ALA 97 H ALA 97 -24.789 16.744 -32.052 791 HA ALA 97 HA ALA 97 -26.727 15.864 -34.028 792 HB1 ALA 97 1HB ALA 97 -28.429 17.396 -33.127 793 HB2 ALA 97 2HB ALA 97 -27.379 17.751 -31.753 794 HB3 ALA 97 3HB ALA 97 -28.032 16.126 -31.969 795 H LYS 98 H LYS 98 -26.388 17.037 -35.802 796 HA LYS 98 HA LYS 98 -24.870 19.528 -35.484 797 HB2 LYS 98 2HB LYS 98 -24.058 19.209 -37.748 798 HB3 LYS 98 1HB LYS 98 -23.687 17.809 -36.755 799 HG2 LYS 98 2HG LYS 98 -25.595 16.623 -37.752 800 HG3 LYS 98 1HG LYS 98 -25.916 18.029 -38.766 801 HD2 LYS 98 2HD LYS 98 -23.705 17.796 -39.780 802 HD3 LYS 98 1HD LYS 98 -23.389 16.382 -38.772 803 HE2 LYS 98 2HE LYS 98 -25.323 15.252 -39.801 804 HE3 LYS 98 1HE LYS 98 -25.575 16.659 -40.827 805 HZ1 LYS 98 3HZ LYS 98 -23.417 16.298 -41.809 806 HZ2 LYS 98 1HZ LYS 98 -24.359 14.911 -41.971 807 HZ3 LYS 98 2HZ LYS 98 -23.139 14.973 -40.806 808 H LYS 99 H LYS 99 -25.338 21.261 -36.719 809 HA LYS 99 HA LYS 99 -27.441 21.429 -38.606 810 HB2 LYS 99 2HB LYS 99 -28.650 21.582 -36.308 811 HB3 LYS 99 1HB LYS 99 -27.737 23.050 -36.042 812 HG2 LYS 99 2HG LYS 99 -29.763 22.636 -38.267 813 HG3 LYS 99 1HG LYS 99 -30.085 23.458 -36.751 814 HD2 LYS 99 2HD LYS 99 -28.102 24.349 -38.862 815 HD3 LYS 99 1HD LYS 99 -29.716 25.014 -38.637 816 HE2 LYS 99 2HE LYS 99 -27.461 25.118 -36.614 817 HE3 LYS 99 1HE LYS 99 -27.951 26.439 -37.658 818 HZ1 LYS 99 3HZ LYS 99 -28.867 26.688 -35.457 819 HZ2 LYS 99 1HZ LYS 99 -29.640 25.195 -35.544 820 HZ3 LYS 99 2HZ LYS 99 -30.104 26.454 -36.562 821 H VAL 100 H VAL 100 -25.802 22.199 -39.876 822 HA VAL 100 HA VAL 100 -24.325 24.443 -38.770 823 HB VAL 100 HB VAL 100 -22.848 22.621 -39.335 824 HG11 VAL 100 1HG1 VAL 100 -22.556 21.799 -41.616 825 HG12 VAL 100 2HG1 VAL 100 -23.936 22.766 -42.136 826 HG13 VAL 100 3HG1 VAL 100 -24.163 21.451 -40.982 827 HG21 VAL 100 3HG2 VAL 100 -21.968 24.859 -39.690 828 HG22 VAL 100 1HG2 VAL 100 -22.586 24.859 -41.343 829 HG23 VAL 100 2HG2 VAL 100 -21.298 23.745 -40.884 830 H GLN 101 H GLN 101 -24.959 26.326 -39.346 831 HA GLN 101 HA GLN 101 -26.338 26.694 -41.814 832 HB2 GLN 101 2HB GLN 101 -26.511 29.107 -41.197 833 HB3 GLN 101 1HB GLN 101 -27.120 28.052 -39.944 834 HG2 GLN 101 2HG GLN 101 -24.405 29.372 -39.908 835 HG3 GLN 101 1HG GLN 101 -25.835 30.013 -39.106 836 HE21 GLN 101 1HE2 GLN 101 -23.260 29.183 -38.019 837 HE22 GLN 101 2HE2 GLN 101 -23.600 27.969 -36.854 838 H ILE 102 H ILE 102 -25.017 26.192 -43.389 839 HA ILE 102 HA ILE 102 -22.616 27.811 -43.642 840 HB ILE 102 HB ILE 102 -22.171 25.397 -43.618 841 HG12 ILE 102 2HG1 ILE 102 -20.641 26.745 -45.054 842 HG13 ILE 102 1HG1 ILE 102 -20.760 25.082 -45.574 843 HG21 ILE 102 1HG2 ILE 102 -24.187 24.453 -44.332 844 HG22 ILE 102 2HG2 ILE 102 -22.885 23.843 -45.352 845 HG23 ILE 102 3HG2 ILE 102 -23.976 25.087 -45.966 846 HD11 ILE 102 3HD1 ILE 102 -22.093 27.453 -46.883 847 HD12 ILE 102 1HD1 ILE 102 -22.227 25.780 -47.421 848 HD13 ILE 102 2HD1 ILE 102 -20.666 26.601 -47.469 849 H GLU 103 H GLU 103 -23.374 29.610 -44.434 850 HA GLU 103 HA GLU 103 -24.898 29.489 -46.940 851 HB2 GLU 103 2HB GLU 103 -24.840 31.707 -44.883 852 HB3 GLU 103 1HB GLU 103 -25.811 31.661 -46.340 853 HG2 GLU 103 2HG GLU 103 -26.088 29.870 -43.941 854 HG3 GLU 103 1HG GLU 103 -27.156 31.193 -44.398 855 H LEU 104 H LEU 104 -24.490 31.486 -48.267 856 HA LEU 104 HA LEU 104 -23.182 32.720 -49.545 857 HB2 LEU 104 2HB LEU 104 -21.617 33.220 -47.018 858 HB3 LEU 104 1HB LEU 104 -21.317 34.054 -48.523 859 HG LEU 104 HG LEU 104 -22.519 35.543 -47.202 860 HD11 LEU 104 1HD1 LEU 104 -24.609 35.890 -48.355 861 HD12 LEU 104 2HD1 LEU 104 -24.516 34.266 -49.022 862 HD13 LEU 104 3HD1 LEU 104 -23.300 35.468 -49.460 863 HD21 LEU 104 3HD2 LEU 104 -24.630 35.039 -46.081 864 HD22 LEU 104 1HD2 LEU 104 -23.313 34.033 -45.475 865 HD23 LEU 104 2HD2 LEU 104 -24.496 33.356 -46.593 866 H ASP 105 H ASP 105 -22.238 31.793 -51.070 867 HA ASP 105 HA ASP 105 -20.229 29.796 -50.629 868 HB2 ASP 105 2HB ASP 105 -21.338 30.981 -53.172 869 HB3 ASP 105 1HB ASP 105 -20.119 29.717 -53.132 870 H THR 106 H THR 106 -20.361 33.003 -52.107 871 HA THR 106 HA THR 106 -18.777 34.459 -52.772 872 HB THR 106 HB THR 106 -17.021 34.984 -51.135 873 HG1 THR 106 1HG THR 106 -17.732 32.490 -50.171 874 HG21 THR 106 3HG2 THR 106 -18.508 35.576 -49.251 875 HG22 THR 106 1HG2 THR 106 -19.747 34.520 -49.932 876 HG23 THR 106 2HG2 THR 106 -19.217 35.948 -50.824 877 H SER 107 H SER 107 -18.583 32.162 -54.119 878 HA SER 107 HA SER 107 -16.082 30.925 -54.179 879 HB2 SER 107 2HB SER 107 -18.111 29.996 -55.246 880 HB3 SER 107 1HB SER 107 -18.082 31.296 -56.430 881 HG SER 107 HG SER 107 -15.818 29.678 -56.096 882 H LEU 108 H LEU 108 -17.389 33.703 -55.933 883 HA LEU 108 HA LEU 108 -14.676 34.690 -56.251 884 HB2 LEU 108 2HB LEU 108 -15.574 33.560 -58.391 885 HB3 LEU 108 1HB LEU 108 -16.780 34.822 -58.443 886 HG LEU 108 HG LEU 108 -13.792 35.163 -58.741 887 HD11 LEU 108 1HD1 LEU 108 -16.020 35.358 -60.745 888 HD12 LEU 108 2HD1 LEU 108 -14.801 34.090 -60.643 889 HD13 LEU 108 3HD1 LEU 108 -14.328 35.741 -61.054 890 HD21 LEU 108 3HD2 LEU 108 -14.787 37.162 -57.730 891 HD22 LEU 108 1HD2 LEU 108 -15.982 37.216 -59.027 892 HD23 LEU 108 2HD2 LEU 108 -14.273 37.473 -59.390 893 H SER 109 H SER 109 -14.895 36.356 -54.800 894 HA SER 109 HA SER 109 -17.456 37.605 -54.562 895 HB2 SER 109 2HB SER 109 -16.338 38.840 -52.648 896 HB3 SER 109 1HB SER 109 -16.479 37.089 -52.480 897 HG SER 109 HG SER 109 -14.431 37.412 -51.994 898 H TYR 110 H TYR 110 -17.430 38.461 -56.667 899 HA TYR 110 HA TYR 110 -16.591 41.228 -56.573 900 HB2 TYR 110 2HB TYR 110 -14.745 40.054 -57.775 901 HB3 TYR 110 1HB TYR 110 -15.917 39.423 -58.915 902 HD1 TYR 110 2HD TYR 110 -14.161 42.440 -57.776 903 HD2 TYR 110 1HD TYR 110 -16.768 40.809 -60.715 904 HE1 TYR 110 2HE TYR 110 -13.817 44.422 -59.172 905 HE2 TYR 110 1HE TYR 110 -16.424 42.793 -62.119 906 HH TYR 110 HH TYR 110 -15.760 45.165 -61.804 907 H ILE 111 H ILE 111 -18.421 42.289 -56.958 908 HA ILE 111 HA ILE 111 -20.049 41.483 -59.143 909 HB ILE 111 HB ILE 111 -21.002 40.139 -57.330 910 HG12 ILE 111 2HG1 ILE 111 -22.643 41.065 -58.988 911 HG13 ILE 111 1HG1 ILE 111 -23.361 40.680 -57.439 912 HG21 ILE 111 1HG2 ILE 111 -20.318 41.256 -55.391 913 HG22 ILE 111 2HG2 ILE 111 -22.072 41.065 -55.335 914 HG23 ILE 111 3HG2 ILE 111 -21.366 42.630 -55.737 915 HD11 ILE 111 3HD1 ILE 111 -23.404 43.060 -56.885 916 HD12 ILE 111 1HD1 ILE 111 -24.265 42.727 -58.386 917 HD13 ILE 111 2HD1 ILE 111 -22.648 43.439 -58.429 Start of MODEL 5 1 H1 GLY -1 1HT GLY -1 -2.196 1.391 -26.117 2 H2 GLY -1 2HT GLY -1 -0.732 2.214 -26.395 3 H3 GLY -1 3HT GLY -1 -1.026 1.454 -24.916 4 HA2 GLY -1 1HA GLY -1 -0.801 0.026 -27.463 5 HA3 GLY -1 2HA GLY -1 0.482 0.176 -26.267 6 H SER 0 H SER 0 -1.203 -2.083 -27.369 7 HA SER 0 HA SER 0 -2.026 -4.045 -26.666 8 HB2 SER 0 2HB SER 0 -0.034 -3.931 -25.135 9 HB3 SER 0 1HB SER 0 -1.051 -3.154 -23.931 10 HG SER 0 HG SER 0 -0.599 -5.519 -23.938 11 H MET 1 H MET 1 -3.508 -4.786 -24.404 12 HA MET 1 HA MET 1 -5.883 -3.180 -24.839 13 HB2 MET 1 2HB MET 1 -5.534 -5.689 -23.181 14 HB3 MET 1 1HB MET 1 -7.064 -4.902 -23.530 15 HG2 MET 1 2HG MET 1 -6.740 -5.370 -25.916 16 HG3 MET 1 1HG MET 1 -5.232 -6.197 -25.547 17 HE1 MET 1 3HE MET 1 -7.406 -7.632 -27.253 18 HE2 MET 1 1HE MET 1 -7.515 -9.211 -26.474 19 HE3 MET 1 2HE MET 1 -5.946 -8.445 -26.708 20 H THR 2 H THR 2 -6.656 -1.734 -23.447 21 HA THR 2 HA THR 2 -5.068 -1.130 -21.140 22 HB THR 2 HB THR 2 -7.541 0.225 -22.240 23 HG1 THR 2 1HG THR 2 -4.956 0.124 -22.997 24 HG21 THR 2 3HG2 THR 2 -7.081 0.766 -19.869 25 HG22 THR 2 1HG2 THR 2 -6.780 2.152 -20.919 26 HG23 THR 2 2HG2 THR 2 -5.429 1.202 -20.305 27 H VAL 3 H VAL 3 -5.461 -2.020 -19.270 28 HA VAL 3 HA VAL 3 -8.176 -3.018 -18.662 29 HB VAL 3 HB VAL 3 -5.650 -3.677 -17.134 30 HG11 VAL 3 1HG1 VAL 3 -7.679 -4.123 -15.941 31 HG12 VAL 3 2HG1 VAL 3 -6.857 -5.612 -16.435 32 HG13 VAL 3 3HG1 VAL 3 -8.269 -5.069 -17.330 33 HG21 VAL 3 3HG2 VAL 3 -6.833 -5.304 -19.377 34 HG22 VAL 3 1HG2 VAL 3 -5.539 -5.781 -18.278 35 HG23 VAL 3 2HG2 VAL 3 -5.281 -4.444 -19.410 36 H TYR 4 H TYR 4 -9.242 -2.185 -16.820 37 HA TYR 4 HA TYR 4 -7.861 0.025 -15.516 38 HB2 TYR 4 2HB TYR 4 -10.804 -0.654 -15.643 39 HB3 TYR 4 1HB TYR 4 -10.108 0.781 -14.895 40 HD1 TYR 4 2HD TYR 4 -10.739 -0.919 -18.100 41 HD2 TYR 4 1HD TYR 4 -9.415 2.655 -16.229 42 HE1 TYR 4 2HE TYR 4 -10.875 0.237 -20.246 43 HE2 TYR 4 1HE TYR 4 -9.549 3.832 -18.389 44 HH TYR 4 HH TYR 4 -11.144 2.494 -21.045 45 H ILE 5 H ILE 5 -7.442 -0.002 -13.408 46 HA ILE 5 HA ILE 5 -8.271 -2.357 -11.801 47 HB ILE 5 HB ILE 5 -5.840 -0.609 -11.390 48 HG12 ILE 5 2HG1 ILE 5 -4.428 -2.380 -11.831 49 HG13 ILE 5 1HG1 ILE 5 -5.630 -3.556 -12.188 50 HG21 ILE 5 1HG2 ILE 5 -6.685 -1.447 -9.330 51 HG22 ILE 5 2HG2 ILE 5 -5.148 -2.234 -9.691 52 HG23 ILE 5 3HG2 ILE 5 -6.669 -3.093 -9.939 53 HD11 ILE 5 3HD1 ILE 5 -4.745 -1.160 -13.821 54 HD12 ILE 5 1HD1 ILE 5 -6.172 -2.110 -14.251 55 HD13 ILE 5 2HD1 ILE 5 -4.579 -2.866 -14.229 56 H CYS 6 H CYS 6 -9.719 -1.726 -10.294 57 HA CYS 6 HA CYS 6 -9.080 0.687 -8.802 58 HB2 CYS 6 2HB CYS 6 -11.162 1.136 -10.067 59 HB3 CYS 6 1HB CYS 6 -11.877 -0.322 -9.394 60 HG CYS 6 HG CYS 6 -13.154 1.495 -7.937 61 HA PRO 7 HA PRO 7 -8.656 -2.922 -6.044 62 HB2 PRO 7 2HB PRO 7 -7.151 -0.987 -4.418 63 HB3 PRO 7 1HB PRO 7 -6.630 -2.542 -5.073 64 HG2 PRO 7 2HG PRO 7 -5.700 -0.229 -6.046 65 HG3 PRO 7 1HG PRO 7 -5.998 -1.629 -7.095 66 HD2 PRO 7 2HD PRO 7 -7.662 0.830 -6.692 67 HD3 PRO 7 1HD PRO 7 -7.252 -0.051 -8.189 68 H GLU 8 H GLU 8 -10.419 -0.241 -5.847 69 HA GLU 8 HA GLU 8 -11.058 -0.382 -2.997 70 HB2 GLU 8 2HB GLU 8 -12.122 1.511 -5.083 71 HB3 GLU 8 1HB GLU 8 -12.257 1.657 -3.340 72 HG2 GLU 8 2HG GLU 8 -9.754 1.763 -4.942 73 HG3 GLU 8 1HG GLU 8 -10.623 3.169 -4.307 74 H THR 9 H THR 9 -12.942 0.094 -5.997 75 HA THR 9 HA THR 9 -15.127 -1.359 -4.771 76 HB THR 9 HB THR 9 -16.478 -0.189 -6.534 77 HG1 THR 9 1HG THR 9 -15.450 1.502 -7.618 78 HG21 THR 9 3HG2 THR 9 -14.837 1.529 -4.666 79 HG22 THR 9 1HG2 THR 9 -16.291 0.635 -4.213 80 HG23 THR 9 2HG2 THR 9 -16.398 1.975 -5.359 81 H GLY 10 H GLY 10 -12.761 -1.837 -7.191 82 HA2 GLY 10 2HA GLY 10 -14.592 -3.592 -8.605 83 HA3 GLY 10 1HA GLY 10 -13.040 -3.222 -9.279 84 H ASP 11 H ASP 11 -12.776 -5.508 -9.522 85 HA ASP 11 HA ASP 11 -11.580 -6.848 -7.361 86 HB2 ASP 11 2HB ASP 11 -13.110 -8.733 -7.133 87 HB3 ASP 11 1HB ASP 11 -13.934 -7.236 -6.712 88 H ASP 12 H ASP 12 -10.655 -8.828 -8.051 89 HA ASP 12 HA ASP 12 -9.829 -8.621 -10.783 90 HB2 ASP 12 2HB ASP 12 -8.312 -10.481 -10.315 91 HB3 ASP 12 1HB ASP 12 -8.184 -9.218 -9.098 92 H GLY 13 H GLY 13 -12.643 -9.907 -9.772 93 HA2 GLY 13 2HA GLY 13 -12.516 -12.266 -11.492 94 HA3 GLY 13 1HA GLY 13 -13.845 -11.813 -10.427 95 H ASN 14 H ASN 14 -12.940 -9.093 -11.854 96 HA ASN 14 HA ASN 14 -15.193 -9.078 -13.674 97 HB2 ASN 14 2HB ASN 14 -13.326 -6.952 -12.692 98 HB3 ASN 14 1HB ASN 14 -14.518 -6.632 -13.940 99 HD21 ASN 14 1HD2 ASN 14 -14.226 -5.590 -11.216 100 HD22 ASN 14 2HD2 ASN 14 -15.716 -5.990 -10.425 101 H ASP 15 H ASP 15 -14.866 -7.690 -15.695 102 HA ASP 15 HA ASP 15 -13.080 -9.029 -17.497 103 HB2 ASP 15 2HB ASP 15 -14.879 -6.628 -17.885 104 HB3 ASP 15 1HB ASP 15 -13.967 -7.413 -19.164 105 H GLY 16 H GLY 16 -12.789 -6.361 -15.455 106 HA2 GLY 16 2HA GLY 16 -11.091 -4.847 -15.175 107 HA3 GLY 16 1HA GLY 16 -10.282 -5.624 -16.544 108 H SER 17 H SER 17 -13.447 -4.431 -16.739 109 HA SER 17 HA SER 17 -12.774 -2.580 -18.848 110 HB2 SER 17 2HB SER 17 -14.797 -4.009 -18.975 111 HB3 SER 17 1HB SER 17 -15.417 -3.251 -17.512 112 HG SER 17 HG SER 17 -16.090 -2.503 -19.722 113 H GLU 18 H GLU 18 -13.959 -0.275 -18.602 114 HA GLU 18 HA GLU 18 -12.745 0.934 -16.404 115 HB2 GLU 18 2HB GLU 18 -13.133 2.038 -18.626 116 HB3 GLU 18 1HB GLU 18 -14.853 2.045 -18.259 117 HG2 GLU 18 2HG GLU 18 -14.457 3.503 -16.359 118 HG3 GLU 18 1HG GLU 18 -12.729 3.431 -16.741 119 H LEU 19 H LEU 19 -15.920 -0.253 -17.149 120 HA LEU 19 HA LEU 19 -17.142 0.893 -14.791 121 HB2 LEU 19 2HB LEU 19 -18.276 -0.958 -16.837 122 HB3 LEU 19 1HB LEU 19 -19.171 -0.199 -15.536 123 HG LEU 19 HG LEU 19 -17.891 1.160 -17.897 124 HD11 LEU 19 1HD1 LEU 19 -20.632 0.881 -16.884 125 HD12 LEU 19 2HD1 LEU 19 -19.983 0.083 -18.318 126 HD13 LEU 19 3HD1 LEU 19 -20.188 1.862 -18.305 127 HD21 LEU 19 3HD2 LEU 19 -17.539 2.567 -15.924 128 HD22 LEU 19 1HD2 LEU 19 -19.252 2.427 -15.508 129 HD23 LEU 19 2HD2 LEU 19 -18.759 3.261 -16.979 130 H LYS 20 H LYS 20 -15.453 -1.907 -15.625 131 HA LYS 20 HA LYS 20 -16.145 -3.281 -13.058 132 HB2 LYS 20 2HB LYS 20 -15.537 -4.777 -15.605 133 HB3 LYS 20 1HB LYS 20 -16.067 -5.387 -14.073 134 HG2 LYS 20 2HG LYS 20 -18.286 -4.444 -14.314 135 HG3 LYS 20 1HG LYS 20 -17.834 -3.743 -15.869 136 HD2 LYS 20 2HD LYS 20 -17.478 -5.946 -16.803 137 HD3 LYS 20 1HD LYS 20 -17.805 -6.695 -15.243 138 HE2 LYS 20 2HE LYS 20 -19.763 -5.082 -16.883 139 HE3 LYS 20 1HE LYS 20 -19.730 -6.840 -16.722 140 HZ1 LYS 20 3HZ LYS 20 -21.382 -5.880 -15.253 141 HZ2 LYS 20 1HZ LYS 20 -20.224 -4.896 -14.533 142 HZ3 LYS 20 2HZ LYS 20 -20.138 -6.561 -14.331 143 HA PRO 21 HA PRO 21 -11.749 -2.583 -13.770 144 HB2 PRO 21 2HB PRO 21 -11.197 -1.415 -11.409 145 HB3 PRO 21 1HB PRO 21 -11.805 -0.517 -12.805 146 HG2 PRO 21 2HG PRO 21 -13.284 -1.489 -10.393 147 HG3 PRO 21 1HG PRO 21 -13.441 0.051 -11.256 148 HD2 PRO 21 2HD PRO 21 -15.133 -2.068 -11.563 149 HD3 PRO 21 1HD PRO 21 -14.844 -0.841 -12.810 150 H LEU 22 H LEU 22 -10.042 -3.659 -12.889 151 HA LEU 22 HA LEU 22 -10.701 -5.984 -11.292 152 HB2 LEU 22 2HB LEU 22 -8.072 -5.053 -12.415 153 HB3 LEU 22 1HB LEU 22 -8.379 -6.614 -11.679 154 HG LEU 22 HG LEU 22 -9.568 -5.600 -14.243 155 HD11 LEU 22 1HD1 LEU 22 -8.229 -7.336 -15.264 156 HD12 LEU 22 2HD1 LEU 22 -7.526 -7.705 -13.687 157 HD13 LEU 22 3HD1 LEU 22 -7.244 -6.136 -14.431 158 HD21 LEU 22 3HD2 LEU 22 -9.886 -8.261 -12.864 159 HD22 LEU 22 1HD2 LEU 22 -10.466 -7.858 -14.478 160 HD23 LEU 22 2HD2 LEU 22 -11.139 -7.036 -13.072 161 H ARG 23 H ARG 23 -8.920 -6.471 -9.592 162 HA ARG 23 HA ARG 23 -8.812 -4.025 -8.007 163 HB2 ARG 23 2HB ARG 23 -9.064 -5.356 -6.005 164 HB3 ARG 23 1HB ARG 23 -10.075 -5.936 -7.225 165 HG2 ARG 23 2HG ARG 23 -8.890 -7.850 -7.659 166 HG3 ARG 23 1HG ARG 23 -7.443 -7.265 -6.838 167 HD2 ARG 23 2HD ARG 23 -8.738 -7.290 -4.700 168 HD3 ARG 23 1HD ARG 23 -10.076 -8.005 -5.585 169 HE ARG 23 HE ARG 23 -8.724 -9.901 -6.048 170 HH11 ARG 23 1HH1 ARG 23 -7.485 -7.732 -3.517 171 HH12 ARG 23 2HH1 ARG 23 -6.574 -8.925 -2.724 172 HH21 ARG 23 1HH2 ARG 23 -7.413 -11.542 -4.963 173 HH22 ARG 23 2HH2 ARG 23 -6.528 -11.132 -3.569 174 H THR 24 H THR 24 -6.753 -6.385 -9.543 175 HA THR 24 HA THR 24 -4.437 -5.025 -8.434 176 HB THR 24 HB THR 24 -3.274 -7.276 -8.393 177 HG1 THR 24 1HG THR 24 -4.943 -9.023 -7.953 178 HG21 THR 24 3HG2 THR 24 -4.143 -7.922 -6.161 179 HG22 THR 24 1HG2 THR 24 -5.524 -6.853 -6.409 180 HG23 THR 24 2HG2 THR 24 -3.902 -6.180 -6.296 181 H LEU 25 H LEU 25 -2.592 -5.070 -9.789 182 HA LEU 25 HA LEU 25 -2.983 -5.157 -12.592 183 HB2 LEU 25 2HB LEU 25 -0.450 -5.197 -10.971 184 HB3 LEU 25 1HB LEU 25 -0.547 -5.002 -12.718 185 HG LEU 25 HG LEU 25 -1.883 -3.172 -10.819 186 HD11 LEU 25 1HD1 LEU 25 0.845 -2.914 -12.135 187 HD12 LEU 25 2HD1 LEU 25 0.554 -3.143 -10.410 188 HD13 LEU 25 3HD1 LEU 25 0.047 -1.649 -11.199 189 HD21 LEU 25 3HD2 LEU 25 -1.142 -3.018 -13.730 190 HD22 LEU 25 1HD2 LEU 25 -1.811 -1.667 -12.826 191 HD23 LEU 25 2HD2 LEU 25 -2.759 -3.129 -13.052 192 H TYR 26 H TYR 26 -2.192 -7.443 -10.262 193 HA TYR 26 HA TYR 26 -0.878 -9.456 -11.670 194 HB2 TYR 26 2HB TYR 26 -1.348 -9.475 -9.203 195 HB3 TYR 26 1HB TYR 26 -3.031 -9.821 -9.555 196 HD1 TYR 26 2HD TYR 26 -3.674 -12.072 -10.416 197 HD2 TYR 26 1HD TYR 26 0.370 -11.199 -9.345 198 HE1 TYR 26 2HE TYR 26 -3.109 -14.481 -10.414 199 HE2 TYR 26 1HE TYR 26 0.907 -13.457 -9.369 200 HH TYR 26 HH TYR 26 -1.105 -15.886 -10.715 201 H GLN 27 H GLN 27 -4.380 -8.829 -11.340 202 HA GLN 27 HA GLN 27 -5.094 -10.965 -13.093 203 HB2 GLN 27 2HB GLN 27 -6.616 -10.243 -11.359 204 HB3 GLN 27 1HB GLN 27 -6.758 -8.649 -12.075 205 HG2 GLN 27 2HG GLN 27 -8.729 -9.991 -12.610 206 HG3 GLN 27 1HG GLN 27 -7.840 -9.652 -14.069 207 HE21 GLN 27 1HE2 GLN 27 -8.648 -11.379 -15.151 208 HE22 GLN 27 2HE2 GLN 27 -8.220 -13.004 -14.834 209 H ALA 28 H ALA 28 -4.609 -7.461 -13.517 210 HA ALA 28 HA ALA 28 -5.564 -7.205 -16.098 211 HB1 ALA 28 1HB ALA 28 -4.909 -5.289 -14.665 212 HB2 ALA 28 2HB ALA 28 -4.094 -5.221 -16.221 213 HB3 ALA 28 3HB ALA 28 -3.224 -5.771 -14.797 214 H MET 29 H MET 29 -2.399 -8.236 -14.876 215 HA MET 29 HA MET 29 -1.343 -8.674 -17.417 216 HB2 MET 29 2HB MET 29 -0.483 -9.537 -14.686 217 HB3 MET 29 1HB MET 29 0.361 -10.031 -16.139 218 HG2 MET 29 2HG MET 29 0.758 -7.581 -16.656 219 HG3 MET 29 1HG MET 29 0.035 -7.185 -15.117 220 HE1 MET 29 3HE MET 29 3.774 -6.501 -14.673 221 HE2 MET 29 1HE MET 29 2.147 -5.828 -14.658 222 HE3 MET 29 2HE MET 29 2.869 -6.341 -16.178 223 H ILE 30 H ILE 30 -3.220 -10.738 -15.273 224 HA ILE 30 HA ILE 30 -2.692 -13.158 -16.678 225 HB ILE 30 HB ILE 30 -5.162 -12.364 -15.103 226 HG12 ILE 30 2HG1 ILE 30 -2.846 -14.167 -14.391 227 HG13 ILE 30 1HG1 ILE 30 -3.115 -12.544 -13.751 228 HG21 ILE 30 1HG2 ILE 30 -5.764 -14.757 -15.076 229 HG22 ILE 30 2HG2 ILE 30 -4.430 -15.084 -16.182 230 HG23 ILE 30 3HG2 ILE 30 -5.785 -14.084 -16.708 231 HD11 ILE 30 3HD1 ILE 30 -5.170 -13.345 -12.694 232 HD12 ILE 30 1HD1 ILE 30 -3.751 -14.256 -12.180 233 HD13 ILE 30 2HD1 ILE 30 -4.867 -14.954 -13.354 234 H ILE 31 H ILE 31 -5.293 -10.768 -17.060 235 HA ILE 31 HA ILE 31 -6.621 -12.165 -19.070 236 HB ILE 31 HB ILE 31 -6.707 -9.177 -18.562 237 HG12 ILE 31 2HG1 ILE 31 -8.321 -11.446 -17.386 238 HG13 ILE 31 1HG1 ILE 31 -7.157 -10.451 -16.522 239 HG21 ILE 31 1HG2 ILE 31 -7.702 -9.948 -20.686 240 HG22 ILE 31 2HG2 ILE 31 -8.939 -9.394 -19.521 241 HG23 ILE 31 3HG2 ILE 31 -8.638 -11.126 -19.741 242 HD11 ILE 31 3HD1 ILE 31 -8.567 -8.496 -16.920 243 HD12 ILE 31 1HD1 ILE 31 -9.420 -9.768 -16.027 244 HD13 ILE 31 2HD1 ILE 31 -9.719 -9.541 -17.754 245 H THR 32 H THR 32 -4.128 -9.649 -19.197 246 HA THR 32 HA THR 32 -4.300 -9.586 -22.096 247 HB THR 32 HB THR 32 -2.648 -7.751 -21.949 248 HG1 THR 32 1HG THR 32 -2.910 -7.751 -19.166 249 HG21 THR 32 3HG2 THR 32 -4.941 -7.395 -19.975 250 HG22 THR 32 1HG2 THR 32 -5.084 -7.264 -21.729 251 HG23 THR 32 2HG2 THR 32 -4.088 -6.128 -20.824 252 H LYS 33 H LYS 33 -2.013 -10.572 -19.557 253 HA LYS 33 HA LYS 33 -0.054 -11.580 -19.491 254 HB2 LYS 33 2HB LYS 33 -0.961 -12.720 -22.155 255 HB3 LYS 33 1HB LYS 33 0.473 -13.275 -21.302 256 HG2 LYS 33 2HG LYS 33 -0.909 -13.981 -19.419 257 HG3 LYS 33 1HG LYS 33 -2.350 -13.387 -20.243 258 HD2 LYS 33 2HD LYS 33 -1.998 -14.995 -22.039 259 HD3 LYS 33 1HD LYS 33 -0.526 -15.571 -21.262 260 HE2 LYS 33 2HE LYS 33 -3.311 -15.718 -20.086 261 HE3 LYS 33 1HE LYS 33 -2.452 -17.056 -20.841 262 HZ1 LYS 33 3HZ LYS 33 -1.523 -15.627 -18.388 263 HZ2 LYS 33 1HZ LYS 33 -0.798 -16.943 -19.119 264 HZ3 LYS 33 2HZ LYS 33 -2.309 -17.128 -18.421 265 H SER 34 H SER 34 -0.462 -8.967 -20.871 266 HA SER 34 HA SER 34 1.637 -8.872 -22.887 267 HB2 SER 34 2HB SER 34 -0.448 -7.696 -23.284 268 HB3 SER 34 1HB SER 34 -0.239 -6.766 -21.805 269 HG SER 34 HG SER 34 1.479 -6.730 -24.059 270 H SER 35 H SER 35 1.191 -8.129 -19.544 271 HA SER 35 HA SER 35 2.529 -7.436 -17.863 272 HB2 SER 35 2HB SER 35 4.778 -7.961 -19.794 273 HB3 SER 35 1HB SER 35 4.903 -7.847 -18.035 274 HG SER 35 HG SER 35 3.693 -9.675 -17.826 275 H LYS 36 H LYS 36 2.883 -5.656 -20.821 276 HA LYS 36 HA LYS 36 4.065 -3.365 -19.375 277 HB2 LYS 36 2HB LYS 36 5.433 -2.892 -21.354 278 HB3 LYS 36 1HB LYS 36 5.802 -4.473 -20.673 279 HG2 LYS 36 2HG LYS 36 4.435 -5.543 -22.382 280 HG3 LYS 36 1HG LYS 36 4.037 -3.970 -23.057 281 HD2 LYS 36 2HD LYS 36 6.421 -3.609 -23.551 282 HD3 LYS 36 1HD LYS 36 6.776 -5.215 -22.898 283 HE2 LYS 36 2HE LYS 36 5.325 -6.222 -24.579 284 HE3 LYS 36 1HE LYS 36 4.964 -4.629 -25.234 285 HZ1 LYS 36 3HZ LYS 36 7.300 -4.377 -25.789 286 HZ2 LYS 36 1HZ LYS 36 6.638 -5.737 -26.531 287 HZ3 LYS 36 2HZ LYS 36 7.637 -5.920 -25.184 288 H GLY 37 H GLY 37 1.354 -4.312 -20.752 289 HA2 GLY 37 2HA GLY 37 0.886 -2.296 -22.720 290 HA3 GLY 37 1HA GLY 37 -0.322 -3.341 -21.978 291 H ASP 38 H ASP 38 -1.363 -1.050 -22.257 292 HA ASP 38 HA ASP 38 -0.686 0.639 -20.032 293 HB2 ASP 38 2HB ASP 38 -2.825 0.910 -22.130 294 HB3 ASP 38 1HB ASP 38 -2.681 2.012 -20.769 295 H PHE 39 H PHE 39 -1.260 0.196 -18.141 296 HA PHE 39 HA PHE 39 -3.885 -0.995 -17.701 297 HB2 PHE 39 2HB PHE 39 -1.387 -1.229 -15.982 298 HB3 PHE 39 1HB PHE 39 -2.932 -2.010 -15.673 299 HD1 PHE 39 1HD PHE 39 -3.769 -3.619 -17.559 300 HD2 PHE 39 2HD PHE 39 0.277 -2.422 -17.106 301 HE1 PHE 39 1HE PHE 39 -3.045 -5.576 -18.859 302 HE2 PHE 39 2HE PHE 39 1.003 -4.365 -18.404 303 HZ PHE 39 HZ PHE 39 -0.659 -5.951 -19.284 304 H LEU 40 H LEU 40 -5.195 0.323 -16.640 305 HA LEU 40 HA LEU 40 -3.957 2.752 -15.514 306 HB2 LEU 40 2HB LEU 40 -6.776 2.555 -16.619 307 HB3 LEU 40 1HB LEU 40 -5.964 3.958 -15.965 308 HG LEU 40 HG LEU 40 -5.214 2.561 -18.523 309 HD11 LEU 40 1HD1 LEU 40 -6.560 5.205 -18.026 310 HD12 LEU 40 2HD1 LEU 40 -7.300 3.762 -18.723 311 HD13 LEU 40 3HD1 LEU 40 -6.017 4.604 -19.589 312 HD21 LEU 40 3HD2 LEU 40 -3.261 3.513 -17.470 313 HD22 LEU 40 1HD2 LEU 40 -4.094 5.053 -17.233 314 HD23 LEU 40 2HD2 LEU 40 -3.717 4.485 -18.864 315 H ILE 41 H ILE 41 -4.166 3.074 -13.472 316 HA ILE 41 HA ILE 41 -6.136 1.455 -12.068 317 HB ILE 41 HB ILE 41 -3.565 2.617 -10.958 318 HG12 ILE 41 2HG1 ILE 41 -4.229 -0.146 -12.044 319 HG13 ILE 41 1HG1 ILE 41 -2.927 0.931 -12.431 320 HG21 ILE 41 1HG2 ILE 41 -5.575 0.724 -9.744 321 HG22 ILE 41 2HG2 ILE 41 -5.328 2.401 -9.289 322 HG23 ILE 41 3HG2 ILE 41 -4.053 1.212 -8.984 323 HD11 ILE 41 3HD1 ILE 41 -1.786 0.477 -10.407 324 HD12 ILE 41 1HD1 ILE 41 -2.371 -1.085 -11.097 325 HD13 ILE 41 2HD1 ILE 41 -3.215 -0.355 -9.772 326 H ARG 42 H ARG 42 -7.472 2.356 -10.704 327 HA ARG 42 HA ARG 42 -8.174 5.090 -10.980 328 HB2 ARG 42 2HB ARG 42 -9.627 3.065 -10.367 329 HB3 ARG 42 1HB ARG 42 -8.981 3.253 -8.749 330 HG2 ARG 42 2HG ARG 42 -11.058 4.414 -8.688 331 HG3 ARG 42 1HG ARG 42 -9.817 5.613 -8.855 332 HD2 ARG 42 2HD ARG 42 -10.415 6.260 -10.889 333 HD3 ARG 42 1HD ARG 42 -10.877 4.625 -11.432 334 HE ARG 42 HE ARG 42 -12.691 5.536 -9.519 335 HH11 ARG 42 1HH1 ARG 42 -11.749 6.402 -12.833 336 HH12 ARG 42 2HH1 ARG 42 -13.287 6.956 -13.274 337 HH21 ARG 42 1HH2 ARG 42 -14.794 6.290 -10.133 338 HH22 ARG 42 2HH2 ARG 42 -15.082 6.896 -11.689 339 H THR 43 H THR 43 -7.402 6.689 -9.869 340 HA THR 43 HA THR 43 -5.978 6.183 -7.387 341 HB THR 43 HB THR 43 -4.330 6.506 -9.249 342 HG1 THR 43 1HG THR 43 -3.366 7.143 -7.554 343 HG21 THR 43 3HG2 THR 43 -5.514 9.276 -9.398 344 HG22 THR 43 1HG2 THR 43 -5.614 8.035 -10.646 345 HG23 THR 43 2HG2 THR 43 -4.050 8.743 -10.222 346 H LYS 44 H LYS 44 -5.882 8.082 -6.010 347 HA LYS 44 HA LYS 44 -8.388 9.595 -6.286 348 HB2 LYS 44 2HB LYS 44 -6.788 8.894 -3.821 349 HB3 LYS 44 1HB LYS 44 -8.341 9.716 -3.851 350 HG2 LYS 44 2HG LYS 44 -9.444 7.759 -4.672 351 HG3 LYS 44 1HG LYS 44 -7.904 6.930 -4.900 352 HD2 LYS 44 2HD LYS 44 -7.518 7.065 -2.468 353 HD3 LYS 44 1HD LYS 44 -9.109 7.815 -2.295 354 HE2 LYS 44 2HE LYS 44 -10.193 5.833 -3.137 355 HE3 LYS 44 1HE LYS 44 -8.645 5.093 -3.512 356 HZ1 LYS 44 3HZ LYS 44 -9.546 4.200 -1.495 357 HZ2 LYS 44 1HZ LYS 44 -9.624 5.739 -0.771 358 HZ3 LYS 44 2HZ LYS 44 -8.131 5.046 -1.171 359 H LYS 45 H LYS 45 -7.941 11.557 -6.990 360 HA LYS 45 HA LYS 45 -5.696 13.059 -5.858 361 HB2 LYS 45 2HB LYS 45 -5.015 12.190 -8.035 362 HB3 LYS 45 1HB LYS 45 -6.388 12.831 -8.842 363 HG2 LYS 45 2HG LYS 45 -5.613 15.102 -8.262 364 HG3 LYS 45 1HG LYS 45 -4.158 14.360 -7.584 365 HD2 LYS 45 2HD LYS 45 -3.601 14.919 -9.872 366 HD3 LYS 45 1HD LYS 45 -3.909 13.172 -9.686 367 HE2 LYS 45 2HE LYS 45 -6.047 13.305 -10.693 368 HE3 LYS 45 1HE LYS 45 -5.988 15.068 -10.693 369 HZ1 LYS 45 3HZ LYS 45 -4.185 13.309 -12.289 370 HZ2 LYS 45 1HZ LYS 45 -4.251 14.996 -12.324 371 HZ3 LYS 45 2HZ LYS 45 -5.555 14.094 -12.873 372 H ASP 46 H ASP 46 -6.474 14.842 -4.953 373 HA ASP 46 HA ASP 46 -7.781 16.617 -4.358 374 HB2 ASP 46 2HB ASP 46 -8.693 16.494 -7.255 375 HB3 ASP 46 1HB ASP 46 -9.138 17.777 -6.143 376 H GLY 47 H GLY 47 -8.688 13.955 -4.000 377 HA2 GLY 47 2HA GLY 47 -10.560 12.903 -3.137 378 HA3 GLY 47 1HA GLY 47 -11.400 14.446 -3.246 379 H LYS 48 H LYS 48 -9.963 13.350 -6.131 380 HA LYS 48 HA LYS 48 -12.568 12.471 -7.185 381 HB2 LYS 48 2HB LYS 48 -10.221 13.716 -8.628 382 HB3 LYS 48 1HB LYS 48 -11.767 13.283 -9.341 383 HG2 LYS 48 2HG LYS 48 -12.884 14.973 -8.060 384 HG3 LYS 48 1HG LYS 48 -11.394 15.340 -7.185 385 HD2 LYS 48 2HD LYS 48 -10.354 16.021 -9.311 386 HD3 LYS 48 1HD LYS 48 -11.885 15.712 -10.135 387 HE2 LYS 48 2HE LYS 48 -12.983 17.373 -8.766 388 HE3 LYS 48 1HE LYS 48 -11.488 17.658 -7.876 389 HZ1 LYS 48 3HZ LYS 48 -11.903 18.163 -10.766 390 HZ2 LYS 48 1HZ LYS 48 -10.484 18.448 -9.935 391 HZ3 LYS 48 2HZ LYS 48 -11.873 19.332 -9.560 392 H GLN 49 H GLN 49 -12.483 10.623 -8.534 393 HA GLN 49 HA GLN 49 -10.028 9.094 -8.245 394 HB2 GLN 49 2HB GLN 49 -12.814 8.194 -8.923 395 HB3 GLN 49 1HB GLN 49 -11.412 7.150 -8.836 396 HG2 GLN 49 2HG GLN 49 -11.214 7.768 -6.433 397 HG3 GLN 49 1HG GLN 49 -12.759 8.614 -6.592 398 HE21 GLN 49 1HE2 GLN 49 -12.069 6.309 -4.990 399 HE22 GLN 49 2HE2 GLN 49 -13.153 5.049 -5.439 400 H VAL 50 H VAL 50 -8.844 8.890 -9.934 401 HA VAL 50 HA VAL 50 -10.064 9.156 -12.592 402 HB VAL 50 HB VAL 50 -8.127 10.451 -13.422 403 HG11 VAL 50 1HG1 VAL 50 -8.597 12.601 -12.358 404 HG12 VAL 50 2HG1 VAL 50 -9.419 11.771 -11.044 405 HG13 VAL 50 3HG1 VAL 50 -10.085 11.706 -12.681 406 HG21 VAL 50 3HG2 VAL 50 -6.520 11.456 -11.856 407 HG22 VAL 50 1HG2 VAL 50 -6.432 9.694 -11.851 408 HG23 VAL 50 2HG2 VAL 50 -7.248 10.539 -10.537 409 H TRP 51 H TRP 51 -8.595 8.272 -14.316 410 HA TRP 51 HA TRP 51 -7.372 5.846 -13.297 411 HB2 TRP 51 2HB TRP 51 -8.110 6.680 -16.105 412 HB3 TRP 51 1HB TRP 51 -7.453 5.130 -15.715 413 HD1 TRP 51 HD TRP 51 -10.484 6.780 -16.303 414 HE1 TRP 51 1HE TRP 51 -12.543 5.371 -15.540 415 HE3 TRP 51 3HE TRP 51 -8.062 3.436 -13.395 416 HZ2 TRP 51 2HZ TRP 51 -13.015 3.124 -13.926 417 HZ3 TRP 51 3HZ TRP 51 -9.359 1.671 -12.265 418 HH2 TRP 51 HH TRP 51 -11.782 1.523 -12.517 419 H GLU 52 H GLU 52 -5.276 5.819 -13.032 420 HA GLU 52 HA GLU 52 -3.601 7.526 -14.737 421 HB2 GLU 52 2HB GLU 52 -3.667 8.316 -12.418 422 HB3 GLU 52 1HB GLU 52 -3.165 6.729 -11.853 423 HG2 GLU 52 2HG GLU 52 -1.308 8.302 -11.870 424 HG3 GLU 52 1HG GLU 52 -1.069 6.968 -13.017 425 H ALA 53 H ALA 53 -1.698 6.604 -15.464 426 HA ALA 53 HA ALA 53 -1.841 3.856 -16.048 427 HB1 ALA 53 1HB ALA 53 0.519 5.715 -16.300 428 HB2 ALA 53 2HB ALA 53 -0.739 5.482 -17.514 429 HB3 ALA 53 3HB ALA 53 0.339 4.150 -17.089 430 H ALA 54 H ALA 54 -0.941 2.146 -15.190 431 HA ALA 54 HA ALA 54 -0.047 2.002 -12.562 432 HB1 ALA 54 1HB ALA 54 0.491 0.086 -14.822 433 HB2 ALA 54 2HB ALA 54 -0.952 0.104 -13.810 434 HB3 ALA 54 3HB ALA 54 0.620 -0.275 -13.101 435 H SER 55 H SER 55 2.173 1.020 -11.989 436 HA SER 55 HA SER 55 4.140 2.808 -13.166 437 HB2 SER 55 2HB SER 55 3.740 3.108 -10.746 438 HB3 SER 55 1HB SER 55 4.032 1.397 -10.472 439 HG SER 55 HG SER 55 5.793 2.973 -10.074 440 H LYS 56 H LYS 56 6.067 1.882 -13.869 441 HA LYS 56 HA LYS 56 5.867 -0.699 -14.932 442 HB2 LYS 56 2HB LYS 56 7.273 1.094 -15.890 443 HB3 LYS 56 1HB LYS 56 8.298 1.026 -14.472 444 HG2 LYS 56 2HG LYS 56 9.076 -1.166 -15.058 445 HG3 LYS 56 1HG LYS 56 7.918 -1.260 -16.386 446 HD2 LYS 56 2HD LYS 56 8.998 0.574 -17.519 447 HD3 LYS 56 1HD LYS 56 10.116 0.799 -16.179 448 HE2 LYS 56 2HE LYS 56 11.055 -1.387 -16.574 449 HE3 LYS 56 1HE LYS 56 9.890 -1.680 -17.866 450 HZ1 LYS 56 3HZ LYS 56 12.043 -0.996 -18.732 451 HZ2 LYS 56 1HZ LYS 56 11.961 0.452 -17.871 452 HZ3 LYS 56 2HZ LYS 56 10.850 0.130 -19.110 453 H THR 57 H THR 57 7.383 0.573 -12.048 454 HA THR 57 HA THR 57 8.584 -1.828 -11.204 455 HB THR 57 HB THR 57 7.698 0.573 -9.590 456 HG1 THR 57 1HG THR 57 9.674 1.405 -10.137 457 HG21 THR 57 3HG2 THR 57 9.839 -1.503 -9.057 458 HG22 THR 57 1HG2 THR 57 8.284 -1.411 -8.231 459 HG23 THR 57 2HG2 THR 57 9.465 -0.115 -8.038 460 H ALA 58 H ALA 58 5.434 -0.360 -10.626 461 HA ALA 58 HA ALA 58 4.537 -2.270 -8.712 462 HB1 ALA 58 1HB ALA 58 2.898 -0.527 -10.566 463 HB2 ALA 58 2HB ALA 58 3.442 -0.077 -8.947 464 HB3 ALA 58 3HB ALA 58 2.285 -1.390 -9.158 465 H LEU 59 H LEU 59 4.345 -2.038 -12.219 466 HA LEU 59 HA LEU 59 2.827 -4.338 -12.635 467 HB2 LEU 59 2HB LEU 59 4.823 -2.851 -14.328 468 HB3 LEU 59 1HB LEU 59 3.870 -4.288 -14.904 469 HG LEU 59 HG LEU 59 2.723 -1.648 -13.984 470 HD11 LEU 59 1HD1 LEU 59 4.137 -1.338 -15.984 471 HD12 LEU 59 2HD1 LEU 59 2.428 -1.174 -16.374 472 HD13 LEU 59 3HD1 LEU 59 3.286 -2.658 -16.782 473 HD21 LEU 59 3HD2 LEU 59 0.731 -2.450 -15.046 474 HD22 LEU 59 1HD2 LEU 59 1.278 -3.685 -13.908 475 HD23 LEU 59 2HD2 LEU 59 1.589 -3.883 -15.632 476 H LYS 60 H LYS 60 6.355 -3.797 -12.444 477 HA LYS 60 HA LYS 60 7.151 -6.430 -12.908 478 HB2 LYS 60 2HB LYS 60 8.477 -4.360 -11.140 479 HB3 LYS 60 1HB LYS 60 9.207 -5.889 -11.599 480 HG2 LYS 60 2HG LYS 60 8.404 -3.695 -13.487 481 HG3 LYS 60 1HG LYS 60 10.041 -4.036 -12.930 482 HD2 LYS 60 2HD LYS 60 9.903 -6.271 -13.951 483 HD3 LYS 60 1HD LYS 60 8.284 -5.890 -14.544 484 HE2 LYS 60 2HE LYS 60 9.198 -4.023 -15.814 485 HE3 LYS 60 1HE LYS 60 10.812 -4.424 -15.224 486 HZ1 LYS 60 3HZ LYS 60 9.103 -6.194 -16.895 487 HZ2 LYS 60 1HZ LYS 60 10.642 -6.574 -16.359 488 HZ3 LYS 60 2HZ LYS 60 10.419 -5.323 -17.453 489 H LYS 61 H LYS 61 6.163 -4.914 -9.883 490 HA LYS 61 HA LYS 61 6.668 -7.154 -8.228 491 HB2 LYS 61 2HB LYS 61 4.667 -4.920 -7.904 492 HB3 LYS 61 1HB LYS 61 5.077 -6.074 -6.647 493 HG2 LYS 61 2HG LYS 61 7.372 -5.283 -6.648 494 HG3 LYS 61 1HG LYS 61 6.987 -4.155 -7.948 495 HD2 LYS 61 2HD LYS 61 5.386 -3.023 -6.493 496 HD3 LYS 61 1HD LYS 61 5.754 -4.165 -5.197 497 HE2 LYS 61 2HE LYS 61 8.065 -3.415 -5.188 498 HE3 LYS 61 1HE LYS 61 7.723 -2.296 -6.499 499 HZ1 LYS 61 3HZ LYS 61 7.732 -1.210 -4.339 500 HZ2 LYS 61 1HZ LYS 61 6.428 -2.174 -3.823 501 HZ3 LYS 61 2HZ LYS 61 6.245 -1.102 -5.092 502 H SER 62 H SER 62 3.866 -6.164 -10.064 503 HA SER 62 HA SER 62 2.103 -8.183 -9.123 504 HB2 SER 62 2HB SER 62 2.022 -6.588 -11.695 505 HB3 SER 62 1HB SER 62 0.678 -7.458 -10.952 506 HG SER 62 HG SER 62 2.061 -5.196 -9.965 507 H TRP 63 H TRP 63 4.344 -7.948 -11.881 508 HA TRP 63 HA TRP 63 3.581 -10.450 -12.950 509 HB2 TRP 63 2HB TRP 63 4.549 -8.719 -14.381 510 HB3 TRP 63 1HB TRP 63 6.036 -8.746 -13.441 511 HD1 TRP 63 HD TRP 63 7.784 -10.471 -14.057 512 HE1 TRP 63 1HE TRP 63 7.972 -12.340 -15.865 513 HE3 TRP 63 3HE TRP 63 2.973 -10.484 -15.713 514 HZ2 TRP 63 2HZ TRP 63 6.279 -13.618 -17.723 515 HZ3 TRP 63 3HZ TRP 63 2.337 -12.068 -17.508 516 HH2 TRP 63 HH TRP 63 3.964 -13.581 -18.482 517 H LYS 64 H LYS 64 5.927 -9.340 -10.648 518 HA LYS 64 HA LYS 64 7.430 -11.700 -10.481 519 HB2 LYS 64 2HB LYS 64 8.186 -9.542 -9.578 520 HB3 LYS 64 1HB LYS 64 6.906 -9.547 -8.399 521 HG2 LYS 64 2HG LYS 64 9.098 -11.627 -8.435 522 HG3 LYS 64 1HG LYS 64 9.265 -10.088 -7.599 523 HD2 LYS 64 2HD LYS 64 7.153 -12.186 -7.047 524 HD3 LYS 64 1HD LYS 64 8.598 -11.903 -6.076 525 HE2 LYS 64 2HE LYS 64 7.810 -9.594 -5.639 526 HE3 LYS 64 1HE LYS 64 6.339 -9.949 -6.540 527 HZ1 LYS 64 3HZ LYS 64 5.920 -10.188 -4.228 528 HZ2 LYS 64 1HZ LYS 64 7.217 -11.236 -4.016 529 HZ3 LYS 64 2HZ LYS 64 5.865 -11.711 -4.918 530 H ARG 65 H ARG 65 4.463 -10.672 -8.898 531 HA ARG 65 HA ARG 65 4.153 -12.986 -7.289 532 HB2 ARG 65 2HB ARG 65 2.861 -10.921 -6.869 533 HB3 ARG 65 1HB ARG 65 2.048 -11.109 -8.397 534 HG2 ARG 65 2HG ARG 65 0.644 -11.753 -6.492 535 HG3 ARG 65 1HG ARG 65 0.914 -13.123 -7.551 536 HD2 ARG 65 2HD ARG 65 2.732 -13.794 -6.138 537 HD3 ARG 65 1HD ARG 65 2.289 -12.491 -5.001 538 HE ARG 65 HE ARG 65 0.178 -14.338 -5.729 539 HH11 ARG 65 1HH1 ARG 65 2.738 -13.696 -3.341 540 HH12 ARG 65 2HH1 ARG 65 2.032 -14.660 -2.137 541 HH21 ARG 65 1HH2 ARG 65 -0.759 -15.670 -4.077 542 HH22 ARG 65 2HH2 ARG 65 0.008 -15.821 -2.556 543 H TYR 66 H TYR 66 3.198 -12.103 -10.520 544 HA TYR 66 HA TYR 66 1.594 -14.277 -11.321 545 HB2 TYR 66 2HB TYR 66 2.058 -12.036 -12.448 546 HB3 TYR 66 1HB TYR 66 3.567 -12.733 -12.999 547 HD1 TYR 66 1HD TYR 66 3.543 -14.461 -14.715 548 HD2 TYR 66 2HD TYR 66 -0.029 -12.643 -13.369 549 HE1 TYR 66 1HE TYR 66 2.374 -15.295 -16.700 550 HE2 TYR 66 2HE TYR 66 -1.207 -13.471 -15.336 551 HH TYR 66 HH TYR 66 0.187 -15.832 -17.315 552 H GLU 67 H GLU 67 5.107 -13.761 -11.454 553 HA GLU 67 HA GLU 67 5.935 -16.304 -12.485 554 HB2 GLU 67 2HB GLU 67 7.366 -14.477 -10.553 555 HB3 GLU 67 1HB GLU 67 8.093 -15.789 -11.465 556 HG2 GLU 67 2HG GLU 67 6.711 -13.499 -12.655 557 HG3 GLU 67 1HG GLU 67 8.446 -13.437 -12.324 558 H GLN 68 H GLN 68 5.625 -15.131 -9.274 559 HA GLN 68 HA GLN 68 6.470 -17.419 -7.885 560 HB2 GLN 68 2HB GLN 68 4.345 -15.467 -7.062 561 HB3 GLN 68 1HB GLN 68 4.994 -16.709 -6.008 562 HG2 GLN 68 2HG GLN 68 7.180 -15.683 -6.138 563 HG3 GLN 68 1HG GLN 68 6.546 -14.460 -7.245 564 HE21 GLN 68 1HE2 GLN 68 6.492 -15.652 -3.988 565 HE22 GLN 68 2HE2 GLN 68 5.771 -14.254 -3.286 566 H GLU 69 H GLU 69 3.137 -16.594 -8.811 567 HA GLU 69 HA GLU 69 2.294 -19.037 -7.715 568 HB2 GLU 69 2HB GLU 69 0.711 -17.016 -9.263 569 HB3 GLU 69 1HB GLU 69 0.025 -18.505 -8.604 570 HG2 GLU 69 2HG GLU 69 0.862 -17.829 -6.375 571 HG3 GLU 69 1HG GLU 69 1.337 -16.288 -7.068 572 H MET 70 H MET 70 3.093 -18.174 -10.956 573 HA MET 70 HA MET 70 2.112 -20.661 -12.027 574 HB2 MET 70 2HB MET 70 4.276 -18.875 -13.103 575 HB3 MET 70 1HB MET 70 3.616 -20.256 -13.965 576 HG2 MET 70 2HG MET 70 1.406 -19.146 -13.925 577 HG3 MET 70 1HG MET 70 2.175 -17.742 -13.182 578 HE1 MET 70 3HE MET 70 4.735 -16.707 -15.967 579 HE2 MET 70 1HE MET 70 5.050 -17.935 -14.735 580 HE3 MET 70 2HE MET 70 4.198 -16.449 -14.306 581 H LEU 71 H LEU 71 5.101 -19.590 -10.613 582 HA LEU 71 HA LEU 71 6.651 -21.885 -11.088 583 HB2 LEU 71 2HB LEU 71 7.633 -19.836 -10.611 584 HB3 LEU 71 1HB LEU 71 6.772 -19.546 -9.148 585 HG LEU 71 HG LEU 71 8.113 -21.555 -8.238 586 HD11 LEU 71 1HD1 LEU 71 10.254 -21.968 -9.406 587 HD12 LEU 71 2HD1 LEU 71 9.680 -20.987 -10.747 588 HD13 LEU 71 3HD1 LEU 71 8.850 -22.489 -10.341 589 HD21 LEU 71 3HD2 LEU 71 8.582 -19.267 -7.582 590 HD22 LEU 71 1HD2 LEU 71 9.560 -19.031 -9.031 591 HD23 LEU 71 2HD2 LEU 71 10.086 -20.165 -7.789 592 H LYS 72 H LYS 72 4.389 -20.929 -8.612 593 HA LYS 72 HA LYS 72 4.764 -23.229 -6.961 594 HB2 LYS 72 2HB LYS 72 2.590 -21.143 -7.038 595 HB3 LYS 72 1HB LYS 72 2.629 -22.465 -5.880 596 HG2 LYS 72 2HG LYS 72 4.805 -20.410 -6.179 597 HG3 LYS 72 1HG LYS 72 3.489 -20.307 -5.006 598 HD2 LYS 72 2HD LYS 72 4.209 -22.381 -3.982 599 HD3 LYS 72 1HD LYS 72 5.473 -22.571 -5.193 600 HE2 LYS 72 2HE LYS 72 6.596 -20.608 -4.388 601 HE3 LYS 72 1HE LYS 72 5.276 -20.270 -3.271 602 HZ1 LYS 72 3HZ LYS 72 5.764 -22.244 -2.078 603 HZ2 LYS 72 1HZ LYS 72 7.221 -21.379 -2.230 604 HZ3 LYS 72 2HZ LYS 72 6.926 -22.720 -3.198 605 H ASN 73 H ASN 73 2.524 -22.383 -9.561 606 HA ASN 73 HA ASN 73 1.053 -24.840 -9.084 607 HB2 ASN 73 2HB ASN 73 -0.190 -22.715 -9.544 608 HB3 ASN 73 1HB ASN 73 0.472 -22.727 -11.171 609 HD21 ASN 73 1HD2 ASN 73 -1.800 -24.187 -8.983 610 HD22 ASN 73 2HD2 ASN 73 -2.657 -25.084 -10.170 611 H GLU 74 H GLU 74 1.887 -23.496 -12.324 612 HA GLU 74 HA GLU 74 3.595 -25.699 -12.863 613 HB2 GLU 74 2HB GLU 74 2.335 -26.752 -14.642 614 HB3 GLU 74 1HB GLU 74 1.407 -26.815 -13.156 615 HG2 GLU 74 2HG GLU 74 0.020 -24.997 -13.926 616 HG3 GLU 74 1HG GLU 74 0.985 -24.846 -15.390 617 H LYS 75 H LYS 75 4.959 -25.265 -14.322 618 HA LYS 75 HA LYS 75 4.973 -24.316 -16.796 619 HB2 LYS 75 2HB LYS 75 4.120 -22.069 -15.985 620 HB3 LYS 75 1HB LYS 75 5.556 -21.936 -14.969 621 HG2 LYS 75 2HG LYS 75 6.985 -21.922 -16.915 622 HG3 LYS 75 1HG LYS 75 5.593 -22.173 -17.962 623 HD2 LYS 75 2HD LYS 75 4.691 -20.012 -17.276 624 HD3 LYS 75 1HD LYS 75 6.095 -19.763 -16.229 625 HE2 LYS 75 2HE LYS 75 6.330 -18.602 -18.397 626 HE3 LYS 75 1HE LYS 75 7.580 -19.819 -18.151 627 HZ1 LYS 75 3HZ LYS 75 5.137 -20.147 -19.835 628 HZ2 LYS 75 1HZ LYS 75 6.317 -21.331 -19.598 629 HZ3 LYS 75 2HZ LYS 75 6.684 -19.900 -20.387 630 H VAL 76 H VAL 76 6.374 -23.729 -13.728 631 HA VAL 76 HA VAL 76 8.548 -25.420 -14.184 632 HB VAL 76 HB VAL 76 9.538 -23.416 -15.095 633 HG11 VAL 76 1HG1 VAL 76 9.820 -21.316 -13.798 634 HG12 VAL 76 2HG1 VAL 76 8.769 -21.987 -12.550 635 HG13 VAL 76 3HG1 VAL 76 8.132 -21.682 -14.162 636 HG21 VAL 76 3HG2 VAL 76 11.036 -24.776 -13.790 637 HG22 VAL 76 1HG2 VAL 76 10.573 -23.933 -12.310 638 HG23 VAL 76 2HG2 VAL 76 11.469 -23.081 -13.569 639 H ALA 77 H ALA 77 8.305 -26.610 -12.545 640 HA ALA 77 HA ALA 77 6.850 -25.583 -10.271 641 HB1 ALA 77 1HB ALA 77 6.128 -27.672 -11.307 642 HB2 ALA 77 2HB ALA 77 6.563 -27.888 -9.612 643 HB3 ALA 77 3HB ALA 77 7.672 -28.405 -10.879 644 H ALA 78 H ALA 78 7.942 -24.657 -8.752 645 HA ALA 78 HA ALA 78 10.524 -25.695 -7.932 646 HB1 ALA 78 1HB ALA 78 10.198 -23.266 -7.878 647 HB2 ALA 78 2HB ALA 78 10.505 -23.877 -6.254 648 HB3 ALA 78 3HB ALA 78 8.864 -23.455 -6.745 649 H LYS 79 H LYS 79 7.793 -24.761 -5.877 650 HA LYS 79 HA LYS 79 7.234 -27.424 -5.035 651 HB2 LYS 79 2HB LYS 79 8.601 -25.516 -3.144 652 HB3 LYS 79 1HB LYS 79 7.513 -26.741 -2.545 653 HG2 LYS 79 2HG LYS 79 9.929 -27.446 -4.199 654 HG3 LYS 79 1HG LYS 79 10.042 -27.163 -2.468 655 HD2 LYS 79 2HD LYS 79 9.861 -29.538 -2.837 656 HD3 LYS 79 1HD LYS 79 8.374 -28.979 -2.103 657 HE2 LYS 79 2HE LYS 79 7.971 -30.622 -3.813 658 HE3 LYS 79 1HE LYS 79 7.261 -29.109 -4.316 659 HZ1 LYS 79 3HZ LYS 79 8.454 -30.217 -6.122 660 HZ2 LYS 79 1HZ LYS 79 9.850 -30.250 -5.207 661 HZ3 LYS 79 2HZ LYS 79 9.257 -28.778 -5.767 662 H MET 80 H MET 80 5.087 -27.398 -5.066 663 HA MET 80 HA MET 80 3.577 -25.005 -4.423 664 HB2 MET 80 2HB MET 80 2.796 -26.549 -6.205 665 HB3 MET 80 1HB MET 80 2.648 -27.842 -5.029 666 HG2 MET 80 2HG MET 80 0.920 -26.504 -3.847 667 HG3 MET 80 1HG MET 80 1.018 -25.306 -5.130 668 HE1 MET 80 3HE MET 80 -0.352 -27.277 -8.214 669 HE2 MET 80 1HE MET 80 1.343 -27.089 -7.737 670 HE3 MET 80 2HE MET 80 0.220 -25.734 -7.586 671 H LEU 81 H LEU 81 5.066 -27.409 -2.765 672 HA LEU 81 HA LEU 81 3.197 -27.924 -0.710 673 HB2 LEU 81 2HB LEU 81 6.176 -28.334 -0.742 674 HB3 LEU 81 1HB LEU 81 5.105 -28.898 0.524 675 HG LEU 81 HG LEU 81 5.093 -29.809 -2.350 676 HD11 LEU 81 1HD1 LEU 81 5.806 -31.950 -1.413 677 HD12 LEU 81 2HD1 LEU 81 5.917 -31.204 0.185 678 HD13 LEU 81 3HD1 LEU 81 6.975 -30.666 -1.121 679 HD21 LEU 81 3HD2 LEU 81 3.454 -31.462 -1.592 680 HD22 LEU 81 1HD2 LEU 81 2.835 -29.819 -1.445 681 HD23 LEU 81 2HD2 LEU 81 3.397 -30.678 -0.016 682 H GLU 82 H GLU 82 2.439 -26.110 0.070 683 HA GLU 82 HA GLU 82 3.921 -25.041 2.245 684 HB2 GLU 82 2HB GLU 82 3.240 -22.701 1.728 685 HB3 GLU 82 1HB GLU 82 4.458 -23.318 0.623 686 HG2 GLU 82 2HG GLU 82 2.750 -23.645 -1.087 687 HG3 GLU 82 1HG GLU 82 1.504 -23.116 0.043 688 H LYS 83 H LYS 83 2.346 -23.794 3.660 689 HA LYS 83 HA LYS 83 0.610 -23.911 4.950 690 HB2 LYS 83 2HB LYS 83 -0.657 -22.944 3.027 691 HB3 LYS 83 1HB LYS 83 -0.921 -24.553 2.395 692 HG2 LYS 83 2HG LYS 83 -2.049 -23.672 5.050 693 HG3 LYS 83 1HG LYS 83 -2.882 -23.377 3.528 694 HD2 LYS 83 2HD LYS 83 -2.900 -25.760 3.075 695 HD3 LYS 83 1HD LYS 83 -1.999 -26.034 4.565 696 HE2 LYS 83 2HE LYS 83 -4.754 -24.807 4.414 697 HE3 LYS 83 1HE LYS 83 -4.441 -26.501 4.787 698 HZ1 LYS 83 3HZ LYS 83 -4.802 -25.204 6.766 699 HZ2 LYS 83 1HZ LYS 83 -3.528 -24.172 6.399 700 HZ3 LYS 83 2HZ LYS 83 -3.231 -25.795 6.773 701 H ASP 84 H ASP 84 1.405 -25.419 6.119 702 HA ASP 84 HA ASP 84 0.516 -28.210 5.665 703 HB2 ASP 84 2HB ASP 84 2.934 -27.898 5.307 704 HB3 ASP 84 1HB ASP 84 3.087 -27.227 6.921 705 H ALA 85 H ALA 85 0.507 -25.514 7.693 706 HA ALA 85 HA ALA 85 0.056 -26.986 10.129 707 HB1 ALA 85 1HB ALA 85 1.349 -24.905 10.195 708 HB2 ALA 85 2HB ALA 85 -0.105 -24.805 11.192 709 HB3 ALA 85 3HB ALA 85 -0.060 -24.015 9.615 710 H THR 86 H THR 86 -1.825 -25.959 11.480 711 HA THR 86 HA THR 86 -3.986 -25.916 11.923 712 HB THR 86 HB THR 86 -4.440 -25.199 9.003 713 HG1 THR 86 1HG THR 86 -3.259 -23.844 10.931 714 HG21 THR 86 3HG2 THR 86 -6.208 -24.841 11.441 715 HG22 THR 86 1HG2 THR 86 -6.473 -26.000 10.138 716 HG23 THR 86 2HG2 THR 86 -6.575 -24.269 9.813 717 H GLU 87 H GLU 87 -4.086 -28.047 12.448 718 HA GLU 87 HA GLU 87 -5.100 -29.803 10.351 719 HB2 GLU 87 2HB GLU 87 -3.712 -30.463 12.947 720 HB3 GLU 87 1HB GLU 87 -4.397 -31.645 11.843 721 HG2 GLU 87 2HG GLU 87 -2.852 -30.962 10.107 722 HG3 GLU 87 1HG GLU 87 -2.189 -29.726 11.176 723 H VAL 88 H VAL 88 -7.188 -29.704 10.425 724 HA VAL 88 HA VAL 88 -8.468 -29.413 12.986 725 HB VAL 88 HB VAL 88 -10.600 -29.029 11.652 726 HG11 VAL 88 1HG1 VAL 88 -8.234 -27.227 11.095 727 HG12 VAL 88 2HG1 VAL 88 -9.255 -27.173 12.531 728 HG13 VAL 88 3HG1 VAL 88 -9.926 -26.764 10.952 729 HG21 VAL 88 3HG2 VAL 88 -8.646 -28.981 9.335 730 HG22 VAL 88 1HG2 VAL 88 -10.336 -28.479 9.259 731 HG23 VAL 88 2HG2 VAL 88 -9.928 -30.166 9.575 732 H GLY 89 H GLY 89 -7.992 -31.415 13.742 733 HA2 GLY 89 2HA GLY 89 -9.532 -33.629 12.587 734 HA3 GLY 89 1HA GLY 89 -8.190 -33.796 13.715 735 H VAL 90 H VAL 90 -9.156 -31.591 15.379 736 HA VAL 90 HA VAL 90 -10.973 -33.132 16.947 737 HB VAL 90 HB VAL 90 -10.866 -31.332 18.610 738 HG11 VAL 90 1HG1 VAL 90 -8.167 -32.159 17.572 739 HG12 VAL 90 2HG1 VAL 90 -9.187 -33.040 18.704 740 HG13 VAL 90 3HG1 VAL 90 -8.487 -31.491 19.173 741 HG21 VAL 90 3HG2 VAL 90 -10.703 -29.380 17.158 742 HG22 VAL 90 1HG2 VAL 90 -9.100 -29.877 16.623 743 HG23 VAL 90 2HG2 VAL 90 -9.355 -29.396 18.295 744 H LYS 91 H LYS 91 -13.031 -32.830 17.276 745 HA LYS 91 HA LYS 91 -14.350 -30.483 16.294 746 HB2 LYS 91 2HB LYS 91 -14.485 -31.859 14.373 747 HB3 LYS 91 1HB LYS 91 -15.020 -33.286 15.295 748 HG2 LYS 91 2HG LYS 91 -16.850 -32.337 14.049 749 HG3 LYS 91 1HG LYS 91 -17.112 -31.997 15.760 750 HD2 LYS 91 2HD LYS 91 -17.580 -29.957 14.597 751 HD3 LYS 91 1HD LYS 91 -16.002 -29.849 15.399 752 HE2 LYS 91 2HE LYS 91 -14.841 -30.248 13.310 753 HE3 LYS 91 1HE LYS 91 -16.385 -30.436 12.473 754 HZ1 LYS 91 3HZ LYS 91 -16.884 -28.106 13.018 755 HZ2 LYS 91 1HZ LYS 91 -15.443 -28.222 12.157 756 HZ3 LYS 91 2HZ LYS 91 -15.418 -27.977 13.809 757 H ALA 92 H ALA 92 -15.358 -29.862 18.058 758 HA ALA 92 HA ALA 92 -16.118 -31.782 20.058 759 HB1 ALA 92 1HB ALA 92 -15.100 -29.655 20.739 760 HB2 ALA 92 2HB ALA 92 -16.731 -29.826 21.394 761 HB3 ALA 92 3HB ALA 92 -16.443 -28.782 20.000 762 H ALA 93 H ALA 93 -17.770 -32.938 19.195 763 HA ALA 93 HA ALA 93 -20.250 -31.444 18.887 764 HB1 ALA 93 1HB ALA 93 -20.941 -32.894 17.045 765 HB2 ALA 93 2HB ALA 93 -19.390 -33.730 17.111 766 HB3 ALA 93 3HB ALA 93 -19.456 -32.032 16.636 767 H LEU 94 H LEU 94 -20.954 -31.969 20.866 768 HA LEU 94 HA LEU 94 -21.471 -34.818 21.329 769 HB2 LEU 94 2HB LEU 94 -20.967 -32.647 23.367 770 HB3 LEU 94 1HB LEU 94 -21.458 -34.279 23.754 771 HG LEU 94 HG LEU 94 -18.835 -33.469 22.484 772 HD11 LEU 94 1HD1 LEU 94 -17.857 -34.201 24.593 773 HD12 LEU 94 2HD1 LEU 94 -19.470 -34.505 25.236 774 HD13 LEU 94 3HD1 LEU 94 -18.978 -32.861 24.831 775 HD21 LEU 94 3HD2 LEU 94 -19.829 -36.193 23.341 776 HD22 LEU 94 1HD2 LEU 94 -18.195 -35.820 22.794 777 HD23 LEU 94 2HD2 LEU 94 -19.549 -35.660 21.682 778 H GLU 95 H GLU 95 -23.504 -35.362 21.720 779 HA GLU 95 HA GLU 95 -25.502 -33.270 21.408 780 HB2 GLU 95 2HB GLU 95 -25.756 -36.285 21.378 781 HB3 GLU 95 1HB GLU 95 -27.119 -35.196 21.232 782 HG2 GLU 95 2HG GLU 95 -26.520 -36.051 19.065 783 HG3 GLU 95 1HG GLU 95 -26.160 -34.332 19.121 784 H GLU 96 H GLU 96 -27.077 -32.837 22.916 785 HA GLU 96 HA GLU 96 -26.531 -33.969 25.538 786 HB2 GLU 96 2HB GLU 96 -27.626 -31.882 26.428 787 HB3 GLU 96 1HB GLU 96 -26.099 -31.639 25.606 788 HG2 GLU 96 2HG GLU 96 -27.307 -30.913 23.599 789 HG3 GLU 96 1HG GLU 96 -28.830 -31.138 24.454 790 H ALA 97 H ALA 97 -27.965 -35.158 26.498 791 HA ALA 97 HA ALA 97 -30.539 -35.550 25.197 792 HB1 ALA 97 1HB ALA 97 -30.607 -37.630 26.506 793 HB2 ALA 97 2HB ALA 97 -29.076 -37.196 27.263 794 HB3 ALA 97 3HB ALA 97 -29.141 -37.521 25.532 795 H LYS 98 H LYS 98 -32.321 -34.764 26.083 796 HA LYS 98 HA LYS 98 -32.524 -34.510 28.963 797 HB2 LYS 98 2HB LYS 98 -31.673 -32.315 28.173 798 HB3 LYS 98 1HB LYS 98 -33.056 -32.182 27.100 799 HG2 LYS 98 2HG LYS 98 -33.399 -30.820 29.072 800 HG3 LYS 98 1HG LYS 98 -34.546 -32.160 29.063 801 HD2 LYS 98 2HD LYS 98 -33.171 -33.380 30.656 802 HD3 LYS 98 1HD LYS 98 -31.957 -32.098 30.623 803 HE2 LYS 98 2HE LYS 98 -34.811 -31.802 31.547 804 HE3 LYS 98 1HE LYS 98 -33.413 -31.972 32.605 805 HZ1 LYS 98 3HZ LYS 98 -32.545 -29.901 31.746 806 HZ2 LYS 98 1HZ LYS 98 -34.087 -29.650 32.353 807 HZ3 LYS 98 2HZ LYS 98 -33.834 -29.716 30.695 808 H LYS 99 H LYS 99 -34.187 -35.868 29.162 809 HA LYS 99 HA LYS 99 -36.302 -35.788 27.199 810 HB2 LYS 99 2HB LYS 99 -35.882 -37.633 29.532 811 HB3 LYS 99 1HB LYS 99 -37.238 -37.701 28.421 812 HG2 LYS 99 2HG LYS 99 -35.651 -38.116 26.570 813 HG3 LYS 99 1HG LYS 99 -34.337 -38.142 27.748 814 HD2 LYS 99 2HD LYS 99 -35.039 -40.418 27.245 815 HD3 LYS 99 1HD LYS 99 -35.445 -40.000 28.911 816 HE2 LYS 99 2HE LYS 99 -37.766 -39.562 28.234 817 HE3 LYS 99 1HE LYS 99 -37.356 -39.966 26.569 818 HZ1 LYS 99 3HZ LYS 99 -38.430 -41.771 27.707 819 HZ2 LYS 99 1HZ LYS 99 -37.242 -41.792 28.901 820 HZ3 LYS 99 2HZ LYS 99 -36.859 -42.212 27.302 821 H VAL 100 H VAL 100 -38.022 -34.719 27.434 822 HA VAL 100 HA VAL 100 -38.786 -33.782 30.079 823 HB VAL 100 HB VAL 100 -40.309 -32.221 28.886 824 HG11 VAL 100 1HG1 VAL 100 -37.442 -32.098 27.959 825 HG12 VAL 100 2HG1 VAL 100 -38.071 -31.479 29.484 826 HG13 VAL 100 3HG1 VAL 100 -38.576 -30.747 27.961 827 HG21 VAL 100 3HG2 VAL 100 -40.120 -31.944 26.453 828 HG22 VAL 100 1HG2 VAL 100 -40.712 -33.552 26.873 829 HG23 VAL 100 2HG2 VAL 100 -39.032 -33.333 26.380 830 H GLN 101 H GLN 101 -41.187 -33.708 30.377 831 HA GLN 101 HA GLN 101 -42.607 -35.860 29.085 832 HB2 GLN 101 2HB GLN 101 -43.281 -36.835 31.275 833 HB3 GLN 101 1HB GLN 101 -41.567 -37.025 30.938 834 HG2 GLN 101 2HG GLN 101 -41.060 -35.166 32.435 835 HG3 GLN 101 1HG GLN 101 -42.778 -34.947 32.746 836 HE21 GLN 101 1HE2 GLN 101 -42.533 -35.278 34.901 837 HE22 GLN 101 2HE2 GLN 101 -42.217 -36.825 35.600 838 H ILE 102 H ILE 102 -44.555 -35.165 28.638 839 HA ILE 102 HA ILE 102 -45.532 -32.921 30.189 840 HB ILE 102 HB ILE 102 -47.125 -32.498 28.281 841 HG12 ILE 102 2HG1 ILE 102 -45.354 -34.500 26.840 842 HG13 ILE 102 1HG1 ILE 102 -47.055 -34.718 27.222 843 HG21 ILE 102 1HG2 ILE 102 -44.174 -32.331 27.697 844 HG22 ILE 102 2HG2 ILE 102 -45.141 -31.150 28.580 845 HG23 ILE 102 3HG2 ILE 102 -45.427 -31.414 26.860 846 HD11 ILE 102 3HD1 ILE 102 -46.736 -34.139 24.879 847 HD12 ILE 102 1HD1 ILE 102 -45.915 -32.653 25.351 848 HD13 ILE 102 2HD1 ILE 102 -47.623 -32.869 25.724 849 H GLU 103 H GLU 103 -46.371 -33.869 31.867 850 HA GLU 103 HA GLU 103 -48.050 -36.171 31.694 851 HB2 GLU 103 2HB GLU 103 -47.555 -34.306 34.023 852 HB3 GLU 103 1HB GLU 103 -48.316 -35.883 34.117 853 HG2 GLU 103 2HG GLU 103 -46.204 -36.919 33.371 854 HG3 GLU 103 1HG GLU 103 -45.456 -35.325 33.344 855 H LEU 104 H LEU 104 -50.253 -36.249 31.837 856 HA LEU 104 HA LEU 104 -51.633 -33.801 31.270 857 HB2 LEU 104 2HB LEU 104 -52.636 -36.638 31.565 858 HB3 LEU 104 1HB LEU 104 -53.702 -35.280 31.297 859 HG LEU 104 HG LEU 104 -53.406 -36.436 29.239 860 HD11 LEU 104 1HD1 LEU 104 -53.570 -34.051 29.055 861 HD12 LEU 104 2HD1 LEU 104 -52.554 -34.709 27.778 862 HD13 LEU 104 3HD1 LEU 104 -51.817 -33.893 29.159 863 HD21 LEU 104 3HD2 LEU 104 -51.209 -36.693 28.140 864 HD22 LEU 104 1HD2 LEU 104 -51.321 -37.600 29.649 865 HD23 LEU 104 2HD2 LEU 104 -50.433 -36.081 29.599 866 H ASP 105 H ASP 105 -52.502 -32.532 32.657 867 HA ASP 105 HA ASP 105 -52.504 -33.244 35.459 868 HB2 ASP 105 2HB ASP 105 -53.350 -30.670 34.093 869 HB3 ASP 105 1HB ASP 105 -53.233 -30.895 35.835 870 H THR 106 H THR 106 -54.645 -33.098 32.822 871 HA THR 106 HA THR 106 -56.728 -34.183 34.465 872 HB THR 106 HB THR 106 -57.216 -31.797 34.542 873 HG1 THR 106 1HG THR 106 -59.030 -32.948 34.520 874 HG21 THR 106 3HG2 THR 106 -57.292 -31.924 31.515 875 HG22 THR 106 1HG2 THR 106 -56.115 -31.045 32.491 876 HG23 THR 106 2HG2 THR 106 -57.807 -30.537 32.471 877 H SER 107 H SER 107 -58.104 -35.545 33.225 878 HA SER 107 HA SER 107 -57.118 -36.063 30.554 879 HB2 SER 107 2HB SER 107 -58.545 -38.144 30.772 880 HB3 SER 107 1HB SER 107 -57.237 -38.016 31.945 881 HG SER 107 HG SER 107 -59.979 -37.881 32.291 882 H LEU 108 H LEU 108 -59.562 -34.485 32.187 883 HA LEU 108 HA LEU 108 -61.373 -33.320 31.658 884 HB2 LEU 108 2HB LEU 108 -59.709 -32.381 29.989 885 HB3 LEU 108 1HB LEU 108 -60.393 -33.456 28.796 886 HG LEU 108 HG LEU 108 -61.142 -31.127 28.515 887 HD11 LEU 108 1HD1 LEU 108 -63.555 -31.441 28.380 888 HD12 LEU 108 2HD1 LEU 108 -63.408 -32.929 29.315 889 HD13 LEU 108 3HD1 LEU 108 -62.660 -32.806 27.722 890 HD21 LEU 108 3HD2 LEU 108 -61.035 -30.402 30.821 891 HD22 LEU 108 1HD2 LEU 108 -62.404 -31.434 31.230 892 HD23 LEU 108 2HD2 LEU 108 -62.627 -30.066 30.142 893 H SER 109 H SER 109 -62.959 -34.637 32.190 894 HA SER 109 HA SER 109 -64.080 -36.356 30.121 895 HB2 SER 109 2HB SER 109 -65.419 -37.290 32.066 896 HB3 SER 109 1HB SER 109 -63.683 -37.590 32.137 897 HG SER 109 HG SER 109 -64.528 -35.249 33.328 898 H TYR 110 H TYR 110 -65.633 -35.481 28.971 899 HA TYR 110 HA TYR 110 -67.710 -33.899 30.251 900 HB2 TYR 110 2HB TYR 110 -66.067 -32.227 29.542 901 HB3 TYR 110 1HB TYR 110 -66.045 -32.906 27.924 902 HD1 TYR 110 1HD TYR 110 -68.246 -31.199 30.385 903 HD2 TYR 110 2HD TYR 110 -67.531 -32.096 26.290 904 HE1 TYR 110 1HE TYR 110 -70.010 -29.613 29.733 905 HE2 TYR 110 2HE TYR 110 -69.293 -30.516 25.627 906 HH TYR 110 HH TYR 110 -71.272 -29.525 26.594 907 H ILE 111 H ILE 111 -69.555 -34.813 29.618 908 HA ILE 111 HA ILE 111 -69.974 -35.399 26.863 909 HB ILE 111 HB ILE 111 -69.000 -37.504 27.526 910 HG12 ILE 111 2HG1 ILE 111 -71.993 -37.809 27.315 911 HG13 ILE 111 1HG1 ILE 111 -70.914 -37.487 25.962 912 HG21 ILE 111 1HG2 ILE 111 -71.075 -37.659 29.710 913 HG22 ILE 111 2HG2 ILE 111 -69.340 -37.443 29.929 914 HG23 ILE 111 3HG2 ILE 111 -69.962 -38.951 29.259 915 HD11 ILE 111 3HD1 ILE 111 -71.504 -39.816 26.061 916 HD12 ILE 111 1HD1 ILE 111 -70.882 -39.917 27.719 917 HD13 ILE 111 2HD1 ILE 111 -69.783 -39.566 26.379 Start of MODEL 6 1 H1 GLY -1 1HT GLY -1 -6.218 -1.565 -31.558 2 H2 GLY -1 2HT GLY -1 -6.344 -2.386 -30.080 3 H3 GLY -1 3HT GLY -1 -5.123 -2.812 -31.191 4 HA2 GLY -1 1HA GLY -1 -4.098 -0.679 -30.939 5 HA3 GLY -1 2HA GLY -1 -5.352 -0.246 -29.779 6 H SER 0 H SER 0 -5.394 -1.276 -27.772 7 HA SER 0 HA SER 0 -3.396 -3.199 -27.118 8 HB2 SER 0 2HB SER 0 -2.467 -1.775 -25.284 9 HB3 SER 0 1HB SER 0 -2.080 -1.171 -26.894 10 HG SER 0 HG SER 0 -2.982 0.279 -25.117 11 H MET 1 H MET 1 -4.056 -4.384 -25.366 12 HA MET 1 HA MET 1 -6.767 -4.039 -24.573 13 HB2 MET 1 2HB MET 1 -5.733 -6.271 -24.767 14 HB3 MET 1 1HB MET 1 -4.646 -5.880 -23.444 15 HG2 MET 1 2HG MET 1 -6.487 -7.287 -22.706 16 HG3 MET 1 1HG MET 1 -6.536 -5.703 -21.929 17 HE1 MET 1 3HE MET 1 -10.313 -6.688 -22.295 18 HE2 MET 1 1HE MET 1 -9.042 -6.199 -21.174 19 HE3 MET 1 2HE MET 1 -8.959 -7.770 -21.966 20 H THR 2 H THR 2 -7.294 -2.411 -23.349 21 HA THR 2 HA THR 2 -5.443 -1.382 -21.373 22 HB THR 2 HB THR 2 -8.110 -0.296 -22.331 23 HG1 THR 2 1HG THR 2 -6.138 -0.526 -23.830 24 HG21 THR 2 3HG2 THR 2 -7.388 0.566 -20.146 25 HG22 THR 2 1HG2 THR 2 -7.292 1.817 -21.385 26 HG23 THR 2 2HG2 THR 2 -5.825 1.000 -20.835 27 H VAL 3 H VAL 3 -5.643 -2.101 -19.342 28 HA VAL 3 HA VAL 3 -8.270 -3.110 -18.467 29 HB VAL 3 HB VAL 3 -5.581 -3.698 -17.210 30 HG11 VAL 3 1HG1 VAL 3 -7.337 -3.951 -15.629 31 HG12 VAL 3 2HG1 VAL 3 -6.754 -5.533 -16.212 32 HG13 VAL 3 3HG1 VAL 3 -8.278 -4.906 -16.806 33 HG21 VAL 3 3HG2 VAL 3 -7.189 -5.450 -19.042 34 HG22 VAL 3 1HG2 VAL 3 -5.787 -5.920 -18.078 35 HG23 VAL 3 2HG2 VAL 3 -5.593 -4.739 -19.383 36 H TYR 4 H TYR 4 -9.194 -2.259 -16.653 37 HA TYR 4 HA TYR 4 -7.792 -0.007 -15.410 38 HB2 TYR 4 2HB TYR 4 -10.759 -0.547 -15.616 39 HB3 TYR 4 1HB TYR 4 -10.019 0.850 -14.832 40 HD1 TYR 4 2HD TYR 4 -10.566 -0.816 -18.084 41 HD2 TYR 4 1HD TYR 4 -9.213 2.691 -16.109 42 HE1 TYR 4 2HE TYR 4 -10.509 0.342 -20.222 43 HE2 TYR 4 1HE TYR 4 -9.159 3.877 -18.248 44 HH TYR 4 HH TYR 4 -10.609 2.619 -21.039 45 H ILE 5 H ILE 5 -7.524 0.061 -13.268 46 HA ILE 5 HA ILE 5 -8.374 -2.309 -11.711 47 HB ILE 5 HB ILE 5 -5.936 -0.587 -11.222 48 HG12 ILE 5 2HG1 ILE 5 -4.542 -2.422 -11.667 49 HG13 ILE 5 1HG1 ILE 5 -5.798 -3.527 -12.071 50 HG21 ILE 5 1HG2 ILE 5 -6.861 -1.445 -9.186 51 HG22 ILE 5 2HG2 ILE 5 -5.306 -2.223 -9.511 52 HG23 ILE 5 3HG2 ILE 5 -6.810 -3.087 -9.823 53 HD11 ILE 5 3HD1 ILE 5 -4.813 -1.129 -13.659 54 HD12 ILE 5 1HD1 ILE 5 -6.267 -2.027 -14.087 55 HD13 ILE 5 2HD1 ILE 5 -4.698 -2.827 -14.102 56 H CYS 6 H CYS 6 -9.818 -1.790 -10.208 57 HA CYS 6 HA CYS 6 -9.293 0.552 -8.563 58 HB2 CYS 6 2HB CYS 6 -12.032 -0.554 -9.248 59 HB3 CYS 6 1HB CYS 6 -11.734 0.641 -7.996 60 HG CYS 6 HG CYS 6 -10.604 1.378 -11.058 61 HA PRO 7 HA PRO 7 -8.647 -3.158 -6.021 62 HB2 PRO 7 2HB PRO 7 -7.400 -1.820 -3.974 63 HB3 PRO 7 1HB PRO 7 -6.568 -2.378 -5.426 64 HG2 PRO 7 2HG PRO 7 -7.629 0.345 -4.780 65 HG3 PRO 7 1HG PRO 7 -6.082 -0.100 -5.522 66 HD2 PRO 7 2HD PRO 7 -8.131 0.804 -6.970 67 HD3 PRO 7 1HD PRO 7 -7.040 -0.453 -7.605 68 H GLU 8 H GLU 8 -10.428 -0.390 -5.522 69 HA GLU 8 HA GLU 8 -11.438 -1.008 -2.850 70 HB2 GLU 8 2HB GLU 8 -12.409 1.142 -4.710 71 HB3 GLU 8 1HB GLU 8 -12.535 1.071 -2.967 72 HG2 GLU 8 2HG GLU 8 -10.153 1.393 -2.777 73 HG3 GLU 8 1HG GLU 8 -10.069 1.361 -4.556 74 H THR 9 H THR 9 -12.985 -0.006 -5.887 75 HA THR 9 HA THR 9 -15.396 -1.335 -5.070 76 HB THR 9 HB THR 9 -16.392 0.190 -6.771 77 HG1 THR 9 1HG THR 9 -15.044 1.160 -8.034 78 HG21 THR 9 3HG2 THR 9 -14.714 1.455 -4.601 79 HG22 THR 9 1HG2 THR 9 -16.325 0.773 -4.376 80 HG23 THR 9 2HG2 THR 9 -16.104 2.209 -5.381 81 H GLY 10 H GLY 10 -12.851 -2.357 -6.930 82 HA2 GLY 10 2HA GLY 10 -14.783 -3.522 -8.739 83 HA3 GLY 10 1HA GLY 10 -13.172 -3.275 -9.326 84 H ASP 11 H ASP 11 -13.239 -5.623 -9.652 85 HA ASP 11 HA ASP 11 -12.475 -7.071 -7.253 86 HB2 ASP 11 2HB ASP 11 -14.917 -7.417 -7.399 87 HB3 ASP 11 1HB ASP 11 -14.751 -7.932 -9.071 88 H ASP 12 H ASP 12 -11.374 -9.024 -7.758 89 HA ASP 12 HA ASP 12 -9.736 -8.635 -10.027 90 HB2 ASP 12 2HB ASP 12 -8.526 -10.641 -9.189 91 HB3 ASP 12 1HB ASP 12 -8.726 -9.368 -7.986 92 H GLY 13 H GLY 13 -12.669 -10.369 -9.551 93 HA2 GLY 13 2HA GLY 13 -12.049 -12.274 -11.670 94 HA3 GLY 13 1HA GLY 13 -13.478 -12.262 -10.649 95 H ASN 14 H ASN 14 -12.851 -9.171 -11.702 96 HA ASN 14 HA ASN 14 -15.109 -9.230 -13.472 97 HB2 ASN 14 2HB ASN 14 -13.291 -6.977 -12.664 98 HB3 ASN 14 1HB ASN 14 -14.590 -6.780 -13.826 99 HD21 ASN 14 1HD2 ASN 14 -14.262 -5.456 -11.328 100 HD22 ASN 14 2HD2 ASN 14 -15.642 -5.892 -10.362 101 H ASP 15 H ASP 15 -14.961 -7.857 -15.512 102 HA ASP 15 HA ASP 15 -13.298 -9.117 -17.447 103 HB2 ASP 15 2HB ASP 15 -15.522 -8.354 -18.022 104 HB3 ASP 15 1HB ASP 15 -15.124 -6.713 -17.552 105 H GLY 16 H GLY 16 -12.798 -6.495 -15.376 106 HA2 GLY 16 2HA GLY 16 -11.091 -5.017 -15.145 107 HA3 GLY 16 1HA GLY 16 -10.279 -5.870 -16.474 108 H SER 17 H SER 17 -13.369 -4.578 -16.770 109 HA SER 17 HA SER 17 -12.620 -2.748 -18.853 110 HB2 SER 17 2HB SER 17 -14.675 -4.024 -19.060 111 HB3 SER 17 1HB SER 17 -15.252 -3.427 -17.511 112 HG SER 17 HG SER 17 -14.855 -1.948 -19.899 113 H GLU 18 H GLU 18 -13.575 -0.436 -18.648 114 HA GLU 18 HA GLU 18 -12.647 0.806 -16.298 115 HB2 GLU 18 2HB GLU 18 -12.845 1.854 -18.601 116 HB3 GLU 18 1HB GLU 18 -14.579 1.916 -18.340 117 HG2 GLU 18 2HG GLU 18 -14.187 3.277 -16.342 118 HG3 GLU 18 1HG GLU 18 -12.472 3.271 -16.770 119 H LEU 19 H LEU 19 -15.705 -0.440 -17.462 120 HA LEU 19 HA LEU 19 -17.287 0.665 -15.348 121 HB2 LEU 19 2HB LEU 19 -17.904 -1.430 -17.423 122 HB3 LEU 19 1HB LEU 19 -19.062 -0.803 -16.272 123 HG LEU 19 HG LEU 19 -19.474 0.178 -18.312 124 HD11 LEU 19 1HD1 LEU 19 -19.740 1.688 -16.499 125 HD12 LEU 19 2HD1 LEU 19 -19.188 2.577 -17.918 126 HD13 LEU 19 3HD1 LEU 19 -18.058 2.201 -16.616 127 HD21 LEU 19 3HD2 LEU 19 -17.410 -0.193 -19.512 128 HD22 LEU 19 1HD2 LEU 19 -16.581 1.006 -18.519 129 HD23 LEU 19 2HD2 LEU 19 -17.852 1.512 -19.632 130 H LYS 20 H LYS 20 -15.460 -2.216 -15.884 131 HA LYS 20 HA LYS 20 -16.177 -3.269 -13.180 132 HB2 LYS 20 2HB LYS 20 -15.543 -5.123 -15.485 133 HB3 LYS 20 1HB LYS 20 -16.070 -5.501 -13.879 134 HG2 LYS 20 2HG LYS 20 -17.940 -5.995 -15.264 135 HG3 LYS 20 1HG LYS 20 -18.321 -4.525 -14.380 136 HD2 LYS 20 2HD LYS 20 -17.771 -3.192 -16.333 137 HD3 LYS 20 1HD LYS 20 -17.335 -4.647 -17.229 138 HE2 LYS 20 2HE LYS 20 -20.077 -3.988 -16.135 139 HE3 LYS 20 1HE LYS 20 -19.581 -3.890 -17.823 140 HZ1 LYS 20 3HZ LYS 20 -20.768 -5.928 -17.431 141 HZ2 LYS 20 1HZ LYS 20 -19.755 -6.359 -16.177 142 HZ3 LYS 20 2HZ LYS 20 -19.161 -6.318 -17.747 143 HA PRO 21 HA PRO 21 -11.792 -2.578 -13.814 144 HB2 PRO 21 2HB PRO 21 -11.349 -1.421 -11.410 145 HB3 PRO 21 1HB PRO 21 -11.897 -0.516 -12.824 146 HG2 PRO 21 2HG PRO 21 -13.493 -1.541 -10.512 147 HG3 PRO 21 1HG PRO 21 -13.598 0.022 -11.340 148 HD2 PRO 21 2HD PRO 21 -15.306 -2.023 -11.811 149 HD3 PRO 21 1HD PRO 21 -14.857 -0.832 -13.045 150 H LEU 22 H LEU 22 -10.129 -3.694 -12.931 151 HA LEU 22 HA LEU 22 -10.858 -5.982 -11.344 152 HB2 LEU 22 2HB LEU 22 -8.208 -5.077 -12.433 153 HB3 LEU 22 1HB LEU 22 -8.479 -6.583 -11.582 154 HG LEU 22 HG LEU 22 -9.701 -5.817 -14.216 155 HD11 LEU 22 1HD1 LEU 22 -8.261 -7.531 -15.119 156 HD12 LEU 22 2HD1 LEU 22 -7.544 -7.757 -13.524 157 HD13 LEU 22 3HD1 LEU 22 -7.347 -6.226 -14.368 158 HD21 LEU 22 3HD2 LEU 22 -9.846 -8.373 -12.636 159 HD22 LEU 22 1HD2 LEU 22 -10.453 -8.145 -14.278 160 HD23 LEU 22 2HD2 LEU 22 -11.176 -7.259 -12.937 161 H ARG 23 H ARG 23 -9.920 -6.453 -9.411 162 HA ARG 23 HA ARG 23 -9.425 -4.089 -7.835 163 HB2 ARG 23 2HB ARG 23 -11.011 -5.420 -6.919 164 HB3 ARG 23 1HB ARG 23 -10.226 -6.924 -7.218 165 HG2 ARG 23 2HG ARG 23 -8.606 -6.307 -5.515 166 HG3 ARG 23 1HG ARG 23 -9.577 -4.850 -5.127 167 HD2 ARG 23 2HD ARG 23 -10.383 -7.740 -4.998 168 HD3 ARG 23 1HD ARG 23 -10.096 -6.696 -3.595 169 HE ARG 23 HE ARG 23 -12.044 -5.449 -5.065 170 HH11 ARG 23 1HH1 ARG 23 -11.756 -8.642 -3.572 171 HH12 ARG 23 2HH1 ARG 23 -13.424 -8.824 -3.313 172 HH21 ARG 23 1HH2 ARG 23 -14.302 -5.682 -4.714 173 HH22 ARG 23 2HH2 ARG 23 -14.932 -7.088 -3.991 174 H THR 24 H THR 24 -7.574 -6.438 -9.462 175 HA THR 24 HA THR 24 -5.239 -5.708 -7.875 176 HB THR 24 HB THR 24 -4.356 -8.005 -8.382 177 HG1 THR 24 1HG THR 24 -6.101 -9.551 -8.864 178 HG21 THR 24 3HG2 THR 24 -5.670 -9.169 -6.656 179 HG22 THR 24 1HG2 THR 24 -6.923 -7.934 -6.778 180 HG23 THR 24 2HG2 THR 24 -5.322 -7.512 -6.168 181 H LEU 25 H LEU 25 -3.369 -5.343 -9.057 182 HA LEU 25 HA LEU 25 -3.623 -4.841 -11.885 183 HB2 LEU 25 2HB LEU 25 -2.292 -3.386 -10.409 184 HB3 LEU 25 1HB LEU 25 -1.235 -4.726 -10.035 185 HG LEU 25 HG LEU 25 -0.368 -4.719 -12.323 186 HD11 LEU 25 1HD1 LEU 25 -2.364 -4.015 -13.522 187 HD12 LEU 25 2HD1 LEU 25 -1.019 -2.948 -13.898 188 HD13 LEU 25 3HD1 LEU 25 -2.284 -2.419 -12.788 189 HD21 LEU 25 3HD2 LEU 25 0.711 -2.494 -12.256 190 HD22 LEU 25 1HD2 LEU 25 0.710 -3.306 -10.684 191 HD23 LEU 25 2HD2 LEU 25 -0.442 -2.015 -11.021 192 H TYR 26 H TYR 26 -2.505 -7.312 -9.814 193 HA TYR 26 HA TYR 26 -0.961 -8.998 -11.367 194 HB2 TYR 26 2HB TYR 26 -1.485 -9.193 -8.961 195 HB3 TYR 26 1HB TYR 26 -3.137 -9.613 -9.356 196 HD1 TYR 26 2HD TYR 26 -3.653 -11.876 -10.196 197 HD2 TYR 26 1HD TYR 26 0.338 -10.796 -9.137 198 HE1 TYR 26 2HE TYR 26 -2.993 -14.241 -10.104 199 HE2 TYR 26 1HE TYR 26 0.941 -13.097 -9.090 200 HH TYR 26 HH TYR 26 -0.984 -15.582 -10.259 201 H GLN 27 H GLN 27 -4.566 -8.890 -11.066 202 HA GLN 27 HA GLN 27 -4.982 -10.929 -12.978 203 HB2 GLN 27 2HB GLN 27 -6.677 -10.448 -11.315 204 HB3 GLN 27 1HB GLN 27 -6.899 -8.822 -11.936 205 HG2 GLN 27 2HG GLN 27 -8.723 -10.265 -12.659 206 HG3 GLN 27 1HG GLN 27 -7.801 -9.751 -14.038 207 HE21 GLN 27 1HE2 GLN 27 -8.438 -11.442 -15.260 208 HE22 GLN 27 2HE2 GLN 27 -7.907 -13.064 -15.063 209 H ALA 28 H ALA 28 -4.677 -7.436 -13.265 210 HA ALA 28 HA ALA 28 -5.619 -7.097 -15.837 211 HB1 ALA 28 1HB ALA 28 -5.064 -5.258 -14.280 212 HB2 ALA 28 2HB ALA 28 -4.270 -5.031 -15.828 213 HB3 ALA 28 3HB ALA 28 -3.356 -5.644 -14.447 214 H MET 29 H MET 29 -2.454 -8.083 -14.640 215 HA MET 29 HA MET 29 -1.273 -8.296 -17.184 216 HB2 MET 29 2HB MET 29 -0.585 -9.362 -14.492 217 HB3 MET 29 1HB MET 29 0.402 -9.693 -15.895 218 HG2 MET 29 2HG MET 29 0.749 -7.224 -16.169 219 HG3 MET 29 1HG MET 29 -0.204 -6.973 -14.724 220 HE1 MET 29 3HE MET 29 3.340 -6.096 -13.861 221 HE2 MET 29 1HE MET 29 1.671 -5.551 -13.991 222 HE3 MET 29 2HE MET 29 2.572 -5.952 -15.446 223 H ILE 30 H ILE 30 -3.079 -10.485 -15.156 224 HA ILE 30 HA ILE 30 -2.484 -12.871 -16.566 225 HB ILE 30 HB ILE 30 -4.935 -12.165 -14.928 226 HG12 ILE 30 2HG1 ILE 30 -2.456 -13.745 -14.241 227 HG13 ILE 30 1HG1 ILE 30 -2.874 -12.145 -13.637 228 HG21 ILE 30 1HG2 ILE 30 -5.398 -14.560 -14.808 229 HG22 ILE 30 2HG2 ILE 30 -4.057 -14.879 -15.908 230 HG23 ILE 30 3HG2 ILE 30 -5.468 -13.974 -16.472 231 HD11 ILE 30 3HD1 ILE 30 -4.795 -13.098 -12.499 232 HD12 ILE 30 1HD1 ILE 30 -3.285 -13.863 -12.008 233 HD13 ILE 30 2HD1 ILE 30 -4.369 -14.698 -13.123 234 H ILE 31 H ILE 31 -5.111 -10.542 -16.978 235 HA ILE 31 HA ILE 31 -6.348 -12.001 -19.031 236 HB ILE 31 HB ILE 31 -6.576 -9.039 -18.442 237 HG12 ILE 31 2HG1 ILE 31 -8.198 -11.397 -17.483 238 HG13 ILE 31 1HG1 ILE 31 -7.121 -10.419 -16.496 239 HG21 ILE 31 1HG2 ILE 31 -7.389 -9.709 -20.654 240 HG22 ILE 31 2HG2 ILE 31 -8.729 -9.268 -19.560 241 HG23 ILE 31 3HG2 ILE 31 -8.346 -10.974 -19.863 242 HD11 ILE 31 3HD1 ILE 31 -8.566 -8.474 -16.925 243 HD12 ILE 31 1HD1 ILE 31 -9.422 -9.802 -16.116 244 HD13 ILE 31 2HD1 ILE 31 -9.631 -9.536 -17.848 245 H THR 32 H THR 32 -3.951 -9.388 -19.023 246 HA THR 32 HA THR 32 -4.100 -9.059 -21.876 247 HB THR 32 HB THR 32 -2.240 -7.438 -21.548 248 HG1 THR 32 1HG THR 32 -2.578 -7.611 -18.790 249 HG21 THR 32 3HG2 THR 32 -4.567 -7.082 -19.624 250 HG22 THR 32 1HG2 THR 32 -4.602 -6.717 -21.342 251 HG23 THR 32 2HG2 THR 32 -3.554 -5.800 -20.270 252 H LYS 33 H LYS 33 -1.885 -10.561 -19.574 253 HA LYS 33 HA LYS 33 -0.082 -11.869 -19.727 254 HB2 LYS 33 2HB LYS 33 -1.075 -12.427 -22.529 255 HB3 LYS 33 1HB LYS 33 0.189 -13.344 -21.730 256 HG2 LYS 33 2HG LYS 33 -1.455 -13.995 -19.984 257 HG3 LYS 33 1HG LYS 33 -2.702 -13.157 -20.895 258 HD2 LYS 33 2HD LYS 33 -1.073 -15.485 -21.953 259 HD3 LYS 33 1HD LYS 33 -2.656 -15.646 -21.218 260 HE2 LYS 33 2HE LYS 33 -2.900 -15.732 -23.615 261 HE3 LYS 33 1HE LYS 33 -3.591 -14.224 -23.046 262 HZ1 LYS 33 3HZ LYS 33 -0.882 -14.479 -24.257 263 HZ2 LYS 33 1HZ LYS 33 -1.730 -13.019 -23.955 264 HZ3 LYS 33 2HZ LYS 33 -2.266 -14.080 -25.094 265 H SER 34 H SER 34 -0.165 -9.050 -20.827 266 HA SER 34 HA SER 34 2.160 -9.120 -22.609 267 HB2 SER 34 2HB SER 34 0.345 -6.802 -21.924 268 HB3 SER 34 1HB SER 34 1.589 -6.824 -23.170 269 HG SER 34 HG SER 34 -0.308 -8.860 -23.276 270 H SER 35 H SER 35 1.349 -8.462 -19.367 271 HA SER 35 HA SER 35 2.336 -7.703 -17.540 272 HB2 SER 35 2HB SER 35 4.806 -7.850 -17.256 273 HB3 SER 35 1HB SER 35 4.153 -9.283 -18.034 274 HG SER 35 HG SER 35 4.780 -8.162 -20.059 275 H LYS 36 H LYS 36 3.506 -5.916 -20.339 276 HA LYS 36 HA LYS 36 3.226 -3.466 -18.778 277 HB2 LYS 36 2HB LYS 36 5.606 -4.448 -19.575 278 HB3 LYS 36 1HB LYS 36 5.117 -3.686 -21.064 279 HG2 LYS 36 2HG LYS 36 5.449 -2.325 -18.414 280 HG3 LYS 36 1HG LYS 36 6.656 -2.348 -19.688 281 HD2 LYS 36 2HD LYS 36 5.645 -0.189 -19.810 282 HD3 LYS 36 1HD LYS 36 4.892 -1.103 -21.110 283 HE2 LYS 36 2HE LYS 36 2.914 -1.457 -19.740 284 HE3 LYS 36 1HE LYS 36 3.697 -0.666 -18.375 285 HZ1 LYS 36 3HZ LYS 36 2.125 0.767 -19.561 286 HZ2 LYS 36 1HZ LYS 36 3.088 0.676 -20.955 287 HZ3 LYS 36 2HZ LYS 36 3.690 1.391 -19.562 288 H GLY 37 H GLY 37 1.327 -2.771 -19.623 289 HA2 GLY 37 2HA GLY 37 1.149 -2.212 -22.449 290 HA3 GLY 37 1HA GLY 37 -0.098 -3.268 -21.772 291 H ASP 38 H ASP 38 -1.722 -1.589 -22.129 292 HA ASP 38 HA ASP 38 -1.284 0.737 -20.462 293 HB2 ASP 38 2HB ASP 38 -3.590 0.021 -22.291 294 HB3 ASP 38 1HB ASP 38 -3.560 1.461 -21.282 295 H PHE 39 H PHE 39 -1.558 0.474 -18.440 296 HA PHE 39 HA PHE 39 -3.926 -0.952 -17.492 297 HB2 PHE 39 2HB PHE 39 -1.213 -0.775 -16.149 298 HB3 PHE 39 1HB PHE 39 -2.636 -1.545 -15.469 299 HD1 PHE 39 1HD PHE 39 -3.678 -3.390 -17.055 300 HD2 PHE 39 2HD PHE 39 0.379 -2.142 -17.142 301 HE1 PHE 39 1HE PHE 39 -3.046 -5.518 -18.105 302 HE2 PHE 39 2HE PHE 39 1.011 -4.249 -18.195 303 HZ PHE 39 HZ PHE 39 -0.692 -5.950 -18.677 304 H LEU 40 H LEU 40 -5.254 0.396 -16.534 305 HA LEU 40 HA LEU 40 -4.090 2.872 -15.443 306 HB2 LEU 40 2HB LEU 40 -6.937 2.620 -16.567 307 HB3 LEU 40 1HB LEU 40 -6.254 3.894 -15.645 308 HG LEU 40 HG LEU 40 -6.429 4.433 -18.030 309 HD11 LEU 40 1HD1 LEU 40 -3.636 4.414 -16.960 310 HD12 LEU 40 2HD1 LEU 40 -4.882 5.638 -16.689 311 HD13 LEU 40 3HD1 LEU 40 -4.221 5.396 -18.303 312 HD21 LEU 40 3HD2 LEU 40 -4.298 2.334 -18.407 313 HD22 LEU 40 1HD2 LEU 40 -4.844 3.479 -19.633 314 HD23 LEU 40 2HD2 LEU 40 -5.955 2.261 -19.007 315 H ILE 41 H ILE 41 -4.216 3.130 -13.377 316 HA ILE 41 HA ILE 41 -6.172 1.486 -11.964 317 HB ILE 41 HB ILE 41 -3.537 2.563 -10.910 318 HG12 ILE 41 2HG1 ILE 41 -4.333 -0.158 -11.999 319 HG13 ILE 41 1HG1 ILE 41 -3.018 0.877 -12.465 320 HG21 ILE 41 1HG2 ILE 41 -5.564 0.715 -9.647 321 HG22 ILE 41 2HG2 ILE 41 -5.236 2.383 -9.197 322 HG23 ILE 41 3HG2 ILE 41 -3.998 1.143 -8.940 323 HD11 ILE 41 3HD1 ILE 41 -1.850 0.379 -10.376 324 HD12 ILE 41 1HD1 ILE 41 -2.288 -1.075 -11.297 325 HD13 ILE 41 2HD1 ILE 41 -3.247 -0.640 -9.909 326 H ARG 42 H ARG 42 -7.521 2.420 -10.545 327 HA ARG 42 HA ARG 42 -8.122 5.124 -10.888 328 HB2 ARG 42 2HB ARG 42 -9.698 3.268 -10.155 329 HB3 ARG 42 1HB ARG 42 -8.979 3.419 -8.553 330 HG2 ARG 42 2HG ARG 42 -10.907 4.737 -8.494 331 HG3 ARG 42 1HG ARG 42 -9.563 5.864 -8.670 332 HD2 ARG 42 2HD ARG 42 -10.824 6.717 -10.392 333 HD3 ARG 42 1HD ARG 42 -10.133 5.385 -11.268 334 HE ARG 42 HE ARG 42 -12.262 4.187 -10.260 335 HH11 ARG 42 1HH1 ARG 42 -11.886 7.252 -12.025 336 HH12 ARG 42 2HH1 ARG 42 -13.449 7.201 -12.685 337 HH21 ARG 42 1HH2 ARG 42 -14.418 4.168 -11.187 338 HH22 ARG 42 2HH2 ARG 42 -14.904 5.443 -12.211 339 H THR 43 H THR 43 -7.336 6.829 -9.954 340 HA THR 43 HA THR 43 -5.833 6.573 -7.474 341 HB THR 43 HB THR 43 -4.315 6.858 -9.423 342 HG1 THR 43 1HG THR 43 -3.896 7.891 -7.291 343 HG21 THR 43 3HG2 THR 43 -5.780 9.449 -9.769 344 HG22 THR 43 1HG2 THR 43 -5.746 8.103 -10.902 345 HG23 THR 43 2HG2 THR 43 -4.274 9.035 -10.585 346 H LYS 44 H LYS 44 -5.862 8.511 -6.202 347 HA LYS 44 HA LYS 44 -8.327 10.040 -6.627 348 HB2 LYS 44 2HB LYS 44 -6.720 9.613 -4.107 349 HB3 LYS 44 1HB LYS 44 -8.289 10.393 -4.232 350 HG2 LYS 44 2HG LYS 44 -9.324 8.288 -4.841 351 HG3 LYS 44 1HG LYS 44 -7.748 7.491 -4.847 352 HD2 LYS 44 2HD LYS 44 -7.495 8.082 -2.457 353 HD3 LYS 44 1HD LYS 44 -9.122 8.754 -2.492 354 HE2 LYS 44 2HE LYS 44 -8.416 5.882 -3.100 355 HE3 LYS 44 1HE LYS 44 -9.044 6.454 -1.558 356 HZ1 LYS 44 3HZ LYS 44 -11.087 7.093 -2.655 357 HZ2 LYS 44 1HZ LYS 44 -10.735 5.473 -2.960 358 HZ3 LYS 44 2HZ LYS 44 -10.479 6.631 -4.162 359 H LYS 45 H LYS 45 -7.754 11.900 -7.580 360 HA LYS 45 HA LYS 45 -5.442 13.339 -6.501 361 HB2 LYS 45 2HB LYS 45 -6.401 13.278 -9.401 362 HB3 LYS 45 1HB LYS 45 -5.214 14.441 -8.807 363 HG2 LYS 45 2HG LYS 45 -3.839 12.553 -8.246 364 HG3 LYS 45 1HG LYS 45 -5.062 11.511 -8.985 365 HD2 LYS 45 2HD LYS 45 -4.883 12.795 -11.067 366 HD3 LYS 45 1HD LYS 45 -3.603 13.773 -10.334 367 HE2 LYS 45 2HE LYS 45 -2.373 11.828 -9.895 368 HE3 LYS 45 1HE LYS 45 -3.691 10.886 -10.645 369 HZ1 LYS 45 3HZ LYS 45 -1.863 11.174 -12.256 370 HZ2 LYS 45 1HZ LYS 45 -1.914 12.842 -12.080 371 HZ3 LYS 45 2HZ LYS 45 -3.209 12.031 -12.787 372 H ASP 46 H ASP 46 -5.981 15.031 -5.435 373 HA ASP 46 HA ASP 46 -7.204 16.698 -4.458 374 HB2 ASP 46 2HB ASP 46 -8.444 16.927 -7.229 375 HB3 ASP 46 1HB ASP 46 -8.686 18.096 -5.942 376 H GLY 47 H GLY 47 -8.100 13.985 -4.395 377 HA2 GLY 47 2HA GLY 47 -9.847 12.896 -3.313 378 HA3 GLY 47 1HA GLY 47 -10.746 14.407 -3.340 379 H LYS 48 H LYS 48 -9.676 13.840 -6.425 380 HA LYS 48 HA LYS 48 -12.335 12.936 -7.241 381 HB2 LYS 48 2HB LYS 48 -10.095 14.147 -8.863 382 HB3 LYS 48 1HB LYS 48 -11.744 13.873 -9.400 383 HG2 LYS 48 2HG LYS 48 -12.552 15.537 -7.806 384 HG3 LYS 48 1HG LYS 48 -10.910 15.775 -7.216 385 HD2 LYS 48 2HD LYS 48 -10.228 16.539 -9.431 386 HD3 LYS 48 1HD LYS 48 -11.868 16.312 -10.027 387 HE2 LYS 48 2HE LYS 48 -11.007 18.218 -7.847 388 HE3 LYS 48 1HE LYS 48 -11.455 18.656 -9.493 389 HZ1 LYS 48 3HZ LYS 48 -13.697 17.784 -9.038 390 HZ2 LYS 48 1HZ LYS 48 -13.300 19.041 -8.012 391 HZ3 LYS 48 2HZ LYS 48 -13.281 17.454 -7.462 392 H GLN 49 H GLN 49 -12.584 11.035 -8.298 393 HA GLN 49 HA GLN 49 -10.372 9.205 -8.330 394 HB2 GLN 49 2HB GLN 49 -13.159 8.803 -9.461 395 HB3 GLN 49 1HB GLN 49 -11.987 7.558 -9.120 396 HG2 GLN 49 2HG GLN 49 -13.474 7.327 -7.406 397 HG3 GLN 49 1HG GLN 49 -12.236 8.334 -6.667 398 HE21 GLN 49 1HE2 GLN 49 -15.037 7.959 -5.995 399 HE22 GLN 49 2HE2 GLN 49 -15.769 9.519 -6.025 400 H VAL 50 H VAL 50 -8.987 9.129 -10.008 401 HA VAL 50 HA VAL 50 -10.070 9.394 -12.700 402 HB VAL 50 HB VAL 50 -8.113 10.746 -13.462 403 HG11 VAL 50 1HG1 VAL 50 -8.750 12.913 -12.494 404 HG12 VAL 50 2HG1 VAL 50 -9.679 12.070 -11.261 405 HG13 VAL 50 3HG1 VAL 50 -10.157 11.949 -12.955 406 HG21 VAL 50 3HG2 VAL 50 -6.685 11.882 -11.833 407 HG22 VAL 50 1HG2 VAL 50 -6.515 10.128 -11.734 408 HG23 VAL 50 2HG2 VAL 50 -7.466 10.990 -10.528 409 H TRP 51 H TRP 51 -8.207 8.667 -14.327 410 HA TRP 51 HA TRP 51 -7.213 6.218 -13.163 411 HB2 TRP 51 2HB TRP 51 -7.564 7.002 -16.079 412 HB3 TRP 51 1HB TRP 51 -6.954 5.503 -15.560 413 HD1 TRP 51 HD TRP 51 -9.944 7.040 -16.534 414 HE1 TRP 51 1HE TRP 51 -12.038 5.584 -15.924 415 HE3 TRP 51 3HE TRP 51 -7.726 3.860 -13.285 416 HZ2 TRP 51 2HZ TRP 51 -12.587 3.397 -14.238 417 HZ3 TRP 51 3HZ TRP 51 -9.073 2.111 -12.226 418 HH2 TRP 51 HH TRP 51 -11.450 1.885 -12.694 419 H GLU 52 H GLU 52 -5.118 5.750 -12.981 420 HA GLU 52 HA GLU 52 -3.181 7.553 -14.234 421 HB2 GLU 52 2HB GLU 52 -3.349 7.924 -11.810 422 HB3 GLU 52 1HB GLU 52 -3.017 6.222 -11.518 423 HG2 GLU 52 2HG GLU 52 -1.048 7.571 -11.132 424 HG3 GLU 52 1HG GLU 52 -0.817 6.508 -12.523 425 H ALA 53 H ALA 53 -1.763 6.507 -15.457 426 HA ALA 53 HA ALA 53 -1.988 3.751 -15.980 427 HB1 ALA 53 1HB ALA 53 0.267 5.637 -16.657 428 HB2 ALA 53 2HB ALA 53 -1.167 5.351 -17.648 429 HB3 ALA 53 3HB ALA 53 -0.007 4.052 -17.372 430 H ALA 54 H ALA 54 -0.953 2.057 -15.243 431 HA ALA 54 HA ALA 54 0.405 2.148 -12.782 432 HB1 ALA 54 1HB ALA 54 0.344 -0.053 -14.842 433 HB2 ALA 54 2HB ALA 54 -0.827 0.172 -13.545 434 HB3 ALA 54 3HB ALA 54 0.847 -0.231 -13.163 435 H SER 55 H SER 55 2.671 1.236 -12.508 436 HA SER 55 HA SER 55 4.345 2.438 -14.555 437 HB2 SER 55 2HB SER 55 4.057 3.894 -12.536 438 HB3 SER 55 1HB SER 55 4.711 2.589 -11.554 439 HG SER 55 HG SER 55 5.946 4.205 -13.466 440 H LYS 56 H LYS 56 6.442 1.488 -14.606 441 HA LYS 56 HA LYS 56 6.406 -1.281 -14.671 442 HB2 LYS 56 2HB LYS 56 8.815 0.526 -14.539 443 HB3 LYS 56 1HB LYS 56 8.822 -1.157 -15.051 444 HG2 LYS 56 2HG LYS 56 7.391 -0.644 -16.927 445 HG3 LYS 56 1HG LYS 56 7.262 1.033 -16.404 446 HD2 LYS 56 2HD LYS 56 9.708 1.262 -16.705 447 HD3 LYS 56 1HD LYS 56 9.746 -0.396 -17.303 448 HE2 LYS 56 2HE LYS 56 8.291 0.186 -19.146 449 HE3 LYS 56 1HE LYS 56 8.139 1.833 -18.536 450 HZ1 LYS 56 3HZ LYS 56 10.683 0.593 -19.471 451 HZ2 LYS 56 1HZ LYS 56 10.462 2.175 -18.922 452 HZ3 LYS 56 2HZ LYS 56 9.718 1.675 -20.334 453 H THR 57 H THR 57 7.521 0.825 -12.076 454 HA THR 57 HA THR 57 8.725 -1.044 -10.436 455 HB THR 57 HB THR 57 7.897 0.503 -8.587 456 HG1 THR 57 1HG THR 57 6.556 2.062 -9.103 457 HG21 THR 57 3HG2 THR 57 9.347 1.715 -10.954 458 HG22 THR 57 1HG2 THR 57 10.091 0.819 -9.635 459 HG23 THR 57 2HG2 THR 57 9.326 2.376 -9.324 460 H ALA 58 H ALA 58 5.333 -0.069 -10.569 461 HA ALA 58 HA ALA 58 4.489 -1.982 -8.594 462 HB1 ALA 58 1HB ALA 58 2.818 -0.378 -10.536 463 HB2 ALA 58 2HB ALA 58 3.291 0.153 -8.923 464 HB3 ALA 58 3HB ALA 58 2.221 -1.237 -9.116 465 H LEU 59 H LEU 59 4.543 -1.869 -12.104 466 HA LEU 59 HA LEU 59 2.995 -4.136 -12.545 467 HB2 LEU 59 2HB LEU 59 5.216 -2.950 -14.224 468 HB3 LEU 59 1HB LEU 59 4.051 -4.237 -14.703 469 HG LEU 59 HG LEU 59 3.244 -1.429 -13.967 470 HD11 LEU 59 1HD1 LEU 59 4.745 -1.377 -15.912 471 HD12 LEU 59 2HD1 LEU 59 3.077 -1.042 -16.362 472 HD13 LEU 59 3HD1 LEU 59 3.776 -2.630 -16.686 473 HD21 LEU 59 3HD2 LEU 59 1.217 -2.037 -15.113 474 HD22 LEU 59 1HD2 LEU 59 1.537 -3.222 -13.848 475 HD23 LEU 59 2HD2 LEU 59 1.893 -3.603 -15.538 476 H LYS 60 H LYS 60 6.544 -3.796 -12.188 477 HA LYS 60 HA LYS 60 6.989 -6.530 -12.510 478 HB2 LYS 60 2HB LYS 60 8.700 -4.331 -11.440 479 HB3 LYS 60 1HB LYS 60 9.205 -5.997 -11.149 480 HG2 LYS 60 2HG LYS 60 10.297 -5.062 -13.071 481 HG3 LYS 60 1HG LYS 60 9.220 -6.362 -13.559 482 HD2 LYS 60 2HD LYS 60 7.547 -4.690 -14.216 483 HD3 LYS 60 1HD LYS 60 8.658 -3.408 -13.745 484 HE2 LYS 60 2HE LYS 60 8.790 -3.714 -16.116 485 HE3 LYS 60 1HE LYS 60 10.274 -4.275 -15.323 486 HZ1 LYS 60 3HZ LYS 60 9.518 -5.832 -17.045 487 HZ2 LYS 60 1HZ LYS 60 8.070 -6.053 -16.211 488 HZ3 LYS 60 2HZ LYS 60 9.511 -6.539 -15.516 489 H LYS 61 H LYS 61 5.976 -4.801 -9.668 490 HA LYS 61 HA LYS 61 6.496 -6.984 -7.886 491 HB2 LYS 61 2HB LYS 61 4.566 -4.670 -7.640 492 HB3 LYS 61 1HB LYS 61 5.002 -5.764 -6.333 493 HG2 LYS 61 2HG LYS 61 7.300 -5.009 -6.425 494 HG3 LYS 61 1HG LYS 61 6.910 -3.973 -7.801 495 HD2 LYS 61 2HD LYS 61 5.342 -2.721 -6.387 496 HD3 LYS 61 1HD LYS 61 5.783 -3.751 -5.023 497 HE2 LYS 61 2HE LYS 61 8.084 -2.981 -5.149 498 HE3 LYS 61 1HE LYS 61 7.694 -2.009 -6.565 499 HZ1 LYS 61 3HZ LYS 61 7.766 -0.682 -4.571 500 HZ2 LYS 61 1HZ LYS 61 6.570 -1.623 -3.848 501 HZ3 LYS 61 2HZ LYS 61 6.206 -0.690 -5.205 502 H SER 62 H SER 62 3.931 -6.070 -9.996 503 HA SER 62 HA SER 62 1.948 -7.922 -9.041 504 HB2 SER 62 2HB SER 62 2.184 -6.475 -11.682 505 HB3 SER 62 1HB SER 62 0.731 -7.215 -11.000 506 HG SER 62 HG SER 62 2.140 -4.923 -10.137 507 H TRP 63 H TRP 63 4.309 -7.846 -11.774 508 HA TRP 63 HA TRP 63 3.438 -10.366 -12.694 509 HB2 TRP 63 2HB TRP 63 4.322 -8.652 -14.228 510 HB3 TRP 63 1HB TRP 63 5.896 -8.782 -13.449 511 HD1 TRP 63 HD TRP 63 7.401 -10.698 -14.129 512 HE1 TRP 63 1HE TRP 63 7.287 -12.578 -15.942 513 HE3 TRP 63 3HE TRP 63 2.534 -10.197 -15.465 514 HZ2 TRP 63 2HZ TRP 63 5.352 -13.659 -17.684 515 HZ3 TRP 63 3HZ TRP 63 1.597 -11.690 -17.192 516 HH2 TRP 63 HH TRP 63 2.988 -13.376 -18.282 517 H LYS 64 H LYS 64 5.972 -9.288 -10.510 518 HA LYS 64 HA LYS 64 7.479 -11.664 -10.429 519 HB2 LYS 64 2HB LYS 64 8.146 -9.552 -9.323 520 HB3 LYS 64 1HB LYS 64 6.848 -9.771 -8.157 521 HG2 LYS 64 2HG LYS 64 7.913 -11.823 -7.362 522 HG3 LYS 64 1HG LYS 64 9.226 -11.586 -8.519 523 HD2 LYS 64 2HD LYS 64 9.757 -9.460 -7.475 524 HD3 LYS 64 1HD LYS 64 8.458 -9.700 -6.302 525 HE2 LYS 64 2HE LYS 64 9.588 -11.757 -5.525 526 HE3 LYS 64 1HE LYS 64 10.897 -11.437 -6.660 527 HZ1 LYS 64 3HZ LYS 64 10.099 -9.687 -4.401 528 HZ2 LYS 64 1HZ LYS 64 11.324 -9.354 -5.488 529 HZ3 LYS 64 2HZ LYS 64 11.467 -10.677 -4.454 530 H ARG 65 H ARG 65 4.535 -10.670 -8.897 531 HA ARG 65 HA ARG 65 4.117 -12.887 -7.173 532 HB2 ARG 65 2HB ARG 65 3.112 -10.608 -7.001 533 HB3 ARG 65 1HB ARG 65 2.196 -10.932 -8.445 534 HG2 ARG 65 2HG ARG 65 0.766 -11.159 -6.543 535 HG3 ARG 65 1HG ARG 65 1.017 -12.759 -7.213 536 HD2 ARG 65 2HD ARG 65 2.694 -13.181 -5.578 537 HD3 ARG 65 1HD ARG 65 2.426 -11.536 -4.931 538 HE ARG 65 HE ARG 65 0.002 -12.937 -5.041 539 HH11 ARG 65 1HH1 ARG 65 2.964 -12.901 -3.058 540 HH12 ARG 65 2HH1 ARG 65 2.184 -13.487 -1.668 541 HH21 ARG 65 1HH2 ARG 65 -1.042 -13.738 -3.102 542 HH22 ARG 65 2HH2 ARG 65 -0.123 -13.988 -1.704 543 H TYR 66 H TYR 66 3.425 -12.165 -10.519 544 HA TYR 66 HA TYR 66 1.617 -14.312 -11.219 545 HB2 TYR 66 2HB TYR 66 2.089 -12.142 -12.474 546 HB3 TYR 66 1HB TYR 66 3.607 -12.868 -12.971 547 HD1 TYR 66 1HD TYR 66 3.347 -15.217 -14.169 548 HD2 TYR 66 2HD TYR 66 0.272 -12.328 -13.789 549 HE1 TYR 66 1HE TYR 66 2.199 -16.216 -16.057 550 HE2 TYR 66 2HE TYR 66 -0.886 -13.283 -15.668 551 HH TYR 66 HH TYR 66 -0.035 -16.337 -16.958 552 H GLU 67 H GLU 67 5.116 -13.831 -11.531 553 HA GLU 67 HA GLU 67 5.985 -16.270 -12.612 554 HB2 GLU 67 2HB GLU 67 7.305 -14.723 -10.374 555 HB3 GLU 67 1HB GLU 67 8.088 -15.841 -11.475 556 HG2 GLU 67 2HG GLU 67 6.730 -13.349 -12.317 557 HG3 GLU 67 1HG GLU 67 8.438 -13.385 -11.901 558 H GLN 68 H GLN 68 5.266 -15.352 -9.384 559 HA GLN 68 HA GLN 68 6.074 -17.620 -8.003 560 HB2 GLN 68 2HB GLN 68 3.807 -15.759 -7.322 561 HB3 GLN 68 1HB GLN 68 4.462 -16.944 -6.210 562 HG2 GLN 68 2HG GLN 68 6.007 -14.667 -7.436 563 HG3 GLN 68 1HG GLN 68 5.323 -14.673 -5.815 564 HE21 GLN 68 1HE2 GLN 68 6.028 -17.447 -5.314 565 HE22 GLN 68 2HE2 GLN 68 7.733 -17.466 -5.051 566 H GLU 69 H GLU 69 2.788 -17.070 -9.431 567 HA GLU 69 HA GLU 69 1.918 -19.591 -8.394 568 HB2 GLU 69 2HB GLU 69 -0.137 -19.388 -9.696 569 HB3 GLU 69 1HB GLU 69 0.226 -17.849 -8.943 570 HG2 GLU 69 2HG GLU 69 0.867 -16.882 -11.007 571 HG3 GLU 69 1HG GLU 69 0.933 -18.453 -11.802 572 H MET 70 H MET 70 3.138 -18.584 -11.516 573 HA MET 70 HA MET 70 2.550 -21.114 -12.698 574 HB2 MET 70 2HB MET 70 3.692 -20.323 -14.702 575 HB3 MET 70 1HB MET 70 2.530 -19.150 -14.113 576 HG2 MET 70 2HG MET 70 4.392 -17.862 -13.118 577 HG3 MET 70 1HG MET 70 5.526 -19.025 -13.803 578 HE1 MET 70 3HE MET 70 4.009 -19.618 -16.637 579 HE2 MET 70 1HE MET 70 5.755 -19.425 -16.473 580 HE3 MET 70 2HE MET 70 4.876 -18.483 -17.672 581 H LEU 71 H LEU 71 5.421 -19.785 -11.164 582 HA LEU 71 HA LEU 71 7.030 -21.932 -12.074 583 HB2 LEU 71 2HB LEU 71 7.989 -19.784 -11.635 584 HB3 LEU 71 1HB LEU 71 7.467 -19.798 -9.973 585 HG LEU 71 HG LEU 71 8.977 -21.691 -9.564 586 HD11 LEU 71 1HD1 LEU 71 10.714 -22.219 -11.257 587 HD12 LEU 71 2HD1 LEU 71 9.895 -21.162 -12.405 588 HD13 LEU 71 3HD1 LEU 71 9.095 -22.623 -11.819 589 HD21 LEU 71 3HD2 LEU 71 9.703 -19.423 -9.081 590 HD22 LEU 71 1HD2 LEU 71 10.287 -19.239 -10.737 591 HD23 LEU 71 2HD2 LEU 71 11.065 -20.388 -9.653 592 H LYS 72 H LYS 72 4.980 -21.341 -9.301 593 HA LYS 72 HA LYS 72 5.914 -23.611 -7.824 594 HB2 LYS 72 2HB LYS 72 3.454 -21.887 -7.544 595 HB3 LYS 72 1HB LYS 72 3.759 -23.283 -6.524 596 HG2 LYS 72 2HG LYS 72 5.670 -20.965 -6.764 597 HG3 LYS 72 1HG LYS 72 4.398 -21.052 -5.552 598 HD2 LYS 72 2HD LYS 72 6.454 -23.245 -5.844 599 HD3 LYS 72 1HD LYS 72 6.764 -21.809 -4.882 600 HE2 LYS 72 2HE LYS 72 5.985 -23.676 -3.486 601 HE3 LYS 72 1HE LYS 72 4.882 -22.318 -3.431 602 HZ1 LYS 72 3HZ LYS 72 3.344 -23.500 -4.822 603 HZ2 LYS 72 1HZ LYS 72 3.806 -24.482 -3.541 604 HZ3 LYS 72 2HZ LYS 72 4.449 -24.781 -5.058 605 H ASN 73 H ASN 73 3.573 -23.089 -10.306 606 HA ASN 73 HA ASN 73 2.394 -25.692 -9.856 607 HB2 ASN 73 2HB ASN 73 0.867 -23.919 -10.506 608 HB3 ASN 73 1HB ASN 73 1.778 -23.629 -11.983 609 HD21 ASN 73 1HD2 ASN 73 1.444 -24.969 -13.758 610 HD22 ASN 73 2HD2 ASN 73 0.239 -26.200 -13.773 611 H GLU 74 H GLU 74 4.286 -24.142 -12.462 612 HA GLU 74 HA GLU 74 4.575 -26.781 -13.706 613 HB2 GLU 74 2HB GLU 74 5.477 -24.099 -14.707 614 HB3 GLU 74 1HB GLU 74 5.421 -25.597 -15.615 615 HG2 GLU 74 2HG GLU 74 2.971 -25.569 -15.452 616 HG3 GLU 74 1HG GLU 74 3.071 -24.038 -14.585 617 H LYS 75 H LYS 75 6.458 -27.826 -13.615 618 HA LYS 75 HA LYS 75 8.625 -28.347 -13.386 619 HB2 LYS 75 2HB LYS 75 9.206 -26.508 -14.833 620 HB3 LYS 75 1HB LYS 75 9.077 -25.368 -13.504 621 HG2 LYS 75 2HG LYS 75 10.989 -26.478 -12.410 622 HG3 LYS 75 1HG LYS 75 11.136 -27.548 -13.803 623 HD2 LYS 75 2HD LYS 75 11.554 -25.637 -15.248 624 HD3 LYS 75 1HD LYS 75 11.318 -24.548 -13.879 625 HE2 LYS 75 2HE LYS 75 13.234 -25.557 -12.749 626 HE3 LYS 75 1HE LYS 75 13.465 -26.643 -14.118 627 HZ1 LYS 75 3HZ LYS 75 13.625 -23.684 -14.237 628 HZ2 LYS 75 1HZ LYS 75 13.939 -24.737 -15.515 629 HZ3 LYS 75 2HZ LYS 75 14.948 -24.709 -14.164 630 H VAL 76 H VAL 76 7.996 -25.527 -11.320 631 HA VAL 76 HA VAL 76 8.383 -25.071 -9.176 632 HB VAL 76 HB VAL 76 8.748 -28.007 -8.927 633 HG11 VAL 76 1HG1 VAL 76 9.780 -26.888 -7.011 634 HG12 VAL 76 2HG1 VAL 76 8.297 -27.670 -6.460 635 HG13 VAL 76 3HG1 VAL 76 8.322 -25.932 -6.755 636 HG21 VAL 76 3HG2 VAL 76 6.302 -26.328 -8.380 637 HG22 VAL 76 1HG2 VAL 76 6.437 -28.040 -7.984 638 HG23 VAL 76 2HG2 VAL 76 6.517 -27.521 -9.663 639 H ALA 77 H ALA 77 10.141 -23.957 -9.053 640 HA ALA 77 HA ALA 77 12.724 -25.269 -9.352 641 HB1 ALA 77 1HB ALA 77 12.136 -22.316 -9.058 642 HB2 ALA 77 2HB ALA 77 12.475 -23.167 -10.571 643 HB3 ALA 77 3HB ALA 77 13.726 -23.021 -9.337 644 H ALA 78 H ALA 78 12.126 -22.552 -7.203 645 HA ALA 78 HA ALA 78 12.050 -24.044 -4.813 646 HB1 ALA 78 1HB ALA 78 14.185 -23.351 -3.845 647 HB2 ALA 78 2HB ALA 78 14.625 -22.543 -5.341 648 HB3 ALA 78 3HB ALA 78 14.476 -24.302 -5.304 649 H LYS 79 H LYS 79 10.302 -22.842 -4.446 650 HA LYS 79 HA LYS 79 10.731 -20.128 -3.460 651 HB2 LYS 79 2HB LYS 79 8.542 -20.921 -5.416 652 HB3 LYS 79 1HB LYS 79 8.583 -19.406 -4.546 653 HG2 LYS 79 2HG LYS 79 10.749 -20.193 -6.485 654 HG3 LYS 79 1HG LYS 79 9.245 -19.463 -7.023 655 HD2 LYS 79 2HD LYS 79 10.971 -17.770 -6.861 656 HD3 LYS 79 1HD LYS 79 9.754 -17.468 -5.636 657 HE2 LYS 79 2HE LYS 79 11.212 -18.328 -3.927 658 HE3 LYS 79 1HE LYS 79 12.413 -18.825 -5.131 659 HZ1 LYS 79 3HZ LYS 79 11.589 -16.040 -4.466 660 HZ2 LYS 79 1HZ LYS 79 12.673 -16.456 -5.686 661 HZ3 LYS 79 2HZ LYS 79 13.056 -16.761 -4.091 662 H MET 80 H MET 80 9.232 -19.699 -1.753 663 HA MET 80 HA MET 80 7.519 -21.975 -1.103 664 HB2 MET 80 2HB MET 80 9.426 -21.840 0.449 665 HB3 MET 80 1HB MET 80 8.988 -20.184 0.845 666 HG2 MET 80 2HG MET 80 6.863 -20.967 1.760 667 HG3 MET 80 1HG MET 80 7.315 -22.628 1.378 668 HE1 MET 80 3HE MET 80 6.369 -21.733 4.235 669 HE2 MET 80 1HE MET 80 7.547 -22.568 5.250 670 HE3 MET 80 2HE MET 80 6.873 -23.371 3.833 671 H LEU 81 H LEU 81 5.567 -21.332 -1.639 672 HA LEU 81 HA LEU 81 4.135 -19.344 -0.296 673 HB2 LEU 81 2HB LEU 81 5.460 -17.768 -1.639 674 HB3 LEU 81 1HB LEU 81 4.974 -18.594 -3.105 675 HG LEU 81 HG LEU 81 2.616 -17.935 -2.620 676 HD11 LEU 81 1HD1 LEU 81 3.864 -16.272 -0.450 677 HD12 LEU 81 2HD1 LEU 81 2.753 -17.625 -0.234 678 HD13 LEU 81 3HD1 LEU 81 2.202 -16.145 -1.020 679 HD21 LEU 81 3HD2 LEU 81 4.613 -15.693 -2.896 680 HD22 LEU 81 1HD2 LEU 81 2.896 -15.591 -3.287 681 HD23 LEU 81 2HD2 LEU 81 3.948 -16.676 -4.197 682 H GLU 82 H GLU 82 2.188 -20.283 -0.334 683 HA GLU 82 HA GLU 82 1.258 -21.323 -2.907 684 HB2 GLU 82 2HB GLU 82 0.708 -22.528 -0.203 685 HB3 GLU 82 1HB GLU 82 -0.120 -22.979 -1.676 686 HG2 GLU 82 2HG GLU 82 2.073 -23.690 -2.596 687 HG3 GLU 82 1HG GLU 82 2.772 -23.361 -1.007 688 H LYS 83 H LYS 83 -0.175 -19.845 -3.561 689 HA LYS 83 HA LYS 83 -2.043 -18.844 -1.612 690 HB2 LYS 83 2HB LYS 83 -1.259 -17.393 -3.539 691 HB3 LYS 83 1HB LYS 83 -2.072 -18.502 -4.636 692 HG2 LYS 83 2HG LYS 83 -4.211 -17.945 -3.716 693 HG3 LYS 83 1HG LYS 83 -3.465 -16.974 -2.451 694 HD2 LYS 83 2HD LYS 83 -2.553 -15.476 -4.189 695 HD3 LYS 83 1HD LYS 83 -3.397 -16.425 -5.412 696 HE2 LYS 83 2HE LYS 83 -4.639 -14.386 -4.793 697 HE3 LYS 83 1HE LYS 83 -5.550 -15.842 -4.420 698 HZ1 LYS 83 3HZ LYS 83 -4.945 -15.616 -2.116 699 HZ2 LYS 83 1HZ LYS 83 -5.635 -14.190 -2.654 700 HZ3 LYS 83 2HZ LYS 83 -3.966 -14.281 -2.433 701 H ASP 84 H ASP 84 -3.829 -19.834 -1.180 702 HA ASP 84 HA ASP 84 -3.934 -22.529 -1.575 703 HB2 ASP 84 2HB ASP 84 -6.155 -20.741 -0.640 704 HB3 ASP 84 1HB ASP 84 -6.220 -22.502 -0.584 705 H ALA 85 H ALA 85 -5.785 -20.181 -3.441 706 HA ALA 85 HA ALA 85 -7.040 -20.400 -5.332 707 HB1 ALA 85 1HB ALA 85 -4.911 -21.253 -6.254 708 HB2 ALA 85 2HB ALA 85 -6.287 -22.086 -6.980 709 HB3 ALA 85 3HB ALA 85 -5.338 -22.882 -5.728 710 H THR 86 H THR 86 -8.169 -21.279 -3.023 711 HA THR 86 HA THR 86 -9.371 -23.876 -3.363 712 HB THR 86 HB THR 86 -8.869 -23.147 -1.082 713 HG1 THR 86 1HG THR 86 -11.383 -23.803 -1.897 714 HG21 THR 86 3HG2 THR 86 -10.099 -21.297 -0.014 715 HG22 THR 86 1HG2 THR 86 -10.862 -20.921 -1.562 716 HG23 THR 86 2HG2 THR 86 -9.117 -20.731 -1.365 717 H GLU 87 H GLU 87 -9.905 -21.027 -4.798 718 HA GLU 87 HA GLU 87 -11.470 -20.180 -6.155 719 HB2 GLU 87 2HB GLU 87 -11.844 -22.499 -6.917 720 HB3 GLU 87 1HB GLU 87 -13.006 -22.738 -5.624 721 HG2 GLU 87 2HG GLU 87 -14.428 -20.988 -6.622 722 HG3 GLU 87 1HG GLU 87 -13.273 -20.837 -7.943 723 H VAL 88 H VAL 88 -12.268 -18.431 -5.298 724 HA VAL 88 HA VAL 88 -14.028 -18.526 -2.996 725 HB VAL 88 HB VAL 88 -12.316 -16.732 -3.209 726 HG11 VAL 88 1HG1 VAL 88 -12.642 -14.871 -4.751 727 HG12 VAL 88 2HG1 VAL 88 -13.935 -15.768 -5.547 728 HG13 VAL 88 3HG1 VAL 88 -12.282 -16.388 -5.573 729 HG21 VAL 88 3HG2 VAL 88 -13.727 -14.815 -2.606 730 HG22 VAL 88 1HG2 VAL 88 -14.257 -16.306 -1.825 731 HG23 VAL 88 2HG2 VAL 88 -15.141 -15.676 -3.217 732 H GLY 89 H GLY 89 -14.256 -18.533 -6.339 733 HA2 GLY 89 2HA GLY 89 -16.699 -19.223 -6.887 734 HA3 GLY 89 1HA GLY 89 -16.994 -17.546 -6.425 735 H VAL 90 H VAL 90 -16.874 -19.223 -9.074 736 HA VAL 90 HA VAL 90 -14.946 -17.615 -10.452 737 HB VAL 90 HB VAL 90 -15.557 -18.848 -12.512 738 HG11 VAL 90 1HG1 VAL 90 -14.681 -21.035 -11.824 739 HG12 VAL 90 2HG1 VAL 90 -14.956 -20.599 -10.138 740 HG13 VAL 90 3HG1 VAL 90 -13.791 -19.693 -11.105 741 HG21 VAL 90 3HG2 VAL 90 -17.047 -20.812 -12.389 742 HG22 VAL 90 1HG2 VAL 90 -17.914 -19.313 -12.062 743 HG23 VAL 90 2HG2 VAL 90 -17.476 -20.385 -10.734 744 H LYS 91 H LYS 91 -15.327 -15.689 -11.088 745 HA LYS 91 HA LYS 91 -18.052 -14.853 -11.647 746 HB2 LYS 91 2HB LYS 91 -15.494 -13.212 -11.764 747 HB3 LYS 91 1HB LYS 91 -17.110 -12.580 -11.984 748 HG2 LYS 91 2HG LYS 91 -16.457 -11.973 -9.806 749 HG3 LYS 91 1HG LYS 91 -17.582 -13.315 -9.599 750 HD2 LYS 91 2HD LYS 91 -15.667 -14.837 -9.326 751 HD3 LYS 91 1HD LYS 91 -14.561 -13.475 -9.488 752 HE2 LYS 91 2HE LYS 91 -16.605 -13.925 -7.324 753 HE3 LYS 91 1HE LYS 91 -14.859 -14.007 -7.154 754 HZ1 LYS 91 3HZ LYS 91 -15.617 -11.899 -6.324 755 HZ2 LYS 91 1HZ LYS 91 -16.469 -11.587 -7.741 756 HZ3 LYS 91 2HZ LYS 91 -14.805 -11.589 -7.772 757 H ALA 92 H ALA 92 -14.899 -15.064 -13.224 758 HA ALA 92 HA ALA 92 -15.855 -16.066 -15.633 759 HB1 ALA 92 1HB ALA 92 -15.393 -14.151 -17.112 760 HB2 ALA 92 2HB ALA 92 -15.093 -13.140 -15.701 761 HB3 ALA 92 3HB ALA 92 -16.709 -13.780 -15.994 762 H ALA 93 H ALA 93 -14.009 -15.976 -17.264 763 HA ALA 93 HA ALA 93 -11.457 -15.965 -15.841 764 HB1 ALA 93 1HB ALA 93 -12.153 -18.242 -16.414 765 HB2 ALA 93 2HB ALA 93 -10.751 -17.770 -17.372 766 HB3 ALA 93 3HB ALA 93 -12.357 -17.769 -18.100 767 H LEU 94 H LEU 94 -9.735 -16.068 -17.878 768 HA LEU 94 HA LEU 94 -10.031 -13.514 -19.129 769 HB2 LEU 94 2HB LEU 94 -7.764 -13.978 -20.100 770 HB3 LEU 94 1HB LEU 94 -7.850 -14.040 -18.360 771 HG LEU 94 HG LEU 94 -7.871 -16.560 -18.536 772 HD11 LEU 94 1HD1 LEU 94 -8.618 -16.818 -20.816 773 HD12 LEU 94 2HD1 LEU 94 -7.054 -17.601 -20.567 774 HD13 LEU 94 3HD1 LEU 94 -7.143 -16.050 -21.406 775 HD21 LEU 94 3HD2 LEU 94 -5.471 -16.740 -18.977 776 HD22 LEU 94 1HD2 LEU 94 -5.863 -15.365 -17.947 777 HD23 LEU 94 2HD2 LEU 94 -5.484 -15.107 -19.648 778 H GLU 95 H GLU 95 -11.656 -15.983 -19.919 779 HA GLU 95 HA GLU 95 -11.168 -16.394 -22.749 780 HB2 GLU 95 2HB GLU 95 -13.603 -17.073 -21.099 781 HB3 GLU 95 1HB GLU 95 -13.172 -17.736 -22.659 782 HG2 GLU 95 2HG GLU 95 -11.315 -18.910 -21.675 783 HG3 GLU 95 1HG GLU 95 -11.644 -18.178 -20.100 784 H GLU 96 H GLU 96 -12.949 -15.857 -24.311 785 HA GLU 96 HA GLU 96 -14.252 -13.370 -23.650 786 HB2 GLU 96 2HB GLU 96 -14.255 -15.026 -26.199 787 HB3 GLU 96 1HB GLU 96 -15.240 -13.596 -25.998 788 HG2 GLU 96 2HG GLU 96 -13.243 -13.107 -27.293 789 HG3 GLU 96 1HG GLU 96 -13.230 -12.223 -25.774 790 H ALA 97 H ALA 97 -15.630 -13.897 -22.068 791 HA ALA 97 HA ALA 97 -17.235 -16.203 -22.039 792 HB1 ALA 97 1HB ALA 97 -17.587 -13.638 -20.496 793 HB2 ALA 97 2HB ALA 97 -16.586 -15.002 -20.006 794 HB3 ALA 97 3HB ALA 97 -18.335 -15.190 -20.122 795 H LYS 98 H LYS 98 -19.186 -16.605 -22.816 796 HA LYS 98 HA LYS 98 -20.598 -14.380 -24.112 797 HB2 LYS 98 2HB LYS 98 -21.485 -15.966 -25.734 798 HB3 LYS 98 1HB LYS 98 -19.733 -16.051 -25.728 799 HG2 LYS 98 2HG LYS 98 -19.834 -18.104 -24.387 800 HG3 LYS 98 1HG LYS 98 -21.592 -17.996 -24.369 801 HD2 LYS 98 2HD LYS 98 -21.615 -18.195 -26.818 802 HD3 LYS 98 1HD LYS 98 -19.854 -18.337 -26.812 803 HE2 LYS 98 2HE LYS 98 -21.785 -20.232 -25.466 804 HE3 LYS 98 1HE LYS 98 -20.966 -20.530 -26.993 805 HZ1 LYS 98 3HZ LYS 98 -19.649 -20.239 -24.326 806 HZ2 LYS 98 1HZ LYS 98 -18.838 -20.457 -25.795 807 HZ3 LYS 98 2HZ LYS 98 -19.862 -21.641 -25.195 808 H LYS 99 H LYS 99 -22.731 -14.130 -23.615 809 HA LYS 99 HA LYS 99 -23.808 -16.055 -21.724 810 HB2 LYS 99 2HB LYS 99 -23.716 -13.778 -20.880 811 HB3 LYS 99 1HB LYS 99 -24.621 -13.197 -22.269 812 HG2 LYS 99 2HG LYS 99 -26.593 -14.406 -21.565 813 HG3 LYS 99 1HG LYS 99 -25.701 -15.141 -20.232 814 HD2 LYS 99 2HD LYS 99 -26.180 -12.179 -20.556 815 HD3 LYS 99 1HD LYS 99 -27.130 -13.249 -19.523 816 HE2 LYS 99 2HE LYS 99 -25.118 -13.800 -18.244 817 HE3 LYS 99 1HE LYS 99 -24.166 -12.750 -19.289 818 HZ1 LYS 99 3HZ LYS 99 -26.393 -11.849 -17.562 819 HZ2 LYS 99 1HZ LYS 99 -25.397 -10.875 -18.522 820 HZ3 LYS 99 2HZ LYS 99 -24.750 -11.709 -17.206 821 H VAL 100 H VAL 100 -25.163 -17.424 -22.530 822 HA VAL 100 HA VAL 100 -26.210 -16.846 -25.138 823 HB VAL 100 HB VAL 100 -26.856 -19.284 -25.233 824 HG11 VAL 100 1HG1 VAL 100 -23.963 -18.651 -24.650 825 HG12 VAL 100 2HG1 VAL 100 -24.777 -18.460 -26.204 826 HG13 VAL 100 3HG1 VAL 100 -24.546 -20.069 -25.522 827 HG21 VAL 100 3HG2 VAL 100 -27.005 -19.727 -22.818 828 HG22 VAL 100 1HG2 VAL 100 -25.273 -19.423 -22.657 829 HG23 VAL 100 2HG2 VAL 100 -25.835 -20.800 -23.593 830 H GLN 101 H GLN 101 -27.848 -15.550 -24.941 831 HA GLN 101 HA GLN 101 -30.013 -16.281 -23.172 832 HB2 GLN 101 2HB GLN 101 -29.393 -13.884 -23.350 833 HB3 GLN 101 1HB GLN 101 -29.778 -13.919 -25.062 834 HG2 GLN 101 2HG GLN 101 -32.121 -14.375 -24.545 835 HG3 GLN 101 1HG GLN 101 -31.742 -14.404 -22.824 836 HE21 GLN 101 1HE2 GLN 101 -33.601 -12.656 -24.298 837 HE22 GLN 101 2HE2 GLN 101 -33.045 -11.055 -23.970 838 H ILE 102 H ILE 102 -30.662 -18.158 -24.077 839 HA ILE 102 HA ILE 102 -31.310 -18.193 -26.854 840 HB ILE 102 HB ILE 102 -30.342 -20.220 -25.952 841 HG12 ILE 102 2HG1 ILE 102 -33.256 -20.635 -26.654 842 HG13 ILE 102 1HG1 ILE 102 -31.924 -20.511 -27.784 843 HG21 ILE 102 1HG2 ILE 102 -32.690 -20.368 -24.086 844 HG22 ILE 102 2HG2 ILE 102 -31.013 -20.041 -23.647 845 HG23 ILE 102 3HG2 ILE 102 -31.467 -21.623 -24.290 846 HD11 ILE 102 3HD1 ILE 102 -32.616 -22.822 -27.493 847 HD12 ILE 102 1HD1 ILE 102 -32.305 -22.707 -25.762 848 HD13 ILE 102 2HD1 ILE 102 -30.970 -22.582 -26.904 849 H GLU 103 H GLU 103 -33.159 -17.576 -27.651 850 HA GLU 103 HA GLU 103 -35.317 -17.313 -25.751 851 HB2 GLU 103 2HB GLU 103 -36.301 -15.595 -27.285 852 HB3 GLU 103 1HB GLU 103 -34.788 -15.155 -26.517 853 HG2 GLU 103 2HG GLU 103 -33.587 -15.625 -28.585 854 HG3 GLU 103 1HG GLU 103 -35.099 -16.109 -29.358 855 H LEU 104 H LEU 104 -36.091 -19.263 -25.812 856 HA LEU 104 HA LEU 104 -37.755 -19.742 -28.150 857 HB2 LEU 104 2HB LEU 104 -37.866 -22.131 -27.674 858 HB3 LEU 104 1HB LEU 104 -36.201 -21.656 -27.862 859 HG LEU 104 HG LEU 104 -37.565 -22.270 -25.226 860 HD11 LEU 104 1HD1 LEU 104 -36.243 -24.330 -25.310 861 HD12 LEU 104 2HD1 LEU 104 -35.672 -23.870 -26.917 862 HD13 LEU 104 3HD1 LEU 104 -37.382 -24.203 -26.653 863 HD21 LEU 104 3HD2 LEU 104 -35.655 -20.723 -24.969 864 HD22 LEU 104 1HD2 LEU 104 -34.646 -21.851 -25.876 865 HD23 LEU 104 2HD2 LEU 104 -35.306 -22.319 -24.311 866 H ASP 105 H ASP 105 -39.450 -18.752 -27.709 867 HA ASP 105 HA ASP 105 -40.242 -18.176 -25.045 868 HB2 ASP 105 2HB ASP 105 -41.644 -17.574 -27.645 869 HB3 ASP 105 1HB ASP 105 -42.107 -16.937 -26.075 870 H THR 106 H THR 106 -41.370 -20.383 -27.509 871 HA THR 106 HA THR 106 -42.995 -21.905 -27.623 872 HB THR 106 HB THR 106 -43.440 -23.311 -25.643 873 HG1 THR 106 1HG THR 106 -42.311 -21.170 -24.351 874 HG21 THR 106 3HG2 THR 106 -40.523 -22.683 -26.094 875 HG22 THR 106 1HG2 THR 106 -41.514 -23.810 -27.022 876 HG23 THR 106 2HG2 THR 106 -41.129 -24.159 -25.336 877 H SER 107 H SER 107 -43.706 -19.178 -27.180 878 HA SER 107 HA SER 107 -46.228 -19.285 -25.718 879 HB2 SER 107 2HB SER 107 -44.844 -16.955 -27.064 880 HB3 SER 107 1HB SER 107 -46.203 -16.869 -25.942 881 HG SER 107 HG SER 107 -44.507 -18.238 -24.668 882 H LEU 108 H LEU 108 -44.905 -18.538 -28.924 883 HA LEU 108 HA LEU 108 -45.685 -18.620 -31.003 884 HB2 LEU 108 2HB LEU 108 -46.475 -20.888 -30.383 885 HB3 LEU 108 1HB LEU 108 -47.973 -20.199 -29.803 886 HG LEU 108 HG LEU 108 -48.588 -19.588 -32.088 887 HD11 LEU 108 1HD1 LEU 108 -47.275 -20.413 -33.980 888 HD12 LEU 108 2HD1 LEU 108 -46.016 -20.956 -32.867 889 HD13 LEU 108 3HD1 LEU 108 -46.378 -19.238 -33.025 890 HD21 LEU 108 3HD2 LEU 108 -47.756 -22.463 -31.789 891 HD22 LEU 108 1HD2 LEU 108 -48.943 -21.841 -32.933 892 HD23 LEU 108 2HD2 LEU 108 -49.257 -21.747 -31.197 893 H SER 109 H SER 109 -47.203 -17.590 -32.479 894 HA SER 109 HA SER 109 -48.381 -15.252 -31.323 895 HB2 SER 109 2HB SER 109 -48.779 -14.729 -33.761 896 HB3 SER 109 1HB SER 109 -47.093 -15.012 -33.317 897 HG SER 109 HG SER 109 -47.093 -16.482 -34.747 898 H TYR 110 H TYR 110 -49.481 -18.250 -31.525 899 HA TYR 110 HA TYR 110 -52.138 -17.759 -32.560 900 HB2 TYR 110 2HB TYR 110 -50.999 -19.883 -33.076 901 HB3 TYR 110 1HB TYR 110 -50.870 -20.231 -31.361 902 HD1 TYR 110 1HD TYR 110 -53.191 -19.984 -34.211 903 HD2 TYR 110 2HD TYR 110 -52.722 -21.154 -30.152 904 HE1 TYR 110 1HE TYR 110 -55.329 -21.195 -34.309 905 HE2 TYR 110 2HE TYR 110 -54.858 -22.358 -30.249 906 HH TYR 110 HH TYR 110 -56.897 -22.338 -31.531 907 H ILE 111 H ILE 111 -53.369 -16.633 -31.233 908 HA ILE 111 HA ILE 111 -53.580 -17.531 -28.493 909 HB ILE 111 HB ILE 111 -52.264 -15.524 -28.358 910 HG12 ILE 111 2HG1 ILE 111 -53.740 -13.984 -27.042 911 HG13 ILE 111 1HG1 ILE 111 -55.123 -14.919 -27.591 912 HG21 ILE 111 1HG2 ILE 111 -52.645 -14.524 -30.481 913 HG22 ILE 111 2HG2 ILE 111 -52.951 -13.337 -29.213 914 HG23 ILE 111 3HG2 ILE 111 -54.300 -14.112 -30.042 915 HD11 ILE 111 3HD1 ILE 111 -54.453 -15.547 -25.339 916 HD12 ILE 111 1HD1 ILE 111 -52.841 -15.958 -25.923 917 HD13 ILE 111 2HD1 ILE 111 -54.237 -16.894 -26.455 Start of MODEL 7 1 H1 GLY -1 1HT GLY -1 -5.701 -0.677 -31.987 2 H2 GLY -1 2HT GLY -1 -7.178 -1.159 -32.576 3 H3 GLY -1 3HT GLY -1 -6.009 -2.340 -32.128 4 HA2 GLY -1 1HA GLY -1 -7.444 -0.416 -30.379 5 HA3 GLY -1 2HA GLY -1 -7.681 -2.159 -30.406 6 H SER 0 H SER 0 -7.050 -0.806 -28.065 7 HA SER 0 HA SER 0 -4.289 -1.676 -27.580 8 HB2 SER 0 2HB SER 0 -5.741 0.665 -26.317 9 HB3 SER 0 1HB SER 0 -4.057 0.203 -26.066 10 HG SER 0 HG SER 0 -3.571 0.814 -28.125 11 H MET 1 H MET 1 -4.074 -2.915 -25.694 12 HA MET 1 HA MET 1 -6.549 -3.621 -24.375 13 HB2 MET 1 2HB MET 1 -3.750 -4.709 -23.997 14 HB3 MET 1 1HB MET 1 -5.158 -5.268 -23.110 15 HG2 MET 1 2HG MET 1 -6.192 -5.935 -25.245 16 HG3 MET 1 1HG MET 1 -4.718 -5.451 -26.075 17 HE1 MET 1 3HE MET 1 -4.637 -7.855 -27.191 18 HE2 MET 1 1HE MET 1 -6.095 -8.319 -26.313 19 HE3 MET 1 2HE MET 1 -4.674 -9.361 -26.274 20 H THR 2 H THR 2 -7.238 -2.214 -22.979 21 HA THR 2 HA THR 2 -5.340 -1.115 -21.061 22 HB THR 2 HB THR 2 -7.995 0.012 -21.999 23 HG1 THR 2 1HG THR 2 -5.455 0.178 -22.974 24 HG21 THR 2 3HG2 THR 2 -7.392 0.626 -19.693 25 HG22 THR 2 1HG2 THR 2 -7.291 2.019 -20.769 26 HG23 THR 2 2HG2 THR 2 -5.819 1.191 -20.256 27 H VAL 3 H VAL 3 -5.578 -2.043 -19.151 28 HA VAL 3 HA VAL 3 -8.195 -3.193 -18.451 29 HB VAL 3 HB VAL 3 -5.572 -3.648 -17.024 30 HG11 VAL 3 1HG1 VAL 3 -7.479 -4.171 -15.690 31 HG12 VAL 3 2HG1 VAL 3 -6.647 -5.651 -16.242 32 HG13 VAL 3 3HG1 VAL 3 -8.139 -5.155 -17.016 33 HG21 VAL 3 3HG2 VAL 3 -6.767 -5.440 -19.126 34 HG22 VAL 3 1HG2 VAL 3 -5.414 -5.795 -18.053 35 HG23 VAL 3 2HG2 VAL 3 -5.255 -4.510 -19.264 36 H TYR 4 H TYR 4 -9.279 -2.311 -16.757 37 HA TYR 4 HA TYR 4 -7.985 -0.078 -15.414 38 HB2 TYR 4 2HB TYR 4 -10.904 -0.822 -15.649 39 HB3 TYR 4 1HB TYR 4 -10.282 0.589 -14.792 40 HD1 TYR 4 2HD TYR 4 -10.746 -0.931 -18.125 41 HD2 TYR 4 1HD TYR 4 -9.530 2.524 -15.980 42 HE1 TYR 4 2HE TYR 4 -10.776 0.358 -20.208 43 HE2 TYR 4 1HE TYR 4 -9.552 3.828 -18.052 44 HH TYR 4 HH TYR 4 -10.999 2.737 -20.889 45 H ILE 5 H ILE 5 -7.511 -0.119 -13.347 46 HA ILE 5 HA ILE 5 -8.282 -2.490 -11.738 47 HB ILE 5 HB ILE 5 -5.910 -0.667 -11.296 48 HG12 ILE 5 2HG1 ILE 5 -4.429 -2.417 -11.813 49 HG13 ILE 5 1HG1 ILE 5 -5.641 -3.569 -12.239 50 HG21 ILE 5 1HG2 ILE 5 -6.745 -1.618 -9.267 51 HG22 ILE 5 2HG2 ILE 5 -5.160 -2.304 -9.637 52 HG23 ILE 5 3HG2 ILE 5 -6.630 -3.241 -9.926 53 HD11 ILE 5 3HD1 ILE 5 -4.794 -1.070 -13.745 54 HD12 ILE 5 1HD1 ILE 5 -6.204 -2.022 -14.192 55 HD13 ILE 5 2HD1 ILE 5 -4.599 -2.748 -14.250 56 H CYS 6 H CYS 6 -9.719 -1.923 -10.200 57 HA CYS 6 HA CYS 6 -9.127 0.517 -8.748 58 HB2 CYS 6 2HB CYS 6 -11.248 0.890 -9.950 59 HB3 CYS 6 1HB CYS 6 -11.902 -0.575 -9.215 60 HG CYS 6 HG CYS 6 -13.121 1.365 -7.770 61 HA PRO 7 HA PRO 7 -8.642 -2.947 -5.907 62 HB2 PRO 7 2HB PRO 7 -6.929 -1.721 -4.254 63 HB3 PRO 7 1HB PRO 7 -6.420 -2.342 -5.831 64 HG2 PRO 7 2HG PRO 7 -7.106 0.464 -5.031 65 HG3 PRO 7 1HG PRO 7 -5.743 -0.115 -6.009 66 HD2 PRO 7 2HD PRO 7 -8.006 0.949 -7.067 67 HD3 PRO 7 1HD PRO 7 -7.019 -0.272 -7.909 68 H GLU 8 H GLU 8 -10.526 -0.438 -5.753 69 HA GLU 8 HA GLU 8 -10.978 -0.486 -2.841 70 HB2 GLU 8 2HB GLU 8 -11.828 1.621 -4.811 71 HB3 GLU 8 1HB GLU 8 -11.933 1.699 -3.058 72 HG2 GLU 8 2HG GLU 8 -9.508 1.575 -2.942 73 HG3 GLU 8 1HG GLU 8 -9.505 1.558 -4.720 74 H THR 9 H THR 9 -12.769 0.213 -5.836 75 HA THR 9 HA THR 9 -15.112 -0.942 -4.574 76 HB THR 9 HB THR 9 -16.391 0.475 -6.161 77 HG1 THR 9 1HG THR 9 -15.293 1.133 -7.850 78 HG21 THR 9 3HG2 THR 9 -14.238 1.909 -4.600 79 HG22 THR 9 1HG2 THR 9 -15.763 1.330 -3.929 80 HG23 THR 9 2HG2 THR 9 -15.757 2.631 -5.130 81 H GLY 10 H GLY 10 -12.809 -1.771 -6.876 82 HA2 GLY 10 2HA GLY 10 -14.800 -3.309 -8.363 83 HA3 GLY 10 1HA GLY 10 -13.238 -2.989 -9.049 84 H ASP 11 H ASP 11 -13.119 -5.288 -9.385 85 HA ASP 11 HA ASP 11 -12.093 -6.797 -7.168 86 HB2 ASP 11 2HB ASP 11 -14.496 -7.116 -6.807 87 HB3 ASP 11 1HB ASP 11 -14.674 -7.651 -8.474 88 H ASP 12 H ASP 12 -10.954 -8.589 -7.845 89 HA ASP 12 HA ASP 12 -10.068 -8.345 -10.573 90 HB2 ASP 12 2HB ASP 12 -8.363 -10.003 -10.080 91 HB3 ASP 12 1HB ASP 12 -8.437 -8.801 -8.802 92 H GLY 13 H GLY 13 -12.632 -10.011 -9.267 93 HA2 GLY 13 2HA GLY 13 -12.477 -12.269 -11.042 94 HA3 GLY 13 1HA GLY 13 -13.791 -11.849 -9.950 95 H ASN 14 H ASN 14 -13.023 -9.116 -11.527 96 HA ASN 14 HA ASN 14 -15.295 -9.309 -13.315 97 HB2 ASN 14 2HB ASN 14 -13.472 -7.062 -12.571 98 HB3 ASN 14 1HB ASN 14 -14.625 -6.846 -13.847 99 HD21 ASN 14 1HD2 ASN 14 -14.009 -6.683 -10.625 100 HD22 ASN 14 2HD2 ASN 14 -15.619 -6.382 -10.055 101 H ASP 15 H ASP 15 -14.814 -7.864 -15.424 102 HA ASP 15 HA ASP 15 -12.973 -9.460 -17.001 103 HB2 ASP 15 2HB ASP 15 -14.868 -7.254 -17.839 104 HB3 ASP 15 1HB ASP 15 -13.937 -8.267 -18.932 105 H GLY 16 H GLY 16 -12.808 -6.640 -15.250 106 HA2 GLY 16 2HA GLY 16 -11.117 -5.141 -15.017 107 HA3 GLY 16 1HA GLY 16 -10.280 -5.983 -16.321 108 H SER 17 H SER 17 -13.406 -4.835 -16.932 109 HA SER 17 HA SER 17 -12.361 -2.885 -18.793 110 HB2 SER 17 2HB SER 17 -15.195 -3.725 -18.172 111 HB3 SER 17 1HB SER 17 -14.714 -2.668 -19.505 112 HG SER 17 HG SER 17 -13.291 -4.992 -19.409 113 H GLU 18 H GLU 18 -13.826 -0.678 -18.798 114 HA GLU 18 HA GLU 18 -12.860 0.683 -16.576 115 HB2 GLU 18 2HB GLU 18 -13.403 1.597 -18.939 116 HB3 GLU 18 1HB GLU 18 -15.055 1.676 -18.345 117 HG2 GLU 18 2HG GLU 18 -14.443 3.239 -16.645 118 HG3 GLU 18 1HG GLU 18 -12.757 3.129 -17.164 119 H LEU 19 H LEU 19 -16.035 -0.746 -17.200 120 HA LEU 19 HA LEU 19 -17.208 0.456 -14.815 121 HB2 LEU 19 2HB LEU 19 -18.351 -1.431 -16.819 122 HB3 LEU 19 1HB LEU 19 -19.214 -0.786 -15.441 123 HG LEU 19 HG LEU 19 -18.130 0.783 -17.764 124 HD11 LEU 19 1HD1 LEU 19 -20.831 0.191 -16.750 125 HD12 LEU 19 2HD1 LEU 19 -20.099 -0.545 -18.186 126 HD13 LEU 19 3HD1 LEU 19 -20.487 1.199 -18.175 127 HD21 LEU 19 3HD2 LEU 19 -17.942 2.106 -15.723 128 HD22 LEU 19 1HD2 LEU 19 -19.602 1.699 -15.296 129 HD23 LEU 19 2HD2 LEU 19 -19.280 2.692 -16.713 130 H LYS 20 H LYS 20 -15.367 -2.232 -15.492 131 HA LYS 20 HA LYS 20 -16.101 -3.446 -12.916 132 HB2 LYS 20 2HB LYS 20 -15.513 -5.193 -15.306 133 HB3 LYS 20 1HB LYS 20 -16.005 -5.590 -13.706 134 HG2 LYS 20 2HG LYS 20 -18.228 -4.704 -13.979 135 HG3 LYS 20 1HG LYS 20 -17.853 -4.231 -15.639 136 HD2 LYS 20 2HD LYS 20 -17.468 -6.530 -16.248 137 HD3 LYS 20 1HD LYS 20 -17.684 -7.044 -14.583 138 HE2 LYS 20 2HE LYS 20 -20.025 -6.221 -14.683 139 HE3 LYS 20 1HE LYS 20 -19.775 -5.828 -16.385 140 HZ1 LYS 20 3HZ LYS 20 -19.298 -8.174 -16.796 141 HZ2 LYS 20 1HZ LYS 20 -20.838 -7.965 -16.134 142 HZ3 LYS 20 2HZ LYS 20 -19.563 -8.520 -15.173 143 HA PRO 21 HA PRO 21 -11.723 -2.808 -13.597 144 HB2 PRO 21 2HB PRO 21 -11.240 -1.496 -11.290 145 HB3 PRO 21 1HB PRO 21 -11.821 -0.691 -12.750 146 HG2 PRO 21 2HG PRO 21 -13.323 -1.456 -10.295 147 HG3 PRO 21 1HG PRO 21 -13.536 -0.060 -11.360 148 HD2 PRO 21 2HD PRO 21 -15.098 -2.365 -11.394 149 HD3 PRO 21 1HD PRO 21 -14.985 -1.211 -12.691 150 H LEU 22 H LEU 22 -10.060 -3.885 -12.741 151 HA LEU 22 HA LEU 22 -10.695 -6.154 -11.063 152 HB2 LEU 22 2HB LEU 22 -8.067 -5.228 -12.195 153 HB3 LEU 22 1HB LEU 22 -8.377 -6.790 -11.464 154 HG LEU 22 HG LEU 22 -9.616 -5.774 -14.004 155 HD11 LEU 22 1HD1 LEU 22 -8.248 -7.475 -15.076 156 HD12 LEU 22 2HD1 LEU 22 -7.481 -7.809 -13.517 157 HD13 LEU 22 3HD1 LEU 22 -7.294 -6.234 -14.272 158 HD21 LEU 22 3HD2 LEU 22 -9.823 -8.460 -12.653 159 HD22 LEU 22 1HD2 LEU 22 -10.451 -8.067 -14.250 160 HD23 LEU 22 2HD2 LEU 22 -11.121 -7.279 -12.825 161 H ARG 23 H ARG 23 -9.529 -6.577 -9.068 162 HA ARG 23 HA ARG 23 -9.142 -4.029 -7.736 163 HB2 ARG 23 2HB ARG 23 -9.611 -5.137 -5.655 164 HB3 ARG 23 1HB ARG 23 -10.733 -5.612 -6.846 165 HG2 ARG 23 2HG ARG 23 -9.636 -7.735 -7.193 166 HG3 ARG 23 1HG ARG 23 -8.389 -7.286 -6.028 167 HD2 ARG 23 2HD ARG 23 -10.063 -7.110 -4.270 168 HD3 ARG 23 1HD ARG 23 -11.326 -7.518 -5.424 169 HE ARG 23 HE ARG 23 -9.557 -9.576 -5.575 170 HH11 ARG 23 1HH1 ARG 23 -11.615 -8.139 -3.080 171 HH12 ARG 23 2HH1 ARG 23 -11.688 -9.537 -2.128 172 HH21 ARG 23 1HH2 ARG 23 -9.668 -11.526 -4.245 173 HH22 ARG 23 2HH2 ARG 23 -10.550 -11.475 -2.789 174 H THR 24 H THR 24 -7.237 -6.179 -9.234 175 HA THR 24 HA THR 24 -4.960 -5.128 -7.853 176 HB THR 24 HB THR 24 -5.032 -7.241 -6.707 177 HG1 THR 24 1HG THR 24 -3.066 -7.711 -7.009 178 HG21 THR 24 3HG2 THR 24 -6.559 -8.462 -8.188 179 HG22 THR 24 1HG2 THR 24 -5.106 -9.407 -7.876 180 HG23 THR 24 2HG2 THR 24 -5.302 -8.560 -9.417 181 H LEU 25 H LEU 25 -3.167 -5.011 -9.040 182 HA LEU 25 HA LEU 25 -3.502 -4.748 -11.828 183 HB2 LEU 25 2HB LEU 25 -2.093 -3.313 -10.406 184 HB3 LEU 25 1HB LEU 25 -1.077 -4.686 -10.056 185 HG LEU 25 HG LEU 25 -0.304 -4.757 -12.314 186 HD11 LEU 25 1HD1 LEU 25 -2.354 -3.988 -13.457 187 HD12 LEU 25 2HD1 LEU 25 -0.970 -3.010 -13.932 188 HD13 LEU 25 3HD1 LEU 25 -2.134 -2.379 -12.769 189 HD21 LEU 25 3HD2 LEU 25 0.855 -2.573 -12.328 190 HD22 LEU 25 1HD2 LEU 25 0.839 -3.337 -10.735 191 HD23 LEU 25 2HD2 LEU 25 -0.260 -2.012 -11.098 192 H TYR 26 H TYR 26 -2.590 -7.249 -9.660 193 HA TYR 26 HA TYR 26 -0.924 -8.880 -11.213 194 HB2 TYR 26 2HB TYR 26 -1.274 -9.237 -8.849 195 HB3 TYR 26 1HB TYR 26 -2.986 -9.530 -9.101 196 HD1 TYR 26 1HD TYR 26 0.405 -10.906 -9.635 197 HD2 TYR 26 2HD TYR 26 -3.773 -11.687 -9.660 198 HE1 TYR 26 1HE TYR 26 0.859 -13.279 -9.773 199 HE2 TYR 26 2HE TYR 26 -3.337 -14.082 -9.802 200 HH TYR 26 HH TYR 26 -1.588 -15.549 -10.571 201 H GLN 27 H GLN 27 -4.451 -8.780 -10.976 202 HA GLN 27 HA GLN 27 -4.889 -10.927 -12.788 203 HB2 GLN 27 2HB GLN 27 -6.588 -10.319 -11.166 204 HB3 GLN 27 1HB GLN 27 -6.769 -8.725 -11.867 205 HG2 GLN 27 2HG GLN 27 -8.644 -10.148 -12.507 206 HG3 GLN 27 1HG GLN 27 -7.708 -9.762 -13.928 207 HE21 GLN 27 1HE2 GLN 27 -8.456 -11.511 -15.034 208 HE22 GLN 27 2HE2 GLN 27 -7.963 -13.119 -14.740 209 H ALA 28 H ALA 28 -4.575 -7.432 -13.207 210 HA ALA 28 HA ALA 28 -5.449 -7.213 -15.811 211 HB1 ALA 28 1HB ALA 28 -5.045 -5.322 -14.277 212 HB2 ALA 28 2HB ALA 28 -4.205 -5.108 -15.802 213 HB3 ALA 28 3HB ALA 28 -3.315 -5.633 -14.370 214 H MET 29 H MET 29 -2.251 -8.034 -14.475 215 HA MET 29 HA MET 29 -1.079 -8.221 -17.013 216 HB2 MET 29 2HB MET 29 -0.240 -8.974 -14.282 217 HB3 MET 29 1HB MET 29 0.653 -9.607 -15.642 218 HG2 MET 29 2HG MET 29 1.014 -7.211 -16.397 219 HG3 MET 29 1HG MET 29 0.286 -6.689 -14.890 220 HE1 MET 29 3HE MET 29 4.099 -6.051 -14.675 221 HE2 MET 29 1HE MET 29 2.498 -5.309 -14.727 222 HE3 MET 29 2HE MET 29 3.144 -6.095 -16.165 223 H ILE 30 H ILE 30 -2.787 -10.515 -15.020 224 HA ILE 30 HA ILE 30 -1.958 -12.868 -16.340 225 HB ILE 30 HB ILE 30 -4.697 -12.352 -15.130 226 HG12 ILE 30 2HG1 ILE 30 -2.222 -13.541 -13.825 227 HG13 ILE 30 1HG1 ILE 30 -2.937 -11.976 -13.470 228 HG21 ILE 30 1HG2 ILE 30 -4.831 -14.793 -14.890 229 HG22 ILE 30 2HG2 ILE 30 -3.277 -14.947 -15.712 230 HG23 ILE 30 3HG2 ILE 30 -4.677 -14.306 -16.580 231 HD11 ILE 30 3HD1 ILE 30 -4.952 -13.085 -12.667 232 HD12 ILE 30 1HD1 ILE 30 -3.509 -13.613 -11.800 233 HD13 ILE 30 2HD1 ILE 30 -4.231 -14.651 -13.030 234 H ILE 31 H ILE 31 -4.700 -10.764 -16.863 235 HA ILE 31 HA ILE 31 -5.853 -12.182 -18.977 236 HB ILE 31 HB ILE 31 -6.156 -9.225 -18.394 237 HG12 ILE 31 2HG1 ILE 31 -7.679 -11.613 -17.330 238 HG13 ILE 31 1HG1 ILE 31 -6.594 -10.580 -16.407 239 HG21 ILE 31 1HG2 ILE 31 -7.031 -9.993 -20.570 240 HG22 ILE 31 2HG2 ILE 31 -8.347 -9.567 -19.436 241 HG23 ILE 31 3HG2 ILE 31 -7.913 -11.260 -19.683 242 HD11 ILE 31 3HD1 ILE 31 -8.077 -8.690 -16.802 243 HD12 ILE 31 1HD1 ILE 31 -8.909 -10.021 -15.975 244 HD13 ILE 31 2HD1 ILE 31 -9.151 -9.762 -17.707 245 H THR 32 H THR 32 -3.457 -9.562 -18.939 246 HA THR 32 HA THR 32 -3.686 -9.203 -21.768 247 HB THR 32 HB THR 32 -1.906 -7.491 -21.428 248 HG1 THR 32 1HG THR 32 -2.315 -7.694 -18.675 249 HG21 THR 32 3HG2 THR 32 -4.302 -7.261 -19.569 250 HG22 THR 32 1HG2 THR 32 -4.316 -6.909 -21.289 251 HG23 THR 32 2HG2 THR 32 -3.348 -5.926 -20.195 252 H LYS 33 H LYS 33 -1.317 -10.539 -19.465 253 HA LYS 33 HA LYS 33 0.528 -11.849 -19.721 254 HB2 LYS 33 2HB LYS 33 -0.819 -12.478 -22.361 255 HB3 LYS 33 1HB LYS 33 0.575 -13.353 -21.746 256 HG2 LYS 33 2HG LYS 33 -0.663 -14.202 -19.895 257 HG3 LYS 33 1HG LYS 33 -2.019 -13.129 -20.239 258 HD2 LYS 33 2HD LYS 33 -1.069 -15.329 -22.071 259 HD3 LYS 33 1HD LYS 33 -2.385 -15.510 -20.911 260 HE2 LYS 33 2HE LYS 33 -3.592 -13.671 -22.036 261 HE3 LYS 33 1HE LYS 33 -2.294 -13.558 -23.223 262 HZ1 LYS 33 3HZ LYS 33 -2.812 -15.811 -23.946 263 HZ2 LYS 33 1HZ LYS 33 -4.211 -14.857 -24.011 264 HZ3 LYS 33 2HZ LYS 33 -3.976 -15.944 -22.749 265 H SER 34 H SER 34 0.354 -9.085 -20.814 266 HA SER 34 HA SER 34 2.384 -9.141 -22.933 267 HB2 SER 34 2HB SER 34 0.303 -7.903 -23.388 268 HB3 SER 34 1HB SER 34 0.610 -6.874 -21.996 269 HG SER 34 HG SER 34 1.875 -5.725 -23.151 270 H SER 35 H SER 35 2.354 -8.851 -19.637 271 HA SER 35 HA SER 35 3.652 -8.105 -18.020 272 HB2 SER 35 2HB SER 35 6.154 -7.841 -18.444 273 HB3 SER 35 1HB SER 35 5.448 -9.385 -18.899 274 HG SER 35 HG SER 35 5.349 -7.719 -21.003 275 H LYS 36 H LYS 36 3.047 -5.911 -20.488 276 HA LYS 36 HA LYS 36 2.901 -3.807 -18.722 277 HB2 LYS 36 2HB LYS 36 5.358 -3.708 -19.294 278 HB3 LYS 36 1HB LYS 36 4.907 -3.621 -20.992 279 HG2 LYS 36 2HG LYS 36 3.751 -1.536 -20.610 280 HG3 LYS 36 1HG LYS 36 4.132 -1.608 -18.893 281 HD2 LYS 36 2HD LYS 36 5.656 -0.079 -20.004 282 HD3 LYS 36 1HD LYS 36 6.542 -1.503 -19.466 283 HE2 LYS 36 2HE LYS 36 7.244 -0.860 -21.703 284 HE3 LYS 36 1HE LYS 36 6.430 -2.417 -21.756 285 HZ1 LYS 36 3HZ LYS 36 5.226 0.208 -22.488 286 HZ2 LYS 36 1HZ LYS 36 4.402 -1.231 -22.518 287 HZ3 LYS 36 2HZ LYS 36 5.696 -1.000 -23.562 288 H GLY 37 H GLY 37 1.631 -2.268 -19.757 289 HA2 GLY 37 2HA GLY 37 0.961 -2.076 -22.406 290 HA3 GLY 37 1HA GLY 37 -0.166 -3.223 -21.669 291 H ASP 38 H ASP 38 -1.807 -1.538 -22.052 292 HA ASP 38 HA ASP 38 -1.486 0.771 -20.365 293 HB2 ASP 38 2HB ASP 38 -3.815 -0.150 -22.055 294 HB3 ASP 38 1HB ASP 38 -3.806 1.337 -21.111 295 H PHE 39 H PHE 39 -1.660 0.479 -18.352 296 HA PHE 39 HA PHE 39 -3.924 -1.044 -17.312 297 HB2 PHE 39 2HB PHE 39 -1.160 -0.797 -16.088 298 HB3 PHE 39 1HB PHE 39 -2.536 -1.600 -15.345 299 HD1 PHE 39 1HD PHE 39 -3.616 -3.444 -16.880 300 HD2 PHE 39 2HD PHE 39 0.397 -2.121 -17.172 301 HE1 PHE 39 1HE PHE 39 -2.997 -5.568 -17.954 302 HE2 PHE 39 2HE PHE 39 1.019 -4.234 -18.246 303 HZ PHE 39 HZ PHE 39 -0.669 -5.958 -18.641 304 H LEU 40 H LEU 40 -5.278 0.323 -16.425 305 HA LEU 40 HA LEU 40 -4.106 2.798 -15.358 306 HB2 LEU 40 2HB LEU 40 -6.892 2.516 -16.505 307 HB3 LEU 40 1HB LEU 40 -6.095 3.934 -15.852 308 HG LEU 40 HG LEU 40 -5.250 2.521 -18.374 309 HD11 LEU 40 1HD1 LEU 40 -6.731 5.113 -17.990 310 HD12 LEU 40 2HD1 LEU 40 -7.392 3.618 -18.649 311 HD13 LEU 40 3HD1 LEU 40 -6.128 4.486 -19.522 312 HD21 LEU 40 3HD2 LEU 40 -3.389 3.615 -17.257 313 HD22 LEU 40 1HD2 LEU 40 -4.313 5.112 -17.134 314 HD23 LEU 40 2HD2 LEU 40 -3.831 4.496 -18.716 315 H ILE 41 H ILE 41 -4.345 3.103 -13.314 316 HA ILE 41 HA ILE 41 -6.281 1.401 -11.946 317 HB ILE 41 HB ILE 41 -3.739 2.603 -10.817 318 HG12 ILE 41 2HG1 ILE 41 -4.338 -0.131 -12.006 319 HG13 ILE 41 1HG1 ILE 41 -3.065 0.983 -12.366 320 HG21 ILE 41 1HG2 ILE 41 -5.675 0.609 -9.637 321 HG22 ILE 41 2HG2 ILE 41 -5.508 2.290 -9.175 322 HG23 ILE 41 3HG2 ILE 41 -4.171 1.161 -8.871 323 HD11 ILE 41 3HD1 ILE 41 -1.928 0.458 -10.293 324 HD12 ILE 41 1HD1 ILE 41 -2.359 -1.030 -11.195 325 HD13 ILE 41 2HD1 ILE 41 -3.308 -0.552 -9.821 326 H ARG 42 H ARG 42 -7.714 2.238 -10.598 327 HA ARG 42 HA ARG 42 -8.469 4.928 -10.876 328 HB2 ARG 42 2HB ARG 42 -9.962 2.980 -10.226 329 HB3 ARG 42 1HB ARG 42 -9.281 3.118 -8.615 330 HG2 ARG 42 2HG ARG 42 -11.435 4.281 -8.671 331 HG3 ARG 42 1HG ARG 42 -10.125 5.423 -8.479 332 HD2 ARG 42 2HD ARG 42 -10.565 6.455 -10.400 333 HD3 ARG 42 1HD ARG 42 -10.866 4.945 -11.291 334 HE ARG 42 HE ARG 42 -12.922 5.532 -9.470 335 HH11 ARG 42 1HH1 ARG 42 -11.610 6.691 -12.568 336 HH12 ARG 42 2HH1 ARG 42 -13.106 7.149 -13.195 337 HH21 ARG 42 1HH2 ARG 42 -14.998 6.162 -10.354 338 HH22 ARG 42 2HH2 ARG 42 -15.097 6.860 -11.903 339 H THR 43 H THR 43 -7.892 6.561 -9.906 340 HA THR 43 HA THR 43 -6.068 6.472 -7.621 341 HB THR 43 HB THR 43 -5.974 7.747 -10.310 342 HG1 THR 43 1HG THR 43 -5.130 5.787 -10.309 343 HG21 THR 43 3HG2 THR 43 -5.348 9.514 -8.874 344 HG22 THR 43 1HG2 THR 43 -3.922 8.915 -9.673 345 HG23 THR 43 2HG2 THR 43 -4.192 8.488 -7.967 346 H LYS 44 H LYS 44 -6.380 8.296 -6.224 347 HA LYS 44 HA LYS 44 -8.471 10.118 -7.102 348 HB2 LYS 44 2HB LYS 44 -7.617 9.449 -4.287 349 HB3 LYS 44 1HB LYS 44 -8.689 10.806 -4.649 350 HG2 LYS 44 2HG LYS 44 -10.142 9.152 -3.987 351 HG3 LYS 44 1HG LYS 44 -10.159 8.945 -5.733 352 HD2 LYS 44 2HD LYS 44 -9.960 6.751 -4.804 353 HD3 LYS 44 1HD LYS 44 -8.355 7.233 -5.397 354 HE2 LYS 44 2HE LYS 44 -7.637 7.804 -3.165 355 HE3 LYS 44 1HE LYS 44 -9.263 7.506 -2.551 356 HZ1 LYS 44 3HZ LYS 44 -9.010 5.186 -3.070 357 HZ2 LYS 44 1HZ LYS 44 -7.749 5.695 -2.087 358 HZ3 LYS 44 2HZ LYS 44 -7.473 5.447 -3.720 359 H LYS 45 H LYS 45 -7.765 11.843 -7.855 360 HA LYS 45 HA LYS 45 -5.202 12.921 -6.881 361 HB2 LYS 45 2HB LYS 45 -5.134 11.856 -9.270 362 HB3 LYS 45 1HB LYS 45 -6.295 13.080 -9.672 363 HG2 LYS 45 2HG LYS 45 -4.704 14.802 -9.259 364 HG3 LYS 45 1HG LYS 45 -3.520 13.608 -8.713 365 HD2 LYS 45 2HD LYS 45 -4.867 13.482 -11.325 366 HD3 LYS 45 1HD LYS 45 -3.296 14.336 -11.171 367 HE2 LYS 45 2HE LYS 45 -3.971 11.379 -10.766 368 HE3 LYS 45 1HE LYS 45 -3.038 12.082 -12.070 369 HZ1 LYS 45 3HZ LYS 45 -2.200 12.011 -9.216 370 HZ2 LYS 45 1HZ LYS 45 -1.342 12.702 -10.502 371 HZ3 LYS 45 2HZ LYS 45 -1.631 11.049 -10.483 372 H ASP 46 H ASP 46 -5.722 14.700 -5.803 373 HA ASP 46 HA ASP 46 -6.626 16.653 -5.176 374 HB2 ASP 46 2HB ASP 46 -6.931 16.978 -8.168 375 HB3 ASP 46 1HB ASP 46 -7.244 18.275 -7.016 376 H GLY 47 H GLY 47 -8.303 14.442 -5.100 377 HA2 GLY 47 2HA GLY 47 -10.447 14.278 -4.187 378 HA3 GLY 47 1HA GLY 47 -10.821 15.860 -4.839 379 H LYS 48 H LYS 48 -9.537 14.264 -7.385 380 HA LYS 48 HA LYS 48 -12.197 13.435 -8.327 381 HB2 LYS 48 2HB LYS 48 -9.621 13.831 -9.824 382 HB3 LYS 48 1HB LYS 48 -11.153 13.380 -10.544 383 HG2 LYS 48 2HG LYS 48 -12.079 15.544 -9.903 384 HG3 LYS 48 1HG LYS 48 -10.521 15.982 -9.177 385 HD2 LYS 48 2HD LYS 48 -9.425 15.650 -11.339 386 HD3 LYS 48 1HD LYS 48 -10.976 15.232 -12.051 387 HE2 LYS 48 2HE LYS 48 -11.811 17.457 -11.623 388 HE3 LYS 48 1HE LYS 48 -10.308 17.883 -10.796 389 HZ1 LYS 48 3HZ LYS 48 -10.528 17.104 -13.653 390 HZ2 LYS 48 1HZ LYS 48 -9.115 17.524 -12.849 391 HZ3 LYS 48 2HZ LYS 48 -10.306 18.676 -13.093 392 H GLN 49 H GLN 49 -12.543 11.320 -9.158 393 HA GLN 49 HA GLN 49 -10.505 9.391 -8.463 394 HB2 GLN 49 2HB GLN 49 -13.284 8.932 -9.602 395 HB3 GLN 49 1HB GLN 49 -12.223 7.756 -8.879 396 HG2 GLN 49 2HG GLN 49 -12.436 8.807 -6.704 397 HG3 GLN 49 1HG GLN 49 -13.486 10.042 -7.400 398 HE21 GLN 49 1HE2 GLN 49 -13.221 6.756 -6.403 399 HE22 GLN 49 2HE2 GLN 49 -14.891 6.378 -6.470 400 H VAL 50 H VAL 50 -9.238 8.758 -10.007 401 HA VAL 50 HA VAL 50 -9.938 9.304 -12.802 402 HB VAL 50 HB VAL 50 -7.520 10.122 -13.129 403 HG11 VAL 50 1HG1 VAL 50 -8.077 12.436 -12.449 404 HG12 VAL 50 2HG1 VAL 50 -9.399 11.818 -11.455 405 HG13 VAL 50 3HG1 VAL 50 -9.465 11.654 -13.210 406 HG21 VAL 50 3HG2 VAL 50 -6.476 11.167 -11.172 407 HG22 VAL 50 1HG2 VAL 50 -6.603 9.418 -11.038 408 HG23 VAL 50 2HG2 VAL 50 -7.723 10.450 -10.147 409 H TRP 51 H TRP 51 -8.364 8.315 -14.302 410 HA TRP 51 HA TRP 51 -7.428 5.773 -13.234 411 HB2 TRP 51 2HB TRP 51 -8.074 6.679 -16.033 412 HB3 TRP 51 1HB TRP 51 -7.446 5.110 -15.710 413 HD1 TRP 51 HD TRP 51 -10.433 6.691 -16.480 414 HE1 TRP 51 1HE TRP 51 -12.546 5.290 -15.806 415 HE3 TRP 51 3HE TRP 51 -8.226 3.481 -13.234 416 HZ2 TRP 51 2HZ TRP 51 -13.131 3.132 -14.141 417 HZ3 TRP 51 3HZ TRP 51 -9.610 1.765 -12.131 418 HH2 TRP 51 HH TRP 51 -12.008 1.594 -12.563 419 H GLU 52 H GLU 52 -5.286 5.779 -12.855 420 HA GLU 52 HA GLU 52 -3.565 7.465 -14.548 421 HB2 GLU 52 2HB GLU 52 -3.600 8.226 -12.187 422 HB3 GLU 52 1HB GLU 52 -3.133 6.620 -11.660 423 HG2 GLU 52 2HG GLU 52 -0.990 6.858 -12.788 424 HG3 GLU 52 1HG GLU 52 -1.449 8.456 -13.365 425 H ALA 53 H ALA 53 -1.676 6.535 -15.305 426 HA ALA 53 HA ALA 53 -1.829 3.802 -15.926 427 HB1 ALA 53 1HB ALA 53 0.559 5.632 -16.133 428 HB2 ALA 53 2HB ALA 53 -0.700 5.438 -17.356 429 HB3 ALA 53 3HB ALA 53 0.356 4.085 -16.953 430 H ALA 54 H ALA 54 -0.959 2.077 -15.103 431 HA ALA 54 HA ALA 54 -0.135 1.927 -12.434 432 HB1 ALA 54 1HB ALA 54 0.369 -0.058 -14.640 433 HB2 ALA 54 2HB ALA 54 -1.092 0.035 -13.655 434 HB3 ALA 54 3HB ALA 54 0.449 -0.385 -12.909 435 H SER 55 H SER 55 1.942 1.288 -11.576 436 HA SER 55 HA SER 55 4.015 2.842 -12.889 437 HB2 SER 55 2HB SER 55 3.817 1.801 -10.059 438 HB3 SER 55 1HB SER 55 4.993 2.962 -10.676 439 HG SER 55 HG SER 55 3.071 4.232 -11.263 440 H LYS 56 H LYS 56 6.058 1.923 -13.158 441 HA LYS 56 HA LYS 56 6.121 -0.771 -13.890 442 HB2 LYS 56 2HB LYS 56 8.422 1.083 -13.292 443 HB3 LYS 56 1HB LYS 56 8.585 -0.504 -14.032 444 HG2 LYS 56 2HG LYS 56 7.209 0.228 -15.913 445 HG3 LYS 56 1HG LYS 56 7.043 1.815 -15.166 446 HD2 LYS 56 2HD LYS 56 9.447 2.155 -15.315 447 HD3 LYS 56 1HD LYS 56 9.649 0.546 -16.004 448 HE2 LYS 56 2HE LYS 56 9.691 2.259 -17.750 449 HE3 LYS 56 1HE LYS 56 8.304 1.188 -17.934 450 HZ1 LYS 56 3HZ LYS 56 7.687 3.486 -18.269 451 HZ2 LYS 56 1HZ LYS 56 8.223 3.908 -16.726 452 HZ3 LYS 56 2HZ LYS 56 6.907 2.885 -16.910 453 H THR 57 H THR 57 6.889 0.740 -10.833 454 HA THR 57 HA THR 57 8.165 -1.462 -9.659 455 HB THR 57 HB THR 57 7.533 -0.259 -7.520 456 HG1 THR 57 1HG THR 57 6.396 1.621 -7.686 457 HG21 THR 57 3HG2 THR 57 8.803 1.401 -9.713 458 HG22 THR 57 1HG2 THR 57 9.643 0.227 -8.703 459 HG23 THR 57 2HG2 THR 57 8.972 1.688 -7.984 460 H ALA 58 H ALA 58 4.827 -0.345 -9.682 461 HA ALA 58 HA ALA 58 3.796 -2.439 -8.039 462 HB1 ALA 58 1HB ALA 58 2.326 -0.643 -9.975 463 HB2 ALA 58 2HB ALA 58 2.643 -0.278 -8.279 464 HB3 ALA 58 3HB ALA 58 1.585 -1.622 -8.706 465 H LEU 59 H LEU 59 4.045 -1.912 -11.512 466 HA LEU 59 HA LEU 59 2.699 -4.207 -12.352 467 HB2 LEU 59 2HB LEU 59 4.883 -2.533 -13.589 468 HB3 LEU 59 1HB LEU 59 4.091 -3.936 -14.408 469 HG LEU 59 HG LEU 59 2.646 -1.443 -13.494 470 HD11 LEU 59 1HD1 LEU 59 4.401 -0.840 -15.125 471 HD12 LEU 59 2HD1 LEU 59 2.791 -0.721 -15.834 472 HD13 LEU 59 3HD1 LEU 59 3.816 -2.105 -16.204 473 HD21 LEU 59 3HD2 LEU 59 0.970 -2.198 -15.008 474 HD22 LEU 59 1HD2 LEU 59 1.343 -3.540 -13.934 475 HD23 LEU 59 2HD2 LEU 59 1.984 -3.509 -15.583 476 H LYS 60 H LYS 60 6.114 -3.598 -11.532 477 HA LYS 60 HA LYS 60 7.165 -6.048 -12.196 478 HB2 LYS 60 2HB LYS 60 8.443 -3.992 -11.537 479 HB3 LYS 60 1HB LYS 60 7.964 -4.289 -9.881 480 HG2 LYS 60 2HG LYS 60 10.208 -5.084 -10.192 481 HG3 LYS 60 1HG LYS 60 9.127 -6.454 -9.941 482 HD2 LYS 60 2HD LYS 60 10.657 -6.995 -11.725 483 HD3 LYS 60 1HD LYS 60 9.025 -6.758 -12.372 484 HE2 LYS 60 2HE LYS 60 9.613 -4.517 -13.109 485 HE3 LYS 60 1HE LYS 60 11.223 -4.692 -12.418 486 HZ1 LYS 60 3HZ LYS 60 10.088 -6.293 -14.639 487 HZ2 LYS 60 1HZ LYS 60 11.610 -6.524 -13.983 488 HZ3 LYS 60 2HZ LYS 60 11.260 -5.086 -14.789 489 H LYS 61 H LYS 61 5.617 -4.982 -9.177 490 HA LYS 61 HA LYS 61 6.050 -7.355 -7.685 491 HB2 LYS 61 2HB LYS 61 3.785 -5.376 -7.450 492 HB3 LYS 61 1HB LYS 61 4.232 -6.563 -6.241 493 HG2 LYS 61 2HG LYS 61 6.374 -5.454 -5.934 494 HG3 LYS 61 1HG LYS 61 5.937 -4.266 -7.167 495 HD2 LYS 61 2HD LYS 61 3.994 -3.622 -5.803 496 HD3 LYS 61 1HD LYS 61 4.515 -4.757 -4.561 497 HE2 LYS 61 2HE LYS 61 6.627 -3.522 -4.343 498 HE3 LYS 61 1HE LYS 61 6.062 -2.373 -5.558 499 HZ1 LYS 61 3HZ LYS 61 5.688 -1.526 -3.330 500 HZ2 LYS 61 1HZ LYS 61 4.787 -2.890 -2.940 501 HZ3 LYS 61 2HZ LYS 61 4.211 -1.818 -4.099 502 H SER 62 H SER 62 3.523 -6.326 -9.843 503 HA SER 62 HA SER 62 1.715 -8.444 -9.367 504 HB2 SER 62 2HB SER 62 2.010 -6.603 -11.757 505 HB3 SER 62 1HB SER 62 0.581 -7.564 -11.376 506 HG SER 62 HG SER 62 1.668 -5.355 -9.991 507 H TRP 63 H TRP 63 4.283 -7.891 -11.779 508 HA TRP 63 HA TRP 63 3.719 -10.251 -13.210 509 HB2 TRP 63 2HB TRP 63 4.701 -8.245 -14.229 510 HB3 TRP 63 1HB TRP 63 6.131 -8.442 -13.227 511 HD1 TRP 63 HD TRP 63 7.951 -9.920 -14.122 512 HE1 TRP 63 1HE TRP 63 8.274 -11.395 -16.234 513 HE3 TRP 63 3HE TRP 63 3.178 -9.825 -15.851 514 HZ2 TRP 63 2HZ TRP 63 6.645 -12.389 -18.349 515 HZ3 TRP 63 3HZ TRP 63 2.623 -11.065 -17.913 516 HH2 TRP 63 HH TRP 63 4.322 -12.307 -19.126 517 H LYS 64 H LYS 64 6.005 -9.332 -10.674 518 HA LYS 64 HA LYS 64 7.610 -11.619 -10.790 519 HB2 LYS 64 2HB LYS 64 8.206 -9.579 -9.497 520 HB3 LYS 64 1HB LYS 64 6.935 -9.951 -8.355 521 HG2 LYS 64 2HG LYS 64 9.089 -10.590 -7.439 522 HG3 LYS 64 1HG LYS 64 8.092 -12.015 -7.712 523 HD2 LYS 64 2HD LYS 64 10.393 -12.443 -8.409 524 HD3 LYS 64 1HD LYS 64 9.330 -12.463 -9.809 525 HE2 LYS 64 2HE LYS 64 10.018 -10.166 -10.360 526 HE3 LYS 64 1HE LYS 64 11.069 -10.145 -8.944 527 HZ1 LYS 64 3HZ LYS 64 12.385 -11.915 -9.945 528 HZ2 LYS 64 1HZ LYS 64 12.274 -10.601 -10.971 529 HZ3 LYS 64 2HZ LYS 64 11.356 -11.970 -11.284 530 H ARG 65 H ARG 65 4.618 -10.968 -9.008 531 HA ARG 65 HA ARG 65 4.528 -13.477 -7.659 532 HB2 ARG 65 2HB ARG 65 3.087 -11.428 -7.057 533 HB3 ARG 65 1HB ARG 65 2.159 -11.804 -8.483 534 HG2 ARG 65 2HG ARG 65 1.596 -13.993 -7.614 535 HG3 ARG 65 1HG ARG 65 2.525 -13.660 -6.159 536 HD2 ARG 65 2HD ARG 65 1.007 -11.798 -5.640 537 HD3 ARG 65 1HD ARG 65 0.073 -12.170 -7.096 538 HE ARG 65 HE ARG 65 0.419 -14.413 -5.385 539 HH11 ARG 65 1HH1 ARG 65 -1.639 -11.577 -5.914 540 HH12 ARG 65 2HH1 ARG 65 -2.960 -12.206 -5.043 541 HH21 ARG 65 1HH2 ARG 65 -1.409 -15.282 -4.218 542 HH22 ARG 65 2HH2 ARG 65 -2.825 -14.363 -4.066 543 H TYR 66 H TYR 66 3.179 -12.250 -10.670 544 HA TYR 66 HA TYR 66 1.618 -14.357 -11.578 545 HB2 TYR 66 2HB TYR 66 1.808 -12.115 -12.592 546 HB3 TYR 66 1HB TYR 66 3.430 -12.506 -13.125 547 HD1 TYR 66 2HD TYR 66 -0.100 -13.580 -13.453 548 HD2 TYR 66 1HD TYR 66 3.750 -13.430 -15.236 549 HE1 TYR 66 2HE TYR 66 -1.048 -14.384 -15.540 550 HE2 TYR 66 1HE TYR 66 2.833 -14.221 -17.323 551 HH TYR 66 HH TYR 66 -0.512 -14.379 -17.934 552 H GLU 67 H GLU 67 5.066 -13.810 -12.150 553 HA GLU 67 HA GLU 67 5.735 -16.198 -13.539 554 HB2 GLU 67 2HB GLU 67 7.384 -14.646 -11.551 555 HB3 GLU 67 1HB GLU 67 7.992 -15.767 -12.761 556 HG2 GLU 67 2HG GLU 67 6.465 -13.312 -13.342 557 HG3 GLU 67 1HG GLU 67 8.231 -13.334 -13.292 558 H GLN 68 H GLN 68 5.877 -15.445 -10.162 559 HA GLN 68 HA GLN 68 6.867 -17.958 -9.334 560 HB2 GLN 68 2HB GLN 68 5.343 -15.894 -7.771 561 HB3 GLN 68 1HB GLN 68 6.036 -17.324 -7.034 562 HG2 GLN 68 2HG GLN 68 7.543 -15.158 -8.480 563 HG3 GLN 68 1HG GLN 68 7.484 -15.405 -6.734 564 HE21 GLN 68 1HE2 GLN 68 8.777 -16.556 -9.738 565 HE22 GLN 68 2HE2 GLN 68 9.939 -17.628 -9.062 566 H GLU 69 H GLU 69 3.540 -16.783 -9.333 567 HA GLU 69 HA GLU 69 2.327 -19.021 -8.206 568 HB2 GLU 69 2HB GLU 69 1.229 -17.057 -10.205 569 HB3 GLU 69 1HB GLU 69 0.269 -18.207 -9.294 570 HG2 GLU 69 2HG GLU 69 1.961 -16.054 -8.057 571 HG3 GLU 69 1HG GLU 69 0.237 -15.896 -8.389 572 H MET 70 H MET 70 2.735 -18.207 -11.667 573 HA MET 70 HA MET 70 1.544 -20.708 -12.449 574 HB2 MET 70 2HB MET 70 2.020 -20.088 -14.752 575 HB3 MET 70 1HB MET 70 1.288 -18.743 -13.895 576 HG2 MET 70 2HG MET 70 3.543 -17.760 -13.628 577 HG3 MET 70 1HG MET 70 4.195 -19.078 -14.594 578 HE1 MET 70 3HE MET 70 1.812 -19.429 -16.776 579 HE2 MET 70 1HE MET 70 3.535 -19.474 -17.176 580 HE3 MET 70 2HE MET 70 2.446 -18.403 -18.061 581 H LEU 71 H LEU 71 4.779 -19.725 -11.746 582 HA LEU 71 HA LEU 71 6.052 -21.834 -13.128 583 HB2 LEU 71 2HB LEU 71 7.338 -19.979 -12.634 584 HB3 LEU 71 1HB LEU 71 6.919 -19.928 -10.953 585 HG LEU 71 HG LEU 71 8.243 -22.038 -10.664 586 HD11 LEU 71 1HD1 LEU 71 9.831 -22.657 -12.442 587 HD12 LEU 71 2HD1 LEU 71 9.063 -21.484 -13.510 588 HD13 LEU 71 3HD1 LEU 71 8.155 -22.885 -12.938 589 HD21 LEU 71 3HD2 LEU 71 9.209 -19.883 -10.120 590 HD22 LEU 71 1HD2 LEU 71 9.714 -19.662 -11.794 591 HD23 LEU 71 2HD2 LEU 71 10.437 -20.939 -10.817 592 H LYS 72 H LYS 72 5.027 -21.406 -9.764 593 HA LYS 72 HA LYS 72 5.779 -24.074 -9.105 594 HB2 LYS 72 2HB LYS 72 5.667 -22.344 -7.379 595 HB3 LYS 72 1HB LYS 72 3.953 -22.144 -7.672 596 HG2 LYS 72 2HG LYS 72 4.098 -23.379 -5.669 597 HG3 LYS 72 1HG LYS 72 3.672 -24.543 -6.906 598 HD2 LYS 72 2HD LYS 72 6.485 -24.127 -5.846 599 HD3 LYS 72 1HD LYS 72 5.373 -25.330 -5.224 600 HE2 LYS 72 2HE LYS 72 6.613 -25.259 -8.009 601 HE3 LYS 72 1HE LYS 72 6.982 -26.328 -6.698 602 HZ1 LYS 72 3HZ LYS 72 4.353 -26.301 -8.110 603 HZ2 LYS 72 1HZ LYS 72 4.796 -27.314 -6.820 604 HZ3 LYS 72 2HZ LYS 72 5.583 -27.401 -8.297 605 H ASN 73 H ASN 73 2.853 -22.398 -9.998 606 HA ASN 73 HA ASN 73 0.866 -22.956 -10.715 607 HB2 ASN 73 2HB ASN 73 2.046 -24.179 -12.485 608 HB3 ASN 73 1HB ASN 73 2.119 -25.606 -11.464 609 HD21 ASN 73 1HD2 ASN 73 0.091 -23.575 -13.413 610 HD22 ASN 73 2HD2 ASN 73 -1.258 -24.631 -13.511 611 H GLU 74 H GLU 74 -0.309 -22.845 -9.013 612 HA GLU 74 HA GLU 74 -0.667 -25.196 -7.305 613 HB2 GLU 74 2HB GLU 74 -0.242 -23.068 -6.182 614 HB3 GLU 74 1HB GLU 74 -1.605 -22.341 -7.019 615 HG2 GLU 74 2HG GLU 74 -3.067 -24.055 -5.898 616 HG3 GLU 74 1HG GLU 74 -1.669 -24.482 -4.916 617 H LYS 75 H LYS 75 -2.582 -22.684 -8.895 618 HA LYS 75 HA LYS 75 -4.853 -24.534 -8.907 619 HB2 LYS 75 2HB LYS 75 -6.290 -22.574 -8.887 620 HB3 LYS 75 1HB LYS 75 -5.205 -22.577 -7.503 621 HG2 LYS 75 2HG LYS 75 -3.790 -20.916 -8.585 622 HG3 LYS 75 1HG LYS 75 -4.808 -20.957 -10.020 623 HD2 LYS 75 2HD LYS 75 -5.437 -19.004 -8.837 624 HD3 LYS 75 1HD LYS 75 -6.705 -20.175 -8.525 625 HE2 LYS 75 2HE LYS 75 -4.444 -19.444 -6.635 626 HE3 LYS 75 1HE LYS 75 -6.100 -18.880 -6.513 627 HZ1 LYS 75 3HZ LYS 75 -5.050 -21.614 -5.985 628 HZ2 LYS 75 1HZ LYS 75 -6.713 -21.302 -6.200 629 HZ3 LYS 75 2HZ LYS 75 -5.849 -20.561 -4.988 630 H VAL 76 H VAL 76 -6.036 -24.797 -10.735 631 HA VAL 76 HA VAL 76 -5.217 -23.240 -13.016 632 HB VAL 76 HB VAL 76 -4.553 -25.462 -13.477 633 HG11 VAL 76 1HG1 VAL 76 -5.939 -26.741 -11.936 634 HG12 VAL 76 2HG1 VAL 76 -6.117 -27.405 -13.559 635 HG13 VAL 76 3HG1 VAL 76 -7.380 -26.375 -12.887 636 HG21 VAL 76 3HG2 VAL 76 -7.068 -24.845 -15.015 637 HG22 VAL 76 1HG2 VAL 76 -5.845 -26.013 -15.528 638 HG23 VAL 76 2HG2 VAL 76 -5.430 -24.305 -15.390 639 H ALA 77 H ALA 77 -6.487 -21.726 -12.548 640 HA ALA 77 HA ALA 77 -9.289 -22.069 -13.207 641 HB1 ALA 77 1HB ALA 77 -10.078 -20.869 -11.215 642 HB2 ALA 77 2HB ALA 77 -8.427 -20.806 -10.600 643 HB3 ALA 77 3HB ALA 77 -9.241 -22.358 -10.768 644 H ALA 78 H ALA 78 -9.149 -20.790 -14.939 645 HA ALA 78 HA ALA 78 -8.675 -17.975 -14.450 646 HB1 ALA 78 1HB ALA 78 -7.262 -17.744 -16.430 647 HB2 ALA 78 2HB ALA 78 -7.316 -19.488 -16.683 648 HB3 ALA 78 3HB ALA 78 -6.517 -18.827 -15.253 649 H LYS 79 H LYS 79 -10.398 -16.998 -15.148 650 HA LYS 79 HA LYS 79 -11.616 -17.901 -17.645 651 HB2 LYS 79 2HB LYS 79 -13.062 -16.852 -15.216 652 HB3 LYS 79 1HB LYS 79 -13.802 -17.170 -16.779 653 HG2 LYS 79 2HG LYS 79 -13.208 -19.514 -16.584 654 HG3 LYS 79 1HG LYS 79 -12.483 -19.197 -15.007 655 HD2 LYS 79 2HD LYS 79 -14.671 -18.424 -14.204 656 HD3 LYS 79 1HD LYS 79 -15.349 -18.810 -15.796 657 HE2 LYS 79 2HE LYS 79 -14.060 -20.772 -13.902 658 HE3 LYS 79 1HE LYS 79 -15.783 -20.593 -14.178 659 HZ1 LYS 79 3HZ LYS 79 -15.450 -21.232 -16.490 660 HZ2 LYS 79 1HZ LYS 79 -14.887 -22.431 -15.445 661 HZ3 LYS 79 2HZ LYS 79 -13.793 -21.419 -16.230 662 H MET 80 H MET 80 -10.797 -16.464 -18.958 663 HA MET 80 HA MET 80 -11.507 -13.708 -18.488 664 HB2 MET 80 2HB MET 80 -9.217 -12.929 -19.033 665 HB3 MET 80 1HB MET 80 -9.311 -13.804 -17.513 666 HG2 MET 80 2HG MET 80 -8.429 -15.808 -18.639 667 HG3 MET 80 1HG MET 80 -8.288 -14.886 -20.134 668 HE1 MET 80 3HE MET 80 -4.562 -15.336 -19.023 669 HE2 MET 80 1HE MET 80 -5.733 -15.559 -20.323 670 HE3 MET 80 2HE MET 80 -5.877 -16.500 -18.838 671 H LEU 81 H LEU 81 -12.341 -12.926 -20.250 672 HA LEU 81 HA LEU 81 -11.845 -14.285 -22.762 673 HB2 LEU 81 2HB LEU 81 -13.811 -12.082 -22.097 674 HB3 LEU 81 1HB LEU 81 -13.692 -12.893 -23.644 675 HG LEU 81 HG LEU 81 -14.557 -14.145 -21.036 676 HD11 LEU 81 1HD1 LEU 81 -16.230 -12.679 -21.984 677 HD12 LEU 81 2HD1 LEU 81 -16.721 -14.368 -22.134 678 HD13 LEU 81 3HD1 LEU 81 -16.099 -13.503 -23.539 679 HD21 LEU 81 3HD2 LEU 81 -14.327 -15.363 -23.792 680 HD22 LEU 81 1HD2 LEU 81 -15.060 -16.140 -22.388 681 HD23 LEU 81 2HD2 LEU 81 -13.341 -15.771 -22.386 682 H GLU 82 H GLU 82 -9.895 -13.688 -23.291 683 HA GLU 82 HA GLU 82 -9.353 -10.852 -23.464 684 HB2 GLU 82 2HB GLU 82 -6.887 -11.578 -23.452 685 HB3 GLU 82 1HB GLU 82 -7.786 -11.672 -21.963 686 HG2 GLU 82 2HG GLU 82 -6.382 -13.597 -22.120 687 HG3 GLU 82 1HG GLU 82 -8.044 -14.119 -22.328 688 H LYS 83 H LYS 83 -7.053 -11.041 -25.152 689 HA LYS 83 HA LYS 83 -6.419 -11.017 -27.327 690 HB2 LYS 83 2HB LYS 83 -8.978 -12.518 -27.984 691 HB3 LYS 83 1HB LYS 83 -7.681 -12.194 -29.115 692 HG2 LYS 83 2HG LYS 83 -7.433 -13.905 -26.647 693 HG3 LYS 83 1HG LYS 83 -7.739 -14.513 -28.268 694 HD2 LYS 83 2HD LYS 83 -5.591 -13.601 -29.004 695 HD3 LYS 83 1HD LYS 83 -5.301 -12.981 -27.373 696 HE2 LYS 83 2HE LYS 83 -5.329 -15.219 -26.468 697 HE3 LYS 83 1HE LYS 83 -5.758 -15.889 -28.035 698 HZ1 LYS 83 3HZ LYS 83 -3.629 -15.193 -28.889 699 HZ2 LYS 83 1HZ LYS 83 -3.414 -16.147 -27.518 700 HZ3 LYS 83 2HZ LYS 83 -3.218 -14.478 -27.416 701 H ASP 84 H ASP 84 -9.731 -10.234 -26.593 702 HA ASP 84 HA ASP 84 -9.911 -8.315 -28.735 703 HB2 ASP 84 2HB ASP 84 -11.911 -9.551 -28.154 704 HB3 ASP 84 1HB ASP 84 -11.844 -8.946 -26.501 705 H ALA 85 H ALA 85 -9.031 -6.448 -28.602 706 HA ALA 85 HA ALA 85 -8.477 -5.212 -26.020 707 HB1 ALA 85 1HB ALA 85 -7.564 -4.488 -28.804 708 HB2 ALA 85 2HB ALA 85 -6.642 -5.419 -27.623 709 HB3 ALA 85 3HB ALA 85 -7.017 -3.725 -27.311 710 H THR 86 H THR 86 -8.816 -2.756 -25.963 711 HA THR 86 HA THR 86 -11.406 -2.209 -27.152 712 HB THR 86 HB THR 86 -11.272 -1.993 -24.661 713 HG1 THR 86 1HG THR 86 -12.764 -0.698 -25.451 714 HG21 THR 86 3HG2 THR 86 -8.925 -1.303 -24.436 715 HG22 THR 86 1HG2 THR 86 -9.997 -0.157 -23.627 716 HG23 THR 86 2HG2 THR 86 -9.303 0.241 -25.196 717 H GLU 87 H GLU 87 -11.621 -0.427 -28.537 718 HA GLU 87 HA GLU 87 -9.071 0.864 -29.114 719 HB2 GLU 87 2HB GLU 87 -9.576 -0.770 -30.875 720 HB3 GLU 87 1HB GLU 87 -11.104 0.042 -31.181 721 HG2 GLU 87 2HG GLU 87 -9.988 2.000 -31.963 722 HG3 GLU 87 1HG GLU 87 -8.423 1.369 -31.465 723 H VAL 88 H VAL 88 -9.062 2.854 -28.760 724 HA VAL 88 HA VAL 88 -11.305 4.468 -29.542 725 HB VAL 88 HB VAL 88 -11.769 4.095 -27.184 726 HG11 VAL 88 1HG1 VAL 88 -10.230 4.727 -25.388 727 HG12 VAL 88 2HG1 VAL 88 -8.980 5.060 -26.589 728 HG13 VAL 88 3HG1 VAL 88 -9.590 3.420 -26.385 729 HG21 VAL 88 3HG2 VAL 88 -12.248 6.325 -28.007 730 HG22 VAL 88 1HG2 VAL 88 -10.608 6.846 -27.614 731 HG23 VAL 88 2HG2 VAL 88 -11.724 6.401 -26.323 732 H GLY 89 H GLY 89 -10.400 5.635 -31.062 733 HA2 GLY 89 2HA GLY 89 -8.067 7.206 -30.319 734 HA3 GLY 89 1HA GLY 89 -8.008 6.244 -31.794 735 H VAL 90 H VAL 90 -9.180 6.834 -33.538 736 HA VAL 90 HA VAL 90 -10.098 8.189 -35.050 737 HB VAL 90 HB VAL 90 -11.563 9.485 -32.718 738 HG11 VAL 90 1HG1 VAL 90 -13.182 10.257 -34.403 739 HG12 VAL 90 2HG1 VAL 90 -12.156 9.596 -35.678 740 HG13 VAL 90 3HG1 VAL 90 -11.574 10.928 -34.683 741 HG21 VAL 90 3HG2 VAL 90 -12.442 7.281 -34.588 742 HG22 VAL 90 1HG2 VAL 90 -13.457 8.051 -33.368 743 HG23 VAL 90 2HG2 VAL 90 -12.058 7.104 -32.873 744 H LYS 91 H LYS 91 -8.529 9.325 -35.910 745 HA LYS 91 HA LYS 91 -7.640 11.698 -34.466 746 HB2 LYS 91 2HB LYS 91 -5.608 11.754 -35.845 747 HB3 LYS 91 1HB LYS 91 -5.769 10.218 -35.033 748 HG2 LYS 91 2HG LYS 91 -6.491 10.652 -37.930 749 HG3 LYS 91 1HG LYS 91 -4.896 10.152 -37.386 750 HD2 LYS 91 2HD LYS 91 -5.906 8.128 -36.393 751 HD3 LYS 91 1HD LYS 91 -7.484 8.630 -36.978 752 HE2 LYS 91 2HE LYS 91 -6.501 6.976 -38.466 753 HE3 LYS 91 1HE LYS 91 -6.665 8.525 -39.289 754 HZ1 LYS 91 3HZ LYS 91 -4.524 7.438 -39.718 755 HZ2 LYS 91 1HZ LYS 91 -4.157 7.470 -38.090 756 HZ3 LYS 91 2HZ LYS 91 -4.284 8.913 -38.949 757 H ALA 92 H ALA 92 -7.452 13.705 -35.503 758 HA ALA 92 HA ALA 92 -9.133 13.925 -37.898 759 HB1 ALA 92 1HB ALA 92 -8.805 15.923 -35.656 760 HB2 ALA 92 2HB ALA 92 -10.204 14.882 -35.901 761 HB3 ALA 92 3HB ALA 92 -9.816 16.134 -37.086 762 H ALA 93 H ALA 93 -7.848 14.286 -39.573 763 HA ALA 93 HA ALA 93 -5.714 16.278 -39.287 764 HB1 ALA 93 1HB ALA 93 -4.370 14.987 -40.889 765 HB2 ALA 93 2HB ALA 93 -5.619 13.742 -40.933 766 HB3 ALA 93 3HB ALA 93 -4.722 14.041 -39.444 767 H LEU 94 H LEU 94 -6.007 17.933 -40.593 768 HA LEU 94 HA LEU 94 -7.069 17.619 -43.224 769 HB2 LEU 94 2HB LEU 94 -8.901 19.228 -42.998 770 HB3 LEU 94 1HB LEU 94 -9.189 17.817 -42.013 771 HG LEU 94 HG LEU 94 -8.230 20.490 -40.919 772 HD11 LEU 94 1HD1 LEU 94 -11.000 19.298 -40.969 773 HD12 LEU 94 2HD1 LEU 94 -10.460 20.697 -41.901 774 HD13 LEU 94 3HD1 LEU 94 -10.531 20.780 -40.141 775 HD21 LEU 94 3HD2 LEU 94 -9.406 18.080 -39.521 776 HD22 LEU 94 1HD2 LEU 94 -8.918 19.590 -38.753 777 HD23 LEU 94 2HD2 LEU 94 -7.705 18.536 -39.487 778 H GLU 95 H GLU 95 -6.668 19.451 -44.519 779 HA GLU 95 HA GLU 95 -4.613 21.134 -43.357 780 HB2 GLU 95 2HB GLU 95 -3.975 19.944 -45.385 781 HB3 GLU 95 1HB GLU 95 -5.323 20.661 -46.254 782 HG2 GLU 95 2HG GLU 95 -4.361 22.837 -46.104 783 HG3 GLU 95 1HG GLU 95 -3.084 22.258 -45.043 784 H GLU 96 H GLU 96 -5.049 23.030 -42.721 785 HA GLU 96 HA GLU 96 -7.177 24.587 -43.989 786 HB2 GLU 96 2HB GLU 96 -7.853 23.607 -41.772 787 HB3 GLU 96 1HB GLU 96 -6.499 24.416 -41.028 788 HG2 GLU 96 2HG GLU 96 -8.802 25.850 -42.355 789 HG3 GLU 96 1HG GLU 96 -8.741 25.438 -40.650 790 H ALA 97 H ALA 97 -5.928 25.962 -45.149 791 HA ALA 97 HA ALA 97 -4.318 27.908 -43.875 792 HB1 ALA 97 1HB ALA 97 -2.686 26.080 -43.803 793 HB2 ALA 97 2HB ALA 97 -2.163 27.344 -44.919 794 HB3 ALA 97 3HB ALA 97 -2.855 25.847 -45.542 795 H LYS 98 H LYS 98 -4.128 29.636 -45.187 796 HA LYS 98 HA LYS 98 -5.038 29.299 -47.936 797 HB2 LYS 98 2HB LYS 98 -5.596 31.747 -47.845 798 HB3 LYS 98 1HB LYS 98 -6.565 30.732 -46.791 799 HG2 LYS 98 2HG LYS 98 -5.249 31.427 -44.867 800 HG3 LYS 98 1HG LYS 98 -4.199 32.379 -45.910 801 HD2 LYS 98 2HD LYS 98 -7.159 32.845 -45.548 802 HD3 LYS 98 1HD LYS 98 -5.879 33.722 -44.706 803 HE2 LYS 98 2HE LYS 98 -5.015 34.490 -46.889 804 HE3 LYS 98 1HE LYS 98 -6.345 33.658 -47.689 805 HZ1 LYS 98 3HZ LYS 98 -6.597 35.899 -45.761 806 HZ2 LYS 98 1HZ LYS 98 -7.898 35.104 -46.486 807 HZ3 LYS 98 2HZ LYS 98 -6.822 35.985 -47.426 808 H LYS 99 H LYS 99 -3.310 29.024 -49.131 809 HA LYS 99 HA LYS 99 -0.972 30.702 -48.687 810 HB2 LYS 99 2HB LYS 99 -1.391 28.336 -50.525 811 HB3 LYS 99 1HB LYS 99 0.106 29.240 -50.371 812 HG2 LYS 99 2HG LYS 99 0.305 28.544 -48.037 813 HG3 LYS 99 1HG LYS 99 -1.220 27.670 -48.162 814 HD2 LYS 99 2HD LYS 99 0.703 26.149 -48.360 815 HD3 LYS 99 1HD LYS 99 -0.241 26.175 -49.842 816 HE2 LYS 99 2HE LYS 99 2.136 26.203 -50.346 817 HE3 LYS 99 1HE LYS 99 1.403 27.718 -50.844 818 HZ1 LYS 99 3HZ LYS 99 3.483 28.117 -49.749 819 HZ2 LYS 99 1HZ LYS 99 2.987 27.260 -48.375 820 HZ3 LYS 99 2HZ LYS 99 2.239 28.715 -48.783 821 H VAL 100 H VAL 100 -0.973 32.572 -49.708 822 HA VAL 100 HA VAL 100 -2.348 32.706 -52.271 823 HB VAL 100 HB VAL 100 -2.387 35.173 -52.018 824 HG11 VAL 100 1HG1 VAL 100 -3.545 33.665 -49.684 825 HG12 VAL 100 2HG1 VAL 100 -4.288 33.877 -51.269 826 HG13 VAL 100 3HG1 VAL 100 -4.041 35.272 -50.215 827 HG21 VAL 100 3HG2 VAL 100 -1.829 36.211 -49.864 828 HG22 VAL 100 1HG2 VAL 100 -0.407 35.473 -50.603 829 HG23 VAL 100 2HG2 VAL 100 -1.231 34.665 -49.265 830 H GLN 101 H GLN 101 -1.304 32.964 -54.074 831 HA GLN 101 HA GLN 101 1.567 33.440 -53.921 832 HB2 GLN 101 2HB GLN 101 -0.052 32.105 -56.114 833 HB3 GLN 101 1HB GLN 101 1.666 32.419 -56.205 834 HG2 GLN 101 2HG GLN 101 1.366 30.120 -55.676 835 HG3 GLN 101 1HG GLN 101 1.973 30.914 -54.231 836 HE21 GLN 101 1HE2 GLN 101 1.191 29.356 -52.867 837 HE22 GLN 101 2HE2 GLN 101 -0.501 29.129 -52.573 838 H ILE 102 H ILE 102 2.504 34.896 -55.345 839 HA ILE 102 HA ILE 102 0.732 37.024 -56.125 840 HB ILE 102 HB ILE 102 2.854 37.659 -55.097 841 HG12 ILE 102 2HG1 ILE 102 2.802 38.399 -58.037 842 HG13 ILE 102 1HG1 ILE 102 1.902 39.198 -56.757 843 HG21 ILE 102 1HG2 ILE 102 4.230 35.765 -55.724 844 HG22 ILE 102 2HG2 ILE 102 5.022 37.270 -56.197 845 HG23 ILE 102 3HG2 ILE 102 4.215 36.281 -57.410 846 HD11 ILE 102 3HD1 ILE 102 3.988 39.920 -55.739 847 HD12 ILE 102 1HD1 ILE 102 3.855 40.478 -57.409 848 HD13 ILE 102 2HD1 ILE 102 4.892 39.101 -57.015 849 H GLU 103 H GLU 103 0.140 37.579 -58.154 850 HA GLU 103 HA GLU 103 0.703 35.652 -60.233 851 HB2 GLU 103 2HB GLU 103 -1.635 36.457 -59.775 852 HB3 GLU 103 1HB GLU 103 -1.129 38.072 -60.230 853 HG2 GLU 103 2HG GLU 103 -0.714 37.342 -62.497 854 HG3 GLU 103 1HG GLU 103 -1.101 35.680 -62.055 855 H LEU 104 H LEU 104 1.940 36.153 -62.021 856 HA LEU 104 HA LEU 104 3.763 38.293 -61.538 857 HB2 LEU 104 2HB LEU 104 3.792 36.156 -63.645 858 HB3 LEU 104 1HB LEU 104 4.950 37.464 -63.634 859 HG LEU 104 HG LEU 104 5.676 36.707 -61.355 860 HD11 LEU 104 1HD1 LEU 104 3.997 34.292 -61.953 861 HD12 LEU 104 2HD1 LEU 104 3.690 35.487 -60.693 862 HD13 LEU 104 3HD1 LEU 104 5.131 34.473 -60.614 863 HD21 LEU 104 3HD2 LEU 104 6.974 34.814 -62.173 864 HD22 LEU 104 1HD2 LEU 104 6.941 36.142 -63.333 865 HD23 LEU 104 2HD2 LEU 104 5.933 34.715 -63.594 866 H ASP 105 H ASP 105 0.904 38.599 -62.841 867 HA ASP 105 HA ASP 105 1.425 39.939 -65.288 868 HB2 ASP 105 2HB ASP 105 -0.858 40.672 -65.214 869 HB3 ASP 105 1HB ASP 105 -0.838 39.056 -64.529 870 H THR 106 H THR 106 1.146 40.948 -61.952 871 HA THR 106 HA THR 106 1.647 43.725 -62.583 872 HB THR 106 HB THR 106 0.055 43.222 -60.819 873 HG1 THR 106 1HG THR 106 2.437 44.557 -60.115 874 HG21 THR 106 3HG2 THR 106 0.760 42.224 -58.665 875 HG22 THR 106 1HG2 THR 106 2.367 41.949 -59.335 876 HG23 THR 106 2HG2 THR 106 0.978 41.099 -60.005 877 H SER 107 H SER 107 3.518 41.079 -62.346 878 HA SER 107 HA SER 107 5.791 42.428 -61.081 879 HB2 SER 107 2HB SER 107 5.196 40.102 -60.366 880 HB3 SER 107 1HB SER 107 5.488 39.560 -62.013 881 HG SER 107 HG SER 107 7.679 40.836 -61.318 882 H LEU 108 H LEU 108 4.415 41.488 -64.059 883 HA LEU 108 HA LEU 108 4.920 41.672 -66.187 884 HB2 LEU 108 2HB LEU 108 6.994 43.621 -65.217 885 HB3 LEU 108 1HB LEU 108 6.642 43.349 -66.914 886 HG LEU 108 HG LEU 108 4.727 44.426 -64.853 887 HD11 LEU 108 1HD1 LEU 108 6.479 46.021 -65.412 888 HD12 LEU 108 2HD1 LEU 108 4.934 46.522 -66.096 889 HD13 LEU 108 3HD1 LEU 108 6.157 45.786 -67.131 890 HD21 LEU 108 3HD2 LEU 108 4.407 44.024 -67.830 891 HD22 LEU 108 1HD2 LEU 108 3.279 44.890 -66.790 892 HD23 LEU 108 2HD2 LEU 108 3.541 43.174 -66.552 893 H SER 109 H SER 109 5.429 39.555 -66.372 894 HA SER 109 HA SER 109 8.220 38.847 -66.333 895 HB2 SER 109 2HB SER 109 6.487 37.225 -65.505 896 HB3 SER 109 1HB SER 109 5.767 37.211 -67.107 897 HG SER 109 HG SER 109 8.477 36.587 -67.043 898 H TYR 110 H TYR 110 8.852 40.368 -67.908 899 HA TYR 110 HA TYR 110 7.685 40.185 -70.544 900 HB2 TYR 110 2HB TYR 110 8.280 42.400 -69.505 901 HB3 TYR 110 1HB TYR 110 9.968 41.929 -69.586 902 HD1 TYR 110 1HD TYR 110 10.930 41.423 -71.961 903 HD2 TYR 110 2HD TYR 110 7.274 43.497 -71.303 904 HE1 TYR 110 1HE TYR 110 11.070 42.371 -74.220 905 HE2 TYR 110 2HE TYR 110 7.401 44.447 -73.564 906 HH TYR 110 HH TYR 110 9.196 44.961 -75.250 907 H ILE 111 H ILE 111 8.333 38.562 -71.702 908 HA ILE 111 HA ILE 111 11.174 38.116 -71.845 909 HB ILE 111 HB ILE 111 10.065 36.244 -70.671 910 HG12 ILE 111 2HG1 ILE 111 12.071 35.685 -72.033 911 HG13 ILE 111 1HG1 ILE 111 10.986 34.326 -71.849 912 HG21 ILE 111 1HG2 ILE 111 7.869 36.300 -71.495 913 HG22 ILE 111 2HG2 ILE 111 8.530 34.685 -71.757 914 HG23 ILE 111 3HG2 ILE 111 8.400 35.815 -73.106 915 HD11 ILE 111 3HD1 ILE 111 10.191 34.687 -74.146 916 HD12 ILE 111 1HD1 ILE 111 11.932 34.418 -74.068 917 HD13 ILE 111 2HD1 ILE 111 11.307 36.050 -74.292 Start of MODEL 8 1 H1 GLY -1 1HT GLY -1 0.446 -7.320 -29.921 2 H2 GLY -1 2HT GLY -1 1.190 -6.875 -28.445 3 H3 GLY -1 3HT GLY -1 0.863 -5.706 -29.616 4 HA2 GLY -1 1HA GLY -1 -1.469 -6.003 -29.354 5 HA3 GLY -1 2HA GLY -1 -1.167 -7.280 -28.183 6 H SER 0 H SER 0 -2.662 -4.973 -27.675 7 HA SER 0 HA SER 0 -1.405 -4.090 -25.302 8 HB2 SER 0 2HB SER 0 -1.910 -2.026 -27.483 9 HB3 SER 0 1HB SER 0 -1.592 -1.628 -25.798 10 HG SER 0 HG SER 0 0.235 -3.346 -26.865 11 H MET 1 H MET 1 -3.094 -4.834 -24.203 12 HA MET 1 HA MET 1 -5.770 -3.880 -24.882 13 HB2 MET 1 2HB MET 1 -4.831 -6.034 -22.994 14 HB3 MET 1 1HB MET 1 -6.514 -5.586 -23.236 15 HG2 MET 1 2HG MET 1 -6.399 -6.317 -25.545 16 HG3 MET 1 1HG MET 1 -4.681 -6.660 -25.370 17 HE1 MET 1 3HE MET 1 -8.314 -7.666 -24.202 18 HE2 MET 1 1HE MET 1 -7.481 -7.398 -22.673 19 HE3 MET 1 2HE MET 1 -7.975 -9.024 -23.129 20 H THR 2 H THR 2 -6.729 -2.372 -23.624 21 HA THR 2 HA THR 2 -5.253 -1.371 -21.352 22 HB THR 2 HB THR 2 -7.816 -0.324 -22.582 23 HG1 THR 2 1HG THR 2 -5.251 -0.278 -23.435 24 HG21 THR 2 3HG2 THR 2 -7.378 0.408 -20.257 25 HG22 THR 2 1HG2 THR 2 -7.217 1.747 -21.402 26 HG23 THR 2 2HG2 THR 2 -5.776 0.959 -20.754 27 H VAL 3 H VAL 3 -5.675 -2.111 -19.403 28 HA VAL 3 HA VAL 3 -8.376 -3.158 -18.814 29 HB VAL 3 HB VAL 3 -5.870 -3.801 -17.252 30 HG11 VAL 3 1HG1 VAL 3 -7.893 -4.252 -16.077 31 HG12 VAL 3 2HG1 VAL 3 -7.074 -5.744 -16.572 32 HG13 VAL 3 3HG1 VAL 3 -8.482 -5.199 -17.472 33 HG21 VAL 3 3HG2 VAL 3 -6.993 -5.475 -19.487 34 HG22 VAL 3 1HG2 VAL 3 -5.718 -5.918 -18.352 35 HG23 VAL 3 2HG2 VAL 3 -5.447 -4.598 -19.505 36 H TYR 4 H TYR 4 -9.435 -2.277 -16.970 37 HA TYR 4 HA TYR 4 -8.055 -0.025 -15.737 38 HB2 TYR 4 2HB TYR 4 -10.994 -0.728 -15.820 39 HB3 TYR 4 1HB TYR 4 -10.298 0.695 -15.058 40 HD1 TYR 4 2HD TYR 4 -10.808 -0.984 -18.312 41 HD2 TYR 4 1HD TYR 4 -9.804 2.632 -16.330 42 HE1 TYR 4 2HE TYR 4 -10.995 0.215 -20.431 43 HE2 TYR 4 1HE TYR 4 -9.988 3.849 -18.457 44 HH TYR 4 HH TYR 4 -9.891 3.393 -20.854 45 H ILE 5 H ILE 5 -7.610 -0.006 -13.659 46 HA ILE 5 HA ILE 5 -8.444 -2.309 -11.989 47 HB ILE 5 HB ILE 5 -6.010 -0.557 -11.618 48 HG12 ILE 5 2HG1 ILE 5 -4.600 -2.363 -12.035 49 HG13 ILE 5 1HG1 ILE 5 -5.828 -3.515 -12.395 50 HG21 ILE 5 1HG2 ILE 5 -6.882 -1.378 -9.539 51 HG22 ILE 5 2HG2 ILE 5 -5.329 -2.153 -9.876 52 HG23 ILE 5 3HG2 ILE 5 -6.833 -3.032 -10.137 53 HD11 ILE 5 3HD1 ILE 5 -4.929 -1.131 -14.056 54 HD12 ILE 5 1HD1 ILE 5 -6.364 -2.069 -14.442 55 HD13 ILE 5 2HD1 ILE 5 -4.782 -2.842 -14.457 56 H CYS 6 H CYS 6 -9.920 -1.597 -10.533 57 HA CYS 6 HA CYS 6 -9.228 0.852 -9.155 58 HB2 CYS 6 2HB CYS 6 -11.302 1.328 -10.416 59 HB3 CYS 6 1HB CYS 6 -12.074 -0.082 -9.687 60 HG CYS 6 HG CYS 6 -13.270 1.707 -8.186 61 HA PRO 7 HA PRO 7 -8.771 -2.591 -6.279 62 HB2 PRO 7 2HB PRO 7 -7.550 -1.076 -4.331 63 HB3 PRO 7 1HB PRO 7 -6.700 -1.832 -5.678 64 HG2 PRO 7 2HG PRO 7 -7.630 0.993 -5.375 65 HG3 PRO 7 1HG PRO 7 -6.113 0.383 -6.056 66 HD2 PRO 7 2HD PRO 7 -8.126 1.235 -7.589 67 HD3 PRO 7 1HD PRO 7 -7.089 -0.115 -8.101 68 H GLU 8 H GLU 8 -10.576 0.232 -6.021 69 HA GLU 8 HA GLU 8 -11.553 -0.293 -3.317 70 HB2 GLU 8 2HB GLU 8 -12.473 1.870 -5.194 71 HB3 GLU 8 1HB GLU 8 -12.617 1.817 -3.445 72 HG2 GLU 8 2HG GLU 8 -10.110 2.066 -5.027 73 HG3 GLU 8 1HG GLU 8 -10.932 3.391 -4.197 74 H THR 9 H THR 9 -13.206 0.643 -6.335 75 HA THR 9 HA THR 9 -15.558 -0.784 -5.463 76 HB THR 9 HB THR 9 -16.635 0.505 -7.340 77 HG1 THR 9 1HG THR 9 -15.430 1.738 -8.554 78 HG21 THR 9 3HG2 THR 9 -15.147 2.082 -5.230 79 HG22 THR 9 1HG2 THR 9 -16.698 1.271 -4.998 80 HG23 THR 9 2HG2 THR 9 -16.572 2.637 -6.110 81 H GLY 10 H GLY 10 -12.968 -1.529 -7.385 82 HA2 GLY 10 2HA GLY 10 -14.694 -3.110 -9.107 83 HA3 GLY 10 1HA GLY 10 -13.037 -2.882 -9.538 84 H ASP 11 H ASP 11 -13.064 -5.231 -9.721 85 HA ASP 11 HA ASP 11 -12.526 -6.610 -7.246 86 HB2 ASP 11 2HB ASP 11 -14.983 -6.822 -7.408 87 HB3 ASP 11 1HB ASP 11 -14.816 -7.494 -9.027 88 H ASP 12 H ASP 12 -11.454 -8.506 -7.564 89 HA ASP 12 HA ASP 12 -9.619 -8.567 -9.688 90 HB2 ASP 12 2HB ASP 12 -9.269 -9.446 -7.369 91 HB3 ASP 12 1HB ASP 12 -10.276 -10.816 -7.794 92 H GLY 13 H GLY 13 -12.703 -10.249 -9.302 93 HA2 GLY 13 2HA GLY 13 -12.003 -12.096 -11.445 94 HA3 GLY 13 1HA GLY 13 -13.424 -12.170 -10.427 95 H ASN 14 H ASN 14 -12.720 -9.104 -11.776 96 HA ASN 14 HA ASN 14 -15.074 -9.319 -13.469 97 HB2 ASN 14 2HB ASN 14 -13.351 -6.960 -12.746 98 HB3 ASN 14 1HB ASN 14 -14.694 -6.871 -13.873 99 HD21 ASN 14 1HD2 ASN 14 -14.333 -5.483 -11.390 100 HD22 ASN 14 2HD2 ASN 14 -15.655 -5.955 -10.371 101 H ASP 15 H ASP 15 -14.829 -7.836 -15.546 102 HA ASP 15 HA ASP 15 -12.991 -9.241 -17.283 103 HB2 ASP 15 2HB ASP 15 -15.026 -7.081 -17.884 104 HB3 ASP 15 1HB ASP 15 -14.071 -7.912 -19.102 105 H GLY 16 H GLY 16 -12.796 -6.533 -15.404 106 HA2 GLY 16 2HA GLY 16 -11.219 -4.919 -15.194 107 HA3 GLY 16 1HA GLY 16 -10.338 -5.742 -16.484 108 H SER 17 H SER 17 -13.532 -4.629 -16.968 109 HA SER 17 HA SER 17 -12.630 -2.732 -18.959 110 HB2 SER 17 2HB SER 17 -15.426 -3.474 -18.056 111 HB3 SER 17 1HB SER 17 -15.001 -2.590 -19.526 112 HG SER 17 HG SER 17 -13.575 -4.661 -19.744 113 H GLU 18 H GLU 18 -14.088 -0.464 -18.804 114 HA GLU 18 HA GLU 18 -13.105 0.644 -16.444 115 HB2 GLU 18 2HB GLU 18 -13.364 1.865 -18.631 116 HB3 GLU 18 1HB GLU 18 -15.101 1.867 -18.349 117 HG2 GLU 18 2HG GLU 18 -14.789 3.173 -16.328 118 HG3 GLU 18 1HG GLU 18 -13.046 3.116 -16.627 119 H LEU 19 H LEU 19 -16.217 -0.620 -17.460 120 HA LEU 19 HA LEU 19 -17.712 0.402 -15.264 121 HB2 LEU 19 2HB LEU 19 -18.349 -1.762 -17.255 122 HB3 LEU 19 1HB LEU 19 -19.461 -1.182 -16.038 123 HG LEU 19 HG LEU 19 -20.066 -0.257 -18.055 124 HD11 LEU 19 1HD1 LEU 19 -20.282 1.271 -16.229 125 HD12 LEU 19 2HD1 LEU 19 -19.895 2.167 -17.698 126 HD13 LEU 19 3HD1 LEU 19 -18.647 1.869 -16.491 127 HD21 LEU 19 3HD2 LEU 19 -18.057 -0.536 -19.370 128 HD22 LEU 19 1HD2 LEU 19 -17.256 0.742 -18.455 129 HD23 LEU 19 2HD2 LEU 19 -18.622 1.129 -19.500 130 H LYS 20 H LYS 20 -15.744 -2.383 -15.838 131 HA LYS 20 HA LYS 20 -16.310 -3.441 -13.103 132 HB2 LYS 20 2HB LYS 20 -15.584 -5.237 -15.401 133 HB3 LYS 20 1HB LYS 20 -16.155 -5.630 -13.807 134 HG2 LYS 20 2HG LYS 20 -18.403 -4.885 -14.321 135 HG3 LYS 20 1HG LYS 20 -17.896 -4.444 -15.956 136 HD2 LYS 20 2HD LYS 20 -17.203 -6.797 -16.333 137 HD3 LYS 20 1HD LYS 20 -17.827 -7.204 -14.738 138 HE2 LYS 20 2HE LYS 20 -20.073 -6.475 -15.468 139 HE3 LYS 20 1HE LYS 20 -19.421 -6.139 -17.071 140 HZ1 LYS 20 3HZ LYS 20 -20.439 -8.282 -17.076 141 HZ2 LYS 20 1HZ LYS 20 -19.546 -8.767 -15.722 142 HZ3 LYS 20 2HZ LYS 20 -18.755 -8.499 -17.178 143 HA PRO 21 HA PRO 21 -11.940 -2.643 -13.934 144 HB2 PRO 21 2HB PRO 21 -11.445 -1.373 -11.569 145 HB3 PRO 21 1HB PRO 21 -11.943 -0.543 -13.045 146 HG2 PRO 21 2HG PRO 21 -13.553 -1.249 -10.639 147 HG3 PRO 21 1HG PRO 21 -13.681 0.151 -11.710 148 HD2 PRO 21 2HD PRO 21 -15.343 -2.040 -11.785 149 HD3 PRO 21 1HD PRO 21 -15.066 -0.929 -13.137 150 H LEU 22 H LEU 22 -10.189 -3.618 -12.942 151 HA LEU 22 HA LEU 22 -10.863 -5.904 -11.296 152 HB2 LEU 22 2HB LEU 22 -8.231 -4.979 -12.423 153 HB3 LEU 22 1HB LEU 22 -8.503 -6.500 -11.593 154 HG LEU 22 HG LEU 22 -9.760 -5.691 -14.199 155 HD11 LEU 22 1HD1 LEU 22 -8.328 -7.385 -15.154 156 HD12 LEU 22 2HD1 LEU 22 -7.564 -7.623 -13.580 157 HD13 LEU 22 3HD1 LEU 22 -7.407 -6.079 -14.411 158 HD21 LEU 22 3HD2 LEU 22 -9.859 -8.279 -12.666 159 HD22 LEU 22 1HD2 LEU 22 -10.499 -8.025 -14.288 160 HD23 LEU 22 2HD2 LEU 22 -11.197 -7.167 -12.918 161 H ARG 23 H ARG 23 -9.504 -6.340 -9.389 162 HA ARG 23 HA ARG 23 -9.160 -3.800 -8.013 163 HB2 ARG 23 2HB ARG 23 -9.693 -4.922 -5.937 164 HB3 ARG 23 1HB ARG 23 -10.853 -5.329 -7.145 165 HG2 ARG 23 2HG ARG 23 -10.563 -7.283 -6.182 166 HG3 ARG 23 1HG ARG 23 -9.405 -7.412 -7.497 167 HD2 ARG 23 2HD ARG 23 -7.607 -6.733 -5.914 168 HD3 ARG 23 1HD ARG 23 -8.790 -6.735 -4.623 169 HE ARG 23 HE ARG 23 -7.957 -9.126 -6.122 170 HH11 ARG 23 1HH1 ARG 23 -9.407 -7.677 -3.246 171 HH12 ARG 23 2HH1 ARG 23 -9.350 -9.092 -2.309 172 HH21 ARG 23 1HH2 ARG 23 -7.934 -11.113 -4.851 173 HH22 ARG 23 2HH2 ARG 23 -8.518 -11.100 -3.266 174 H THR 24 H THR 24 -7.376 -5.987 -9.579 175 HA THR 24 HA THR 24 -4.989 -5.356 -8.032 176 HB THR 24 HB THR 24 -4.069 -7.556 -8.788 177 HG1 THR 24 1HG THR 24 -6.327 -8.942 -9.127 178 HG21 THR 24 3HG2 THR 24 -5.133 -8.929 -7.097 179 HG22 THR 24 1HG2 THR 24 -6.511 -7.835 -7.034 180 HG23 THR 24 2HG2 THR 24 -4.921 -7.289 -6.484 181 H LEU 25 H LEU 25 -3.230 -4.885 -9.304 182 HA LEU 25 HA LEU 25 -3.607 -4.414 -12.110 183 HB2 LEU 25 2HB LEU 25 -2.192 -2.957 -10.778 184 HB3 LEU 25 1HB LEU 25 -1.195 -4.309 -10.300 185 HG LEU 25 HG LEU 25 -0.299 -4.503 -12.548 186 HD11 LEU 25 1HD1 LEU 25 -2.272 -3.837 -13.827 187 HD12 LEU 25 2HD1 LEU 25 -0.868 -2.891 -14.288 188 HD13 LEU 25 3HD1 LEU 25 -2.108 -2.178 -13.266 189 HD21 LEU 25 3HD2 LEU 25 0.875 -2.340 -12.628 190 HD22 LEU 25 1HD2 LEU 25 0.772 -2.999 -10.998 191 HD23 LEU 25 2HD2 LEU 25 -0.307 -1.697 -11.491 192 H TYR 26 H TYR 26 -2.438 -6.825 -10.031 193 HA TYR 26 HA TYR 26 -0.954 -8.424 -11.718 194 HB2 TYR 26 2HB TYR 26 -0.886 -8.728 -9.349 195 HB3 TYR 26 1HB TYR 26 -2.610 -9.032 -9.274 196 HD1 TYR 26 1HD TYR 26 0.110 -10.489 -11.386 197 HD2 TYR 26 2HD TYR 26 -2.921 -11.113 -8.508 198 HE1 TYR 26 1HE TYR 26 0.538 -12.917 -11.469 199 HE2 TYR 26 2HE TYR 26 -2.523 -13.529 -8.574 200 HH TYR 26 HH TYR 26 0.206 -14.876 -10.034 201 H GLN 27 H GLN 27 -4.537 -8.515 -11.146 202 HA GLN 27 HA GLN 27 -4.918 -10.699 -12.900 203 HB2 GLN 27 2HB GLN 27 -6.607 -10.166 -11.244 204 HB3 GLN 27 1HB GLN 27 -6.888 -8.594 -11.955 205 HG2 GLN 27 2HG GLN 27 -8.699 -10.161 -12.489 206 HG3 GLN 27 1HG GLN 27 -7.875 -9.654 -13.939 207 HE21 GLN 27 1HE2 GLN 27 -8.640 -11.471 -15.028 208 HE22 GLN 27 2HE2 GLN 27 -7.959 -13.029 -14.803 209 H ALA 28 H ALA 28 -4.773 -7.216 -13.459 210 HA ALA 28 HA ALA 28 -5.703 -7.139 -16.058 211 HB1 ALA 28 1HB ALA 28 -5.236 -5.155 -14.660 212 HB2 ALA 28 2HB ALA 28 -4.416 -5.030 -16.211 213 HB3 ALA 28 3HB ALA 28 -3.517 -5.491 -14.765 214 H MET 29 H MET 29 -2.513 -7.889 -14.746 215 HA MET 29 HA MET 29 -1.256 -8.309 -17.224 216 HB2 MET 29 2HB MET 29 -0.631 -9.164 -14.434 217 HB3 MET 29 1HB MET 29 0.366 -9.572 -15.813 218 HG2 MET 29 2HG MET 29 0.837 -7.171 -16.195 219 HG3 MET 29 1HG MET 29 -0.242 -6.762 -14.870 220 HE1 MET 29 3HE MET 29 3.346 -5.993 -13.844 221 HE2 MET 29 1HE MET 29 1.753 -5.337 -14.229 222 HE3 MET 29 2HE MET 29 2.752 -6.044 -15.502 223 H ILE 30 H ILE 30 -3.084 -10.374 -15.054 224 HA ILE 30 HA ILE 30 -2.326 -12.825 -16.291 225 HB ILE 30 HB ILE 30 -4.769 -12.200 -14.603 226 HG12 ILE 30 2HG1 ILE 30 -2.140 -13.510 -13.895 227 HG13 ILE 30 1HG1 ILE 30 -2.647 -11.890 -13.426 228 HG21 ILE 30 1HG2 ILE 30 -4.980 -14.624 -14.283 229 HG22 ILE 30 2HG2 ILE 30 -3.655 -14.885 -15.420 230 HG23 ILE 30 3HG2 ILE 30 -5.170 -14.177 -15.978 231 HD11 ILE 30 3HD1 ILE 30 -4.466 -12.855 -12.114 232 HD12 ILE 30 1HD1 ILE 30 -2.888 -13.459 -11.601 233 HD13 ILE 30 2HD1 ILE 30 -3.940 -14.471 -12.594 234 H ILE 31 H ILE 31 -4.943 -10.609 -16.841 235 HA ILE 31 HA ILE 31 -6.297 -12.249 -18.700 236 HB ILE 31 HB ILE 31 -6.416 -9.239 -18.403 237 HG12 ILE 31 2HG1 ILE 31 -8.140 -11.434 -17.253 238 HG13 ILE 31 1HG1 ILE 31 -7.019 -10.420 -16.351 239 HG21 ILE 31 1HG2 ILE 31 -7.233 -10.073 -20.552 240 HG22 ILE 31 2HG2 ILE 31 -8.562 -9.456 -19.537 241 HG23 ILE 31 3HG2 ILE 31 -8.282 -11.201 -19.663 242 HD11 ILE 31 3HD1 ILE 31 -8.367 -8.460 -16.941 243 HD12 ILE 31 1HD1 ILE 31 -9.294 -9.677 -16.038 244 HD13 ILE 31 2HD1 ILE 31 -9.481 -9.535 -17.792 245 H THR 32 H THR 32 -3.920 -9.644 -19.021 246 HA THR 32 HA THR 32 -4.084 -9.729 -21.899 247 HB THR 32 HB THR 32 -2.408 -7.901 -21.800 248 HG1 THR 32 1HG THR 32 -2.681 -7.742 -19.033 249 HG21 THR 32 3HG2 THR 32 -4.693 -7.484 -19.825 250 HG22 THR 32 1HG2 THR 32 -4.864 -7.447 -21.564 251 HG23 THR 32 2HG2 THR 32 -3.854 -6.247 -20.760 252 H LYS 33 H LYS 33 -1.872 -10.751 -19.362 253 HA LYS 33 HA LYS 33 0.001 -11.899 -19.238 254 HB2 LYS 33 2HB LYS 33 -0.992 -13.131 -21.804 255 HB3 LYS 33 1HB LYS 33 0.385 -13.728 -20.882 256 HG2 LYS 33 2HG LYS 33 -1.112 -14.044 -18.936 257 HG3 LYS 33 1HG LYS 33 -2.472 -13.568 -19.947 258 HD2 LYS 33 2HD LYS 33 -2.319 -15.987 -19.783 259 HD3 LYS 33 1HD LYS 33 -2.008 -15.451 -21.438 260 HE2 LYS 33 2HE LYS 33 0.387 -15.696 -21.094 261 HE3 LYS 33 1HE LYS 33 0.124 -16.126 -19.406 262 HZ1 LYS 33 3HZ LYS 33 0.548 -18.033 -20.794 263 HZ2 LYS 33 1HZ LYS 33 -0.792 -17.674 -21.760 264 HZ3 LYS 33 2HZ LYS 33 -1.003 -18.112 -20.133 265 H SER 34 H SER 34 -0.084 -9.391 -20.755 266 HA SER 34 HA SER 34 2.162 -9.674 -22.597 267 HB2 SER 34 2HB SER 34 0.476 -7.267 -21.918 268 HB3 SER 34 1HB SER 34 1.587 -7.413 -23.277 269 HG SER 34 HG SER 34 -0.301 -9.412 -23.084 270 H SER 35 H SER 35 1.749 -9.218 -19.345 271 HA SER 35 HA SER 35 2.920 -8.415 -17.593 272 HB2 SER 35 2HB SER 35 5.174 -7.884 -19.581 273 HB3 SER 35 1HB SER 35 5.334 -7.922 -17.829 274 HG SER 35 HG SER 35 4.887 -10.023 -19.636 275 H LYS 36 H LYS 36 3.887 -6.318 -20.299 276 HA LYS 36 HA LYS 36 2.986 -4.023 -18.819 277 HB2 LYS 36 2HB LYS 36 5.394 -4.114 -19.156 278 HB3 LYS 36 1HB LYS 36 5.191 -4.401 -20.866 279 HG2 LYS 36 2HG LYS 36 4.314 -1.884 -19.472 280 HG3 LYS 36 1HG LYS 36 5.927 -2.093 -20.159 281 HD2 LYS 36 2HD LYS 36 3.304 -2.199 -21.683 282 HD3 LYS 36 1HD LYS 36 4.419 -0.832 -21.677 283 HE2 LYS 36 2HE LYS 36 6.157 -2.290 -22.697 284 HE3 LYS 36 1HE LYS 36 5.006 -3.617 -22.719 285 HZ1 LYS 36 3HZ LYS 36 4.687 -1.056 -24.177 286 HZ2 LYS 36 1HZ LYS 36 3.630 -2.381 -24.240 287 HZ3 LYS 36 2HZ LYS 36 5.175 -2.514 -24.853 288 H GLY 37 H GLY 37 1.213 -3.446 -19.578 289 HA2 GLY 37 2HA GLY 37 0.737 -3.200 -22.460 290 HA3 GLY 37 1HA GLY 37 -0.500 -3.966 -21.451 291 H ASP 38 H ASP 38 -1.957 -2.100 -21.990 292 HA ASP 38 HA ASP 38 -1.001 0.183 -20.458 293 HB2 ASP 38 2HB ASP 38 -1.802 0.631 -22.853 294 HB3 ASP 38 1HB ASP 38 -3.421 0.272 -22.241 295 H PHE 39 H PHE 39 -1.599 0.263 -18.528 296 HA PHE 39 HA PHE 39 -4.182 -0.928 -17.858 297 HB2 PHE 39 2HB PHE 39 -1.685 -0.949 -16.158 298 HB3 PHE 39 1HB PHE 39 -3.229 -1.690 -15.765 299 HD1 PHE 39 1HD PHE 39 -4.047 -3.395 -17.695 300 HD2 PHE 39 2HD PHE 39 -0.034 -2.346 -16.857 301 HE1 PHE 39 1HE PHE 39 -3.293 -5.502 -18.709 302 HE2 PHE 39 2HE PHE 39 0.736 -4.447 -17.869 303 HZ PHE 39 HZ PHE 39 -0.896 -6.030 -18.801 304 H LEU 40 H LEU 40 -5.469 0.435 -16.912 305 HA LEU 40 HA LEU 40 -4.253 2.900 -15.866 306 HB2 LEU 40 2HB LEU 40 -7.124 2.621 -16.835 307 HB3 LEU 40 1HB LEU 40 -6.285 4.035 -16.264 308 HG LEU 40 HG LEU 40 -5.615 2.604 -18.823 309 HD11 LEU 40 1HD1 LEU 40 -7.063 5.200 -18.322 310 HD12 LEU 40 2HD1 LEU 40 -7.767 3.708 -18.948 311 HD13 LEU 40 3HD1 LEU 40 -6.564 4.584 -19.900 312 HD21 LEU 40 3HD2 LEU 40 -3.679 3.690 -17.824 313 HD22 LEU 40 1HD2 LEU 40 -4.588 5.198 -17.664 314 HD23 LEU 40 2HD2 LEU 40 -4.210 4.553 -19.264 315 H ILE 41 H ILE 41 -4.386 3.169 -13.803 316 HA ILE 41 HA ILE 41 -6.278 1.473 -12.374 317 HB ILE 41 HB ILE 41 -3.651 2.583 -11.359 318 HG12 ILE 41 2HG1 ILE 41 -4.402 -0.150 -12.434 319 HG13 ILE 41 1HG1 ILE 41 -3.144 0.927 -12.971 320 HG21 ILE 41 1HG2 ILE 41 -5.598 0.652 -10.084 321 HG22 ILE 41 2HG2 ILE 41 -5.298 2.317 -9.598 322 HG23 ILE 41 3HG2 ILE 41 -4.024 1.103 -9.423 323 HD11 ILE 41 3HD1 ILE 41 -1.869 0.491 -10.945 324 HD12 ILE 41 1HD1 ILE 41 -2.342 -1.016 -11.790 325 HD13 ILE 41 2HD1 ILE 41 -3.212 -0.519 -10.370 326 H ARG 42 H ARG 42 -7.562 2.331 -10.949 327 HA ARG 42 HA ARG 42 -8.119 5.098 -11.051 328 HB2 ARG 42 2HB ARG 42 -9.693 3.137 -10.529 329 HB3 ARG 42 1HB ARG 42 -9.019 3.199 -8.913 330 HG2 ARG 42 2HG ARG 42 -11.056 4.448 -8.868 331 HG3 ARG 42 1HG ARG 42 -9.720 5.569 -8.788 332 HD2 ARG 42 2HD ARG 42 -10.042 6.426 -10.820 333 HD3 ARG 42 1HD ARG 42 -10.797 4.955 -11.522 334 HE ARG 42 HE ARG 42 -12.318 6.309 -9.531 335 HH11 ARG 42 1HH1 ARG 42 -11.488 6.333 -12.995 336 HH12 ARG 42 2HH1 ARG 42 -12.830 7.242 -13.465 337 HH21 ARG 42 1HH2 ARG 42 -14.228 7.625 -10.229 338 HH22 ARG 42 2HH2 ARG 42 -14.384 7.965 -11.868 339 H THR 43 H THR 43 -7.197 6.521 -9.975 340 HA THR 43 HA THR 43 -5.532 5.814 -7.685 341 HB THR 43 HB THR 43 -4.147 6.334 -9.694 342 HG1 THR 43 1HG THR 43 -2.830 7.020 -8.292 343 HG21 THR 43 3HG2 THR 43 -5.452 9.034 -9.475 344 HG22 THR 43 1HG2 THR 43 -5.584 7.908 -10.816 345 HG23 THR 43 2HG2 THR 43 -4.037 8.695 -10.473 346 H LYS 44 H LYS 44 -5.239 7.541 -6.174 347 HA LYS 44 HA LYS 44 -7.718 9.101 -5.961 348 HB2 LYS 44 2HB LYS 44 -5.804 8.056 -3.878 349 HB3 LYS 44 1HB LYS 44 -7.218 9.026 -3.507 350 HG2 LYS 44 2HG LYS 44 -8.653 7.260 -4.400 351 HG3 LYS 44 1HG LYS 44 -7.229 6.311 -4.813 352 HD2 LYS 44 2HD LYS 44 -6.614 6.216 -2.445 353 HD3 LYS 44 1HD LYS 44 -8.051 7.165 -2.044 354 HE2 LYS 44 2HE LYS 44 -9.485 5.409 -2.927 355 HE3 LYS 44 1HE LYS 44 -8.075 4.477 -3.413 356 HZ1 LYS 44 3HZ LYS 44 -9.080 3.678 -1.390 357 HZ2 LYS 44 1HZ LYS 44 -8.775 5.152 -0.597 358 HZ3 LYS 44 2HZ LYS 44 -7.491 4.173 -1.110 359 H LYS 45 H LYS 45 -7.329 11.090 -6.595 360 HA LYS 45 HA LYS 45 -4.801 12.387 -5.833 361 HB2 LYS 45 2HB LYS 45 -6.402 12.597 -8.354 362 HB3 LYS 45 1HB LYS 45 -5.090 13.677 -8.086 363 HG2 LYS 45 2HG LYS 45 -3.620 11.614 -7.972 364 HG3 LYS 45 1HG LYS 45 -5.044 10.727 -8.524 365 HD2 LYS 45 2HD LYS 45 -3.839 11.295 -10.518 366 HD3 LYS 45 1HD LYS 45 -5.229 12.393 -10.323 367 HE2 LYS 45 2HE LYS 45 -3.244 13.618 -11.058 368 HE3 LYS 45 1HE LYS 45 -3.817 14.159 -9.492 369 HZ1 LYS 45 3HZ LYS 45 -2.055 12.781 -8.458 370 HZ2 LYS 45 1HZ LYS 45 -1.434 13.954 -9.478 371 HZ3 LYS 45 2HZ LYS 45 -1.500 12.364 -9.992 372 H ASP 46 H ASP 46 -5.397 13.700 -4.271 373 HA ASP 46 HA ASP 46 -6.481 15.214 -3.012 374 HB2 ASP 46 2HB ASP 46 -6.763 16.479 -5.734 375 HB3 ASP 46 1HB ASP 46 -7.158 17.315 -4.235 376 H GLY 47 H GLY 47 -8.097 13.085 -3.398 377 HA2 GLY 47 2HA GLY 47 -10.267 12.700 -2.591 378 HA3 GLY 47 1HA GLY 47 -10.662 14.367 -2.950 379 H LYS 48 H LYS 48 -9.249 13.378 -5.687 380 HA LYS 48 HA LYS 48 -11.811 12.529 -6.807 381 HB2 LYS 48 2HB LYS 48 -9.460 13.894 -8.130 382 HB3 LYS 48 1HB LYS 48 -10.910 13.360 -8.974 383 HG2 LYS 48 2HG LYS 48 -12.256 14.915 -7.681 384 HG3 LYS 48 1HG LYS 48 -10.827 15.411 -6.772 385 HD2 LYS 48 2HD LYS 48 -9.809 16.267 -8.815 386 HD3 LYS 48 1HD LYS 48 -11.204 15.729 -9.755 387 HE2 LYS 48 2HE LYS 48 -12.647 17.236 -8.513 388 HE3 LYS 48 1HE LYS 48 -11.291 17.743 -7.510 389 HZ1 LYS 48 3HZ LYS 48 -11.518 18.173 -10.447 390 HZ2 LYS 48 1HZ LYS 48 -10.237 18.668 -9.459 391 HZ3 LYS 48 2HZ LYS 48 -11.773 19.332 -9.254 392 H GLN 49 H GLN 49 -11.927 10.560 -7.842 393 HA GLN 49 HA GLN 49 -9.495 9.014 -7.892 394 HB2 GLN 49 2HB GLN 49 -12.405 8.189 -8.156 395 HB3 GLN 49 1HB GLN 49 -11.047 7.105 -8.247 396 HG2 GLN 49 2HG GLN 49 -12.090 6.861 -6.118 397 HG3 GLN 49 1HG GLN 49 -10.520 7.614 -5.867 398 HE21 GLN 49 1HE2 GLN 49 -10.475 9.733 -5.003 399 HE22 GLN 49 2HE2 GLN 49 -11.880 10.489 -4.396 400 H VAL 50 H VAL 50 -8.563 8.782 -9.800 401 HA VAL 50 HA VAL 50 -10.182 9.067 -12.245 402 HB VAL 50 HB VAL 50 -8.402 10.412 -13.323 403 HG11 VAL 50 1HG1 VAL 50 -8.727 12.525 -12.104 404 HG12 VAL 50 2HG1 VAL 50 -9.370 11.624 -10.739 405 HG13 VAL 50 3HG1 VAL 50 -10.236 11.628 -12.280 406 HG21 VAL 50 3HG2 VAL 50 -6.584 11.389 -11.974 407 HG22 VAL 50 1HG2 VAL 50 -6.491 9.624 -12.021 408 HG23 VAL 50 2HG2 VAL 50 -7.112 10.432 -10.592 409 H TRP 51 H TRP 51 -8.748 8.301 -14.251 410 HA TRP 51 HA TRP 51 -7.481 5.831 -13.401 411 HB2 TRP 51 2HB TRP 51 -8.293 6.785 -16.161 412 HB3 TRP 51 1HB TRP 51 -7.628 5.233 -15.841 413 HD1 TRP 51 HD TRP 51 -10.667 6.840 -16.408 414 HE1 TRP 51 1HE TRP 51 -12.705 5.403 -15.693 415 HE3 TRP 51 3HE TRP 51 -8.237 3.465 -13.507 416 HZ2 TRP 51 2HZ TRP 51 -13.176 3.120 -14.107 417 HZ3 TRP 51 3HZ TRP 51 -9.529 1.679 -12.425 418 HH2 TRP 51 HH TRP 51 -11.948 1.511 -12.710 419 H GLU 52 H GLU 52 -5.362 5.811 -13.215 420 HA GLU 52 HA GLU 52 -3.776 7.546 -14.971 421 HB2 GLU 52 2HB GLU 52 -3.704 8.356 -12.668 422 HB3 GLU 52 1HB GLU 52 -3.234 6.760 -12.102 423 HG2 GLU 52 2HG GLU 52 -1.146 6.934 -13.330 424 HG3 GLU 52 1HG GLU 52 -1.621 8.524 -13.919 425 H ALA 53 H ALA 53 -2.030 6.616 -15.910 426 HA ALA 53 HA ALA 53 -2.086 3.849 -16.389 427 HB1 ALA 53 1HB ALA 53 0.155 5.799 -16.914 428 HB2 ALA 53 2HB ALA 53 -1.205 5.485 -17.993 429 HB3 ALA 53 3HB ALA 53 -0.034 4.208 -17.656 430 H ALA 54 H ALA 54 -0.860 2.212 -15.708 431 HA ALA 54 HA ALA 54 0.256 2.308 -13.108 432 HB1 ALA 54 1HB ALA 54 0.477 0.152 -15.206 433 HB2 ALA 54 2HB ALA 54 -0.803 0.287 -14.002 434 HB3 ALA 54 3HB ALA 54 0.856 -0.034 -13.494 435 H SER 55 H SER 55 2.555 1.397 -12.704 436 HA SER 55 HA SER 55 4.380 2.673 -14.584 437 HB2 SER 55 2HB SER 55 4.010 4.126 -12.583 438 HB3 SER 55 1HB SER 55 4.540 2.801 -11.549 439 HG SER 55 HG SER 55 5.949 4.500 -13.194 440 H LYS 56 H LYS 56 6.511 1.771 -14.480 441 HA LYS 56 HA LYS 56 6.500 -0.997 -14.735 442 HB2 LYS 56 2HB LYS 56 8.028 0.613 -15.789 443 HB3 LYS 56 1HB LYS 56 8.883 0.748 -14.258 444 HG2 LYS 56 2HG LYS 56 9.481 -1.590 -14.344 445 HG3 LYS 56 1HG LYS 56 8.544 -1.796 -15.824 446 HD2 LYS 56 2HD LYS 56 10.877 0.041 -15.483 447 HD3 LYS 56 1HD LYS 56 10.944 -1.571 -16.233 448 HE2 LYS 56 2HE LYS 56 9.370 -0.784 -17.981 449 HE3 LYS 56 1HE LYS 56 9.330 0.805 -17.229 450 HZ1 LYS 56 3HZ LYS 56 11.740 -0.472 -18.385 451 HZ2 LYS 56 1HZ LYS 56 11.668 1.064 -17.709 452 HZ3 LYS 56 2HZ LYS 56 10.828 0.727 -19.131 453 H THR 57 H THR 57 7.374 0.916 -11.898 454 HA THR 57 HA THR 57 8.390 -1.283 -10.440 455 HB THR 57 HB THR 57 8.954 0.969 -9.725 456 HG1 THR 57 1HG THR 57 8.512 0.734 -7.510 457 HG21 THR 57 3HG2 THR 57 6.852 2.131 -10.312 458 HG22 THR 57 1HG2 THR 57 7.311 2.458 -8.638 459 HG23 THR 57 2HG2 THR 57 6.030 1.301 -8.995 460 H ALA 58 H ALA 58 5.141 0.065 -10.705 461 HA ALA 58 HA ALA 58 4.047 -1.681 -8.715 462 HB1 ALA 58 1HB ALA 58 2.638 -0.055 -10.835 463 HB2 ALA 58 2HB ALA 58 3.013 0.497 -9.203 464 HB3 ALA 58 3HB ALA 58 1.872 -0.826 -9.447 465 H LEU 59 H LEU 59 4.388 -1.671 -12.198 466 HA LEU 59 HA LEU 59 2.846 -3.932 -12.695 467 HB2 LEU 59 2HB LEU 59 5.224 -2.808 -14.205 468 HB3 LEU 59 1HB LEU 59 4.108 -4.126 -14.747 469 HG LEU 59 HG LEU 59 3.245 -1.281 -14.215 470 HD11 LEU 59 1HD1 LEU 59 4.945 -1.297 -16.005 471 HD12 LEU 59 2HD1 LEU 59 3.335 -0.988 -16.649 472 HD13 LEU 59 3HD1 LEU 59 4.060 -2.586 -16.821 473 HD21 LEU 59 3HD2 LEU 59 1.349 -1.912 -15.515 474 HD22 LEU 59 1HD2 LEU 59 1.545 -3.140 -14.241 475 HD23 LEU 59 2HD2 LEU 59 2.064 -3.472 -15.888 476 H LYS 60 H LYS 60 6.417 -3.597 -12.130 477 HA LYS 60 HA LYS 60 6.961 -6.301 -12.324 478 HB2 LYS 60 2HB LYS 60 8.679 -4.581 -12.369 479 HB3 LYS 60 1HB LYS 60 8.340 -4.178 -10.694 480 HG2 LYS 60 2HG LYS 60 9.077 -6.365 -9.986 481 HG3 LYS 60 1HG LYS 60 9.361 -6.832 -11.661 482 HD2 LYS 60 2HD LYS 60 10.990 -5.079 -11.881 483 HD3 LYS 60 1HD LYS 60 10.704 -4.590 -10.211 484 HE2 LYS 60 2HE LYS 60 11.447 -6.778 -9.407 485 HE3 LYS 60 1HE LYS 60 11.679 -7.324 -11.063 486 HZ1 LYS 60 3HZ LYS 60 13.411 -5.679 -11.323 487 HZ2 LYS 60 1HZ LYS 60 13.755 -6.709 -10.035 488 HZ3 LYS 60 2HZ LYS 60 13.204 -5.149 -9.732 489 H LYS 61 H LYS 61 5.797 -4.390 -9.560 490 HA LYS 61 HA LYS 61 6.185 -6.358 -7.636 491 HB2 LYS 61 2HB LYS 61 5.898 -4.043 -7.035 492 HB3 LYS 61 1HB LYS 61 4.365 -3.952 -7.858 493 HG2 LYS 61 2HG LYS 61 4.770 -5.665 -5.410 494 HG3 LYS 61 1HG LYS 61 4.367 -3.954 -5.312 495 HD2 LYS 61 2HD LYS 61 2.376 -4.398 -6.691 496 HD3 LYS 61 1HD LYS 61 2.766 -6.110 -6.664 497 HE2 LYS 61 2HE LYS 61 2.565 -6.146 -4.216 498 HE3 LYS 61 1HE LYS 61 2.233 -4.417 -4.216 499 HZ1 LYS 61 3HZ LYS 61 0.226 -4.866 -5.492 500 HZ2 LYS 61 1HZ LYS 61 0.176 -5.630 -4.013 501 HZ3 LYS 61 2HZ LYS 61 0.505 -6.519 -5.416 502 H SER 62 H SER 62 3.444 -5.613 -9.708 503 HA SER 62 HA SER 62 1.733 -7.655 -8.652 504 HB2 SER 62 2HB SER 62 1.657 -6.217 -11.310 505 HB3 SER 62 1HB SER 62 0.324 -7.071 -10.522 506 HG SER 62 HG SER 62 1.545 -4.635 -9.821 507 H TRP 63 H TRP 63 3.911 -7.482 -11.492 508 HA TRP 63 HA TRP 63 3.143 -9.981 -12.444 509 HB2 TRP 63 2HB TRP 63 4.130 -8.232 -13.866 510 HB3 TRP 63 1HB TRP 63 5.656 -8.397 -13.000 511 HD1 TRP 63 HD TRP 63 7.206 -10.215 -13.717 512 HE1 TRP 63 1HE TRP 63 7.173 -12.074 -15.545 513 HE3 TRP 63 3HE TRP 63 2.346 -9.837 -15.130 514 HZ2 TRP 63 2HZ TRP 63 5.291 -13.195 -17.333 515 HZ3 TRP 63 3HZ TRP 63 1.475 -11.359 -16.896 516 HH2 TRP 63 HH TRP 63 2.931 -12.975 -17.968 517 H LYS 64 H LYS 64 5.455 -8.959 -10.061 518 HA LYS 64 HA LYS 64 7.013 -11.253 -9.965 519 HB2 LYS 64 2HB LYS 64 7.506 -9.132 -8.779 520 HB3 LYS 64 1HB LYS 64 6.185 -9.456 -7.681 521 HG2 LYS 64 2HG LYS 64 7.356 -11.327 -6.737 522 HG3 LYS 64 1HG LYS 64 8.630 -11.195 -7.955 523 HD2 LYS 64 2HD LYS 64 9.200 -8.967 -7.124 524 HD3 LYS 64 1HD LYS 64 7.928 -9.092 -5.915 525 HE2 LYS 64 2HE LYS 64 10.298 -10.934 -6.130 526 HE3 LYS 64 1HE LYS 64 10.210 -9.557 -5.034 527 HZ1 LYS 64 3HZ LYS 64 8.337 -10.622 -3.934 528 HZ2 LYS 64 1HZ LYS 64 9.683 -11.639 -3.954 529 HZ3 LYS 64 2HZ LYS 64 8.417 -11.928 -5.007 530 H ARG 65 H ARG 65 3.722 -10.709 -8.852 531 HA ARG 65 HA ARG 65 3.510 -13.141 -7.344 532 HB2 ARG 65 2HB ARG 65 1.553 -11.185 -8.419 533 HB3 ARG 65 1HB ARG 65 0.921 -12.765 -8.128 534 HG2 ARG 65 2HG ARG 65 0.387 -11.804 -6.155 535 HG3 ARG 65 1HG ARG 65 2.010 -12.297 -5.729 536 HD2 ARG 65 2HD ARG 65 1.205 -9.604 -6.759 537 HD3 ARG 65 1HD ARG 65 1.408 -9.978 -5.051 538 HE ARG 65 HE ARG 65 3.426 -9.505 -7.060 539 HH11 ARG 65 1HH1 ARG 65 2.831 -10.741 -3.777 540 HH12 ARG 65 2HH1 ARG 65 4.379 -10.311 -3.223 541 HH21 ARG 65 1HH2 ARG 65 5.486 -8.858 -6.212 542 HH22 ARG 65 2HH2 ARG 65 5.903 -9.226 -4.598 543 H TYR 66 H TYR 66 3.353 -12.323 -10.696 544 HA TYR 66 HA TYR 66 1.907 -14.638 -11.597 545 HB2 TYR 66 2HB TYR 66 2.260 -12.330 -12.749 546 HB3 TYR 66 1HB TYR 66 3.799 -13.006 -13.259 547 HD1 TYR 66 1HD TYR 66 3.657 -15.322 -14.482 548 HD2 TYR 66 2HD TYR 66 0.409 -12.636 -14.026 549 HE1 TYR 66 1HE TYR 66 2.521 -16.392 -16.364 550 HE2 TYR 66 2HE TYR 66 -0.733 -13.649 -15.878 551 HH TYR 66 HH TYR 66 0.308 -16.666 -17.254 552 H GLU 67 H GLU 67 5.294 -13.663 -11.440 553 HA GLU 67 HA GLU 67 6.592 -16.040 -12.424 554 HB2 GLU 67 2HB GLU 67 7.473 -14.188 -10.205 555 HB3 GLU 67 1HB GLU 67 8.493 -15.258 -11.158 556 HG2 GLU 67 2HG GLU 67 6.901 -13.027 -12.237 557 HG3 GLU 67 1HG GLU 67 8.599 -12.838 -11.778 558 H GLN 68 H GLN 68 5.537 -15.143 -9.291 559 HA GLN 68 HA GLN 68 6.348 -17.521 -8.033 560 HB2 GLN 68 2HB GLN 68 4.097 -15.668 -7.280 561 HB3 GLN 68 1HB GLN 68 4.618 -17.006 -6.274 562 HG2 GLN 68 2HG GLN 68 6.278 -14.632 -7.092 563 HG3 GLN 68 1HG GLN 68 5.585 -14.935 -5.499 564 HE21 GLN 68 1HE2 GLN 68 6.463 -16.537 -4.226 565 HE22 GLN 68 2HE2 GLN 68 8.039 -17.185 -4.485 566 H GLU 69 H GLU 69 3.401 -16.786 -9.773 567 HA GLU 69 HA GLU 69 2.234 -19.307 -9.163 568 HB2 GLU 69 2HB GLU 69 1.433 -17.231 -11.148 569 HB3 GLU 69 1HB GLU 69 0.551 -18.734 -10.904 570 HG2 GLU 69 2HG GLU 69 1.073 -16.629 -8.835 571 HG3 GLU 69 1HG GLU 69 -0.439 -16.955 -9.685 572 H MET 70 H MET 70 4.085 -18.160 -11.818 573 HA MET 70 HA MET 70 3.772 -20.494 -13.462 574 HB2 MET 70 2HB MET 70 6.115 -18.573 -13.308 575 HB3 MET 70 1HB MET 70 5.888 -19.769 -14.572 576 HG2 MET 70 2HG MET 70 4.035 -17.470 -13.986 577 HG3 MET 70 1HG MET 70 5.223 -17.519 -15.284 578 HE1 MET 70 3HE MET 70 3.821 -20.284 -17.628 579 HE2 MET 70 1HE MET 70 5.000 -20.511 -16.340 580 HE3 MET 70 2HE MET 70 5.081 -19.080 -17.370 581 H LEU 71 H LEU 71 5.907 -19.568 -10.946 582 HA LEU 71 HA LEU 71 7.530 -21.903 -10.847 583 HB2 LEU 71 2HB LEU 71 8.416 -19.838 -10.235 584 HB3 LEU 71 1HB LEU 71 7.134 -19.425 -9.165 585 HG LEU 71 HG LEU 71 7.997 -21.227 -7.597 586 HD11 LEU 71 1HD1 LEU 71 10.248 -22.092 -7.965 587 HD12 LEU 71 2HD1 LEU 71 10.289 -21.314 -9.548 588 HD13 LEU 71 3HD1 LEU 71 9.135 -22.613 -9.230 589 HD21 LEU 71 3HD2 LEU 71 9.935 -19.934 -6.849 590 HD22 LEU 71 1HD2 LEU 71 8.577 -18.890 -7.263 591 HD23 LEU 71 2HD2 LEU 71 9.933 -19.055 -8.377 592 H LYS 72 H LYS 72 4.500 -20.992 -9.633 593 HA LYS 72 HA LYS 72 4.155 -22.450 -7.235 594 HB2 LYS 72 2HB LYS 72 2.895 -20.573 -7.991 595 HB3 LYS 72 1HB LYS 72 2.198 -21.496 -9.313 596 HG2 LYS 72 2HG LYS 72 0.527 -21.305 -7.712 597 HG3 LYS 72 1HG LYS 72 1.187 -22.918 -7.425 598 HD2 LYS 72 2HD LYS 72 2.357 -22.201 -5.517 599 HD3 LYS 72 1HD LYS 72 2.160 -20.499 -5.943 600 HE2 LYS 72 2HE LYS 72 -0.041 -22.390 -5.137 601 HE3 LYS 72 1HE LYS 72 0.659 -21.108 -4.143 602 HZ1 LYS 72 3HZ LYS 72 -0.918 -20.746 -6.652 603 HZ2 LYS 72 1HZ LYS 72 -0.079 -19.529 -5.965 604 HZ3 LYS 72 2HZ LYS 72 -1.369 -20.241 -5.110 605 H ASN 73 H ASN 73 3.987 -23.342 -10.592 606 HA ASN 73 HA ASN 73 2.125 -25.447 -10.501 607 HB2 ASN 73 2HB ASN 73 2.893 -24.459 -12.618 608 HB3 ASN 73 1HB ASN 73 4.487 -25.146 -12.371 609 HD21 ASN 73 1HD2 ASN 73 1.420 -26.848 -11.711 610 HD22 ASN 73 2HD2 ASN 73 1.621 -27.999 -12.968 611 H GLU 74 H GLU 74 5.653 -25.938 -10.802 612 HA GLU 74 HA GLU 74 5.279 -28.378 -9.215 613 HB2 GLU 74 2HB GLU 74 7.567 -27.607 -11.027 614 HB3 GLU 74 1HB GLU 74 7.419 -29.121 -10.148 615 HG2 GLU 74 2HG GLU 74 5.372 -29.614 -11.434 616 HG3 GLU 74 1HG GLU 74 5.647 -28.144 -12.367 617 H LYS 75 H LYS 75 6.885 -28.828 -7.578 618 HA LYS 75 HA LYS 75 8.197 -28.348 -5.807 619 HB2 LYS 75 2HB LYS 75 9.784 -27.278 -7.333 620 HB3 LYS 75 1HB LYS 75 8.858 -25.787 -7.299 621 HG2 LYS 75 2HG LYS 75 9.357 -25.584 -4.892 622 HG3 LYS 75 1HG LYS 75 10.377 -27.020 -5.011 623 HD2 LYS 75 2HD LYS 75 10.752 -24.443 -6.532 624 HD3 LYS 75 1HD LYS 75 11.689 -24.951 -5.128 625 HE2 LYS 75 2HE LYS 75 12.480 -26.909 -6.410 626 HE3 LYS 75 1HE LYS 75 11.565 -26.346 -7.806 627 HZ1 LYS 75 3HZ LYS 75 12.931 -24.313 -7.769 628 HZ2 LYS 75 1HZ LYS 75 13.870 -25.707 -7.990 629 HZ3 LYS 75 2HZ LYS 75 13.805 -24.947 -6.487 630 H VAL 76 H VAL 76 6.291 -25.648 -6.933 631 HA VAL 76 HA VAL 76 4.714 -24.379 -6.067 632 HB VAL 76 HB VAL 76 4.718 -26.367 -3.873 633 HG11 VAL 76 1HG1 VAL 76 2.372 -25.562 -3.395 634 HG12 VAL 76 2HG1 VAL 76 2.596 -24.312 -4.615 635 HG13 VAL 76 3HG1 VAL 76 3.582 -24.299 -3.151 636 HG21 VAL 76 3HG2 VAL 76 2.741 -27.351 -5.024 637 HG22 VAL 76 1HG2 VAL 76 4.227 -27.425 -5.970 638 HG23 VAL 76 2HG2 VAL 76 3.005 -26.211 -6.347 639 H ALA 77 H ALA 77 5.611 -22.576 -5.699 640 HA ALA 77 HA ALA 77 6.815 -22.048 -3.085 641 HB1 ALA 77 1HB ALA 77 6.946 -20.414 -5.624 642 HB2 ALA 77 2HB ALA 77 8.231 -21.446 -5.001 643 HB3 ALA 77 3HB ALA 77 7.739 -20.009 -4.103 644 H ALA 78 H ALA 78 5.119 -21.622 -1.800 645 HA ALA 78 HA ALA 78 2.942 -20.029 -2.815 646 HB1 ALA 78 1HB ALA 78 3.300 -21.288 -0.103 647 HB2 ALA 78 2HB ALA 78 2.456 -22.023 -1.463 648 HB3 ALA 78 3HB ALA 78 1.822 -20.554 -0.723 649 H LYS 79 H LYS 79 3.417 -17.975 -2.929 650 HA LYS 79 HA LYS 79 3.912 -16.572 -0.447 651 HB2 LYS 79 2HB LYS 79 6.163 -16.831 -1.610 652 HB3 LYS 79 1HB LYS 79 5.472 -15.949 -2.965 653 HG2 LYS 79 2HG LYS 79 6.818 -14.463 -1.608 654 HG3 LYS 79 1HG LYS 79 5.117 -14.000 -1.518 655 HD2 LYS 79 2HD LYS 79 4.909 -15.184 0.626 656 HD3 LYS 79 1HD LYS 79 6.610 -15.638 0.526 657 HE2 LYS 79 2HE LYS 79 7.210 -13.247 0.573 658 HE3 LYS 79 1HE LYS 79 5.501 -12.845 0.711 659 HZ1 LYS 79 3HZ LYS 79 5.441 -14.082 2.819 660 HZ2 LYS 79 1HZ LYS 79 6.576 -12.836 2.882 661 HZ3 LYS 79 2HZ LYS 79 7.070 -14.422 2.667 662 H MET 80 H MET 80 2.586 -14.821 -0.378 663 HA MET 80 HA MET 80 1.114 -14.300 -2.861 664 HB2 MET 80 2HB MET 80 -0.218 -15.452 -1.207 665 HB3 MET 80 1HB MET 80 0.156 -14.227 -0.011 666 HG2 MET 80 2HG MET 80 -1.078 -12.578 -1.300 667 HG3 MET 80 1HG MET 80 -1.437 -13.793 -2.530 668 HE1 MET 80 3HE MET 80 -4.026 -13.244 -2.291 669 HE2 MET 80 1HE MET 80 -3.650 -12.035 -1.061 670 HE3 MET 80 2HE MET 80 -4.885 -13.256 -0.751 671 H LEU 81 H LEU 81 1.837 -12.689 0.240 672 HA LEU 81 HA LEU 81 2.038 -10.568 0.896 673 HB2 LEU 81 2HB LEU 81 3.778 -10.354 -0.948 674 HB3 LEU 81 1HB LEU 81 2.513 -9.868 -2.042 675 HG LEU 81 HG LEU 81 3.417 -8.246 0.370 676 HD11 LEU 81 1HD1 LEU 81 4.067 -7.915 -2.550 677 HD12 LEU 81 2HD1 LEU 81 5.187 -8.398 -1.273 678 HD13 LEU 81 3HD1 LEU 81 4.490 -6.779 -1.269 679 HD21 LEU 81 3HD2 LEU 81 1.656 -7.477 -1.967 680 HD22 LEU 81 1HD2 LEU 81 2.195 -6.404 -0.676 681 HD23 LEU 81 2HD2 LEU 81 1.106 -7.749 -0.315 682 H GLU 82 H GLU 82 0.214 -9.867 1.652 683 HA GLU 82 HA GLU 82 -2.018 -9.675 -0.231 684 HB2 GLU 82 2HB GLU 82 -2.210 -11.494 1.346 685 HB3 GLU 82 1HB GLU 82 -2.043 -10.374 2.687 686 HG2 GLU 82 2HG GLU 82 -4.121 -9.259 1.958 687 HG3 GLU 82 1HG GLU 82 -4.305 -10.488 0.704 688 H LYS 83 H LYS 83 -2.250 -7.597 -0.666 689 HA LYS 83 HA LYS 83 -2.618 -5.724 1.593 690 HB2 LYS 83 2HB LYS 83 -1.361 -5.213 -0.719 691 HB3 LYS 83 1HB LYS 83 -2.992 -5.027 -1.328 692 HG2 LYS 83 2HG LYS 83 -1.710 -3.388 0.869 693 HG3 LYS 83 1HG LYS 83 -1.978 -2.868 -0.782 694 HD2 LYS 83 2HD LYS 83 -4.412 -2.990 -0.397 695 HD3 LYS 83 1HD LYS 83 -4.118 -3.526 1.259 696 HE2 LYS 83 2HE LYS 83 -2.863 -1.412 1.665 697 HE3 LYS 83 1HE LYS 83 -3.296 -0.891 0.042 698 HZ1 LYS 83 3HZ LYS 83 -5.655 -0.937 0.705 699 HZ2 LYS 83 1HZ LYS 83 -4.748 0.054 1.713 700 HZ3 LYS 83 2HZ LYS 83 -5.207 -1.455 2.246 701 H ASP 84 H ASP 84 -3.972 -7.444 -1.052 702 HA ASP 84 HA ASP 84 -5.893 -8.318 -1.603 703 HB2 ASP 84 2HB ASP 84 -6.167 -8.960 0.756 704 HB3 ASP 84 1HB ASP 84 -6.951 -7.413 1.068 705 H ALA 85 H ALA 85 -7.174 -5.500 0.180 706 HA ALA 85 HA ALA 85 -7.829 -4.179 -2.251 707 HB1 ALA 85 1HB ALA 85 -10.251 -4.373 -2.103 708 HB2 ALA 85 2HB ALA 85 -10.088 -5.466 -0.725 709 HB3 ALA 85 3HB ALA 85 -9.500 -5.958 -2.315 710 H THR 86 H THR 86 -9.675 -2.489 -1.634 711 HA THR 86 HA THR 86 -9.656 -1.582 1.065 712 HB THR 86 HB THR 86 -8.620 0.205 -1.188 713 HG1 THR 86 1HG THR 86 -7.418 -1.627 0.245 714 HG21 THR 86 3HG2 THR 86 -8.673 0.612 1.823 715 HG22 THR 86 1HG2 THR 86 -9.767 1.381 0.672 716 HG23 THR 86 2HG2 THR 86 -8.050 1.761 0.641 717 H GLU 87 H GLU 87 -11.416 0.207 1.105 718 HA GLU 87 HA GLU 87 -12.902 0.368 -1.374 719 HB2 GLU 87 2HB GLU 87 -13.818 -1.608 -0.210 720 HB3 GLU 87 1HB GLU 87 -14.180 -0.600 1.180 721 HG2 GLU 87 2HG GLU 87 -15.672 0.767 -0.233 722 HG3 GLU 87 1HG GLU 87 -15.362 -0.335 -1.573 723 H VAL 88 H VAL 88 -13.024 2.474 -1.607 724 HA VAL 88 HA VAL 88 -13.984 4.013 0.683 725 HB VAL 88 HB VAL 88 -13.188 6.050 -0.445 726 HG11 VAL 88 1HG1 VAL 88 -11.686 4.982 1.110 727 HG12 VAL 88 2HG1 VAL 88 -10.786 5.694 -0.233 728 HG13 VAL 88 3HG1 VAL 88 -11.055 3.953 -0.181 729 HG21 VAL 88 3HG2 VAL 88 -11.750 5.926 -2.437 730 HG22 VAL 88 1HG2 VAL 88 -13.376 5.330 -2.773 731 HG23 VAL 88 2HG2 VAL 88 -12.055 4.191 -2.536 732 H GLY 89 H GLY 89 -15.731 5.436 0.325 733 HA2 GLY 89 2HA GLY 89 -17.644 4.351 -1.481 734 HA3 GLY 89 1HA GLY 89 -17.870 5.720 -0.401 735 H VAL 90 H VAL 90 -16.573 4.725 -3.467 736 HA VAL 90 HA VAL 90 -16.099 7.362 -4.434 737 HB VAL 90 HB VAL 90 -16.599 4.846 -6.069 738 HG11 VAL 90 1HG1 VAL 90 -15.297 7.453 -6.866 739 HG12 VAL 90 2HG1 VAL 90 -16.875 6.874 -7.400 740 HG13 VAL 90 3HG1 VAL 90 -15.412 6.014 -7.878 741 HG21 VAL 90 3HG2 VAL 90 -14.150 4.688 -6.238 742 HG22 VAL 90 1HG2 VAL 90 -14.701 4.554 -4.568 743 HG23 VAL 90 2HG2 VAL 90 -13.993 6.064 -5.143 744 H LYS 91 H LYS 91 -17.712 8.736 -4.459 745 HA LYS 91 HA LYS 91 -20.401 7.805 -5.036 746 HB2 LYS 91 2HB LYS 91 -19.744 9.292 -3.035 747 HB3 LYS 91 1HB LYS 91 -19.525 10.576 -4.200 748 HG2 LYS 91 2HG LYS 91 -22.126 9.131 -3.658 749 HG3 LYS 91 1HG LYS 91 -21.667 10.697 -3.012 750 HD2 LYS 91 2HD LYS 91 -21.618 11.616 -5.277 751 HD3 LYS 91 1HD LYS 91 -22.052 10.032 -5.928 752 HE2 LYS 91 2HE LYS 91 -24.016 11.459 -5.773 753 HE3 LYS 91 1HE LYS 91 -24.150 10.095 -4.663 754 HZ1 LYS 91 3HZ LYS 91 -23.360 12.857 -3.976 755 HZ2 LYS 91 1HZ LYS 91 -23.438 11.588 -2.860 756 HZ3 LYS 91 2HZ LYS 91 -24.839 12.141 -3.616 757 H ALA 92 H ALA 92 -20.888 7.778 -7.126 758 HA ALA 92 HA ALA 92 -19.601 9.578 -8.982 759 HB1 ALA 92 1HB ALA 92 -19.908 7.227 -9.598 760 HB2 ALA 92 2HB ALA 92 -20.799 8.285 -10.690 761 HB3 ALA 92 3HB ALA 92 -21.654 7.404 -9.425 762 H ALA 93 H ALA 93 -20.445 11.516 -9.414 763 HA ALA 93 HA ALA 93 -23.029 12.225 -8.468 764 HB1 ALA 93 1HB ALA 93 -22.576 14.418 -9.464 765 HB2 ALA 93 2HB ALA 93 -21.168 13.760 -10.291 766 HB3 ALA 93 3HB ALA 93 -21.189 13.860 -8.531 767 H LEU 94 H LEU 94 -24.881 12.065 -9.511 768 HA LEU 94 HA LEU 94 -24.822 10.911 -12.140 769 HB2 LEU 94 2HB LEU 94 -27.255 10.614 -11.878 770 HB3 LEU 94 1HB LEU 94 -26.313 9.855 -10.625 771 HG LEU 94 HG LEU 94 -26.928 11.803 -9.128 772 HD11 LEU 94 1HD1 LEU 94 -28.909 13.109 -9.677 773 HD12 LEU 94 2HD1 LEU 94 -28.923 12.411 -11.295 774 HD13 LEU 94 3HD1 LEU 94 -27.581 13.434 -10.791 775 HD21 LEU 94 3HD2 LEU 94 -29.158 10.099 -10.186 776 HD22 LEU 94 1HD2 LEU 94 -29.148 10.924 -8.631 777 HD23 LEU 94 2HD2 LEU 94 -27.988 9.633 -8.946 778 H GLU 95 H GLU 95 -26.037 11.635 -13.928 779 HA GLU 95 HA GLU 95 -26.112 14.528 -13.969 780 HB2 GLU 95 2HB GLU 95 -25.957 14.390 -16.412 781 HB3 GLU 95 1HB GLU 95 -24.613 13.577 -15.643 782 HG2 GLU 95 2HG GLU 95 -27.028 12.191 -16.808 783 HG3 GLU 95 1HG GLU 95 -25.496 12.409 -17.638 784 H GLU 96 H GLU 96 -27.901 15.601 -14.497 785 HA GLU 96 HA GLU 96 -30.368 14.106 -14.479 786 HB2 GLU 96 2HB GLU 96 -30.155 16.160 -13.130 787 HB3 GLU 96 1HB GLU 96 -29.817 17.088 -14.579 788 HG2 GLU 96 2HG GLU 96 -32.102 17.417 -13.809 789 HG3 GLU 96 1HG GLU 96 -32.058 16.651 -15.398 790 H ALA 97 H ALA 97 -30.724 13.151 -16.426 791 HA ALA 97 HA ALA 97 -30.828 14.910 -18.715 792 HB1 ALA 97 1HB ALA 97 -29.535 13.453 -20.150 793 HB2 ALA 97 2HB ALA 97 -29.247 12.347 -18.807 794 HB3 ALA 97 3HB ALA 97 -28.562 13.973 -18.774 795 H LYS 98 H LYS 98 -33.039 14.687 -18.493 796 HA LYS 98 HA LYS 98 -33.971 12.622 -20.127 797 HB2 LYS 98 2HB LYS 98 -35.815 11.868 -18.617 798 HB3 LYS 98 1HB LYS 98 -34.234 11.417 -18.037 799 HG2 LYS 98 2HG LYS 98 -35.466 12.036 -16.130 800 HG3 LYS 98 1HG LYS 98 -34.409 13.403 -16.453 801 HD2 LYS 98 2HD LYS 98 -36.238 14.623 -17.469 802 HD3 LYS 98 1HD LYS 98 -37.300 13.223 -17.301 803 HE2 LYS 98 2HE LYS 98 -37.752 14.856 -15.571 804 HE3 LYS 98 1HE LYS 98 -37.110 13.384 -14.860 805 HZ1 LYS 98 3HZ LYS 98 -35.626 15.887 -15.374 806 HZ2 LYS 98 1HZ LYS 98 -34.917 14.521 -14.688 807 HZ3 LYS 98 2HZ LYS 98 -36.134 15.347 -13.874 808 H LYS 99 H LYS 99 -35.746 13.210 -21.242 809 HA LYS 99 HA LYS 99 -36.943 15.815 -20.729 810 HB2 LYS 99 2HB LYS 99 -34.780 16.236 -21.895 811 HB3 LYS 99 1HB LYS 99 -35.294 15.194 -23.196 812 HG2 LYS 99 2HG LYS 99 -35.524 17.495 -23.851 813 HG3 LYS 99 1HG LYS 99 -37.124 16.773 -23.693 814 HD2 LYS 99 2HD LYS 99 -37.453 17.830 -21.563 815 HD3 LYS 99 1HD LYS 99 -35.784 18.400 -21.541 816 HE2 LYS 99 2HE LYS 99 -37.869 19.216 -23.562 817 HE3 LYS 99 1HE LYS 99 -37.411 20.169 -22.149 818 HZ1 LYS 99 3HZ LYS 99 -35.163 20.289 -23.034 819 HZ2 LYS 99 1HZ LYS 99 -36.269 20.935 -24.123 820 HZ3 LYS 99 2HZ LYS 99 -35.605 19.425 -24.403 821 H VAL 100 H VAL 100 -39.084 15.454 -21.201 822 HA VAL 100 HA VAL 100 -39.618 13.414 -23.204 823 HB VAL 100 HB VAL 100 -41.934 13.252 -22.326 824 HG11 VAL 100 1HG1 VAL 100 -41.385 12.117 -20.223 825 HG12 VAL 100 2HG1 VAL 100 -39.791 12.871 -20.245 826 HG13 VAL 100 3HG1 VAL 100 -40.242 11.727 -21.508 827 HG21 VAL 100 3HG2 VAL 100 -42.520 14.291 -20.172 828 HG22 VAL 100 1HG2 VAL 100 -42.177 15.509 -21.400 829 HG23 VAL 100 2HG2 VAL 100 -40.974 15.138 -20.167 830 H GLN 101 H GLN 101 -40.290 13.904 -25.100 831 HA GLN 101 HA GLN 101 -41.464 16.543 -25.546 832 HB2 GLN 101 2HB GLN 101 -39.243 16.405 -26.531 833 HB3 GLN 101 1HB GLN 101 -39.662 14.898 -27.330 834 HG2 GLN 101 2HG GLN 101 -41.271 16.042 -28.723 835 HG3 GLN 101 1HG GLN 101 -40.957 17.557 -27.887 836 HE21 GLN 101 1HE2 GLN 101 -39.055 18.632 -28.296 837 HE22 GLN 101 2HE2 GLN 101 -38.032 18.272 -29.640 838 H ILE 102 H ILE 102 -43.452 16.498 -26.333 839 HA ILE 102 HA ILE 102 -44.259 14.324 -27.975 840 HB ILE 102 HB ILE 102 -44.856 13.364 -25.857 841 HG12 ILE 102 2HG1 ILE 102 -47.321 13.132 -26.043 842 HG13 ILE 102 1HG1 ILE 102 -47.349 14.502 -27.145 843 HG21 ILE 102 1HG2 ILE 102 -44.813 15.287 -24.428 844 HG22 ILE 102 2HG2 ILE 102 -46.338 14.424 -24.217 845 HG23 ILE 102 3HG2 ILE 102 -46.288 15.912 -25.163 846 HD11 ILE 102 3HD1 ILE 102 -46.016 13.250 -28.749 847 HD12 ILE 102 1HD1 ILE 102 -47.493 12.381 -28.335 848 HD13 ILE 102 2HD1 ILE 102 -45.947 11.880 -27.642 849 H GLU 103 H GLU 103 -44.510 15.620 -29.607 850 HA GLU 103 HA GLU 103 -46.383 17.845 -29.341 851 HB2 GLU 103 2HB GLU 103 -44.267 17.252 -31.397 852 HB3 GLU 103 1HB GLU 103 -45.435 18.557 -31.545 853 HG2 GLU 103 2HG GLU 103 -44.579 19.602 -29.555 854 HG3 GLU 103 1HG GLU 103 -43.479 18.253 -29.285 855 H LEU 104 H LEU 104 -48.005 18.079 -30.847 856 HA LEU 104 HA LEU 104 -48.773 15.569 -32.127 857 HB2 LEU 104 2HB LEU 104 -50.520 17.874 -31.225 858 HB3 LEU 104 1HB LEU 104 -51.098 16.500 -32.130 859 HG LEU 104 HG LEU 104 -50.404 15.048 -30.175 860 HD11 LEU 104 1HD1 LEU 104 -50.161 16.086 -27.989 861 HD12 LEU 104 2HD1 LEU 104 -50.152 17.678 -28.743 862 HD13 LEU 104 3HD1 LEU 104 -48.846 16.539 -29.076 863 HD21 LEU 104 3HD2 LEU 104 -52.387 15.613 -28.854 864 HD22 LEU 104 1HD2 LEU 104 -52.711 15.628 -30.587 865 HD23 LEU 104 2HD2 LEU 104 -52.510 17.145 -29.716 866 H ASP 105 H ASP 105 -49.883 15.795 -34.197 867 HA ASP 105 HA ASP 105 -48.379 17.623 -35.855 868 HB2 ASP 105 2HB ASP 105 -50.544 15.643 -36.626 869 HB3 ASP 105 1HB ASP 105 -49.504 16.509 -37.741 870 H THR 106 H THR 106 -51.805 16.887 -35.371 871 HA THR 106 HA THR 106 -53.751 18.046 -35.641 872 HB THR 106 HB THR 106 -53.846 20.240 -34.547 873 HG1 THR 106 1HG THR 106 -51.139 20.112 -34.963 874 HG21 THR 106 3HG2 THR 106 -54.027 18.214 -33.214 875 HG22 THR 106 1HG2 THR 106 -53.161 19.452 -32.303 876 HG23 THR 106 2HG2 THR 106 -52.270 18.137 -33.063 877 H SER 107 H SER 107 -51.755 18.348 -37.900 878 HA SER 107 HA SER 107 -52.361 20.938 -38.987 879 HB2 SER 107 2HB SER 107 -50.830 20.081 -40.812 880 HB3 SER 107 1HB SER 107 -50.129 20.229 -39.197 881 HG SER 107 HG SER 107 -49.981 18.163 -40.608 882 H LEU 108 H LEU 108 -53.465 17.693 -39.315 883 HA LEU 108 HA LEU 108 -55.046 16.655 -40.588 884 HB2 LEU 108 2HB LEU 108 -55.945 19.475 -41.257 885 HB3 LEU 108 1HB LEU 108 -56.869 18.022 -41.572 886 HG LEU 108 HG LEU 108 -56.168 19.158 -38.872 887 HD11 LEU 108 1HD1 LEU 108 -58.582 19.506 -38.670 888 HD12 LEU 108 2HD1 LEU 108 -58.799 18.919 -40.317 889 HD13 LEU 108 3HD1 LEU 108 -57.898 20.403 -40.024 890 HD21 LEU 108 3HD2 LEU 108 -56.178 16.722 -38.771 891 HD22 LEU 108 1HD2 LEU 108 -57.749 16.684 -39.575 892 HD23 LEU 108 2HD2 LEU 108 -57.597 17.376 -37.959 893 H SER 109 H SER 109 -56.141 17.147 -43.086 894 HA SER 109 HA SER 109 -55.749 17.065 -45.305 895 HB2 SER 109 2HB SER 109 -53.386 18.837 -44.629 896 HB3 SER 109 1HB SER 109 -54.099 18.622 -46.229 897 HG SER 109 HG SER 109 -56.053 19.438 -45.372 898 H TYR 110 H TYR 110 -54.703 14.965 -43.687 899 HA TYR 110 HA TYR 110 -52.063 14.321 -44.689 900 HB2 TYR 110 2HB TYR 110 -53.963 12.580 -43.087 901 HB3 TYR 110 1HB TYR 110 -52.244 12.286 -43.345 902 HD1 TYR 110 1HD TYR 110 -50.653 14.204 -42.552 903 HD2 TYR 110 2HD TYR 110 -54.638 13.671 -41.175 904 HE1 TYR 110 1HE TYR 110 -50.149 15.567 -40.579 905 HE2 TYR 110 2HE TYR 110 -54.143 15.033 -39.200 906 HH TYR 110 HH TYR 110 -51.279 16.875 -39.058 907 H ILE 111 H ILE 111 -51.618 13.087 -46.356 908 HA ILE 111 HA ILE 111 -51.890 12.463 -48.428 909 HB ILE 111 HB ILE 111 -51.804 10.259 -47.433 910 HG12 ILE 111 2HG1 ILE 111 -53.872 10.338 -49.635 911 HG13 ILE 111 1HG1 ILE 111 -52.137 10.464 -49.857 912 HG21 ILE 111 1HG2 ILE 111 -53.779 8.919 -46.898 913 HG22 ILE 111 2HG2 ILE 111 -54.806 10.325 -47.186 914 HG23 ILE 111 3HG2 ILE 111 -53.645 10.343 -45.863 915 HD11 ILE 111 3HD1 ILE 111 -53.593 8.112 -48.720 916 HD12 ILE 111 1HD1 ILE 111 -51.853 8.261 -48.970 917 HD13 ILE 111 2HD1 ILE 111 -52.948 8.260 -50.367 Start of MODEL 9 1 H1 GLY -1 1HT GLY -1 0.302 -6.761 -29.256 2 H2 GLY -1 2HT GLY -1 0.109 -7.033 -27.591 3 H3 GLY -1 3HT GLY -1 1.131 -5.814 -28.123 4 HA2 GLY -1 1HA GLY -1 -0.720 -4.584 -29.004 5 HA3 GLY -1 2HA GLY -1 -1.800 -5.869 -28.477 6 H SER 0 H SER 0 -1.732 -3.038 -27.681 7 HA SER 0 HA SER 0 -0.955 -3.316 -24.903 8 HB2 SER 0 2HB SER 0 -1.101 -0.795 -24.904 9 HB3 SER 0 1HB SER 0 0.172 -1.500 -25.904 10 HG SER 0 HG SER 0 -2.017 -0.024 -26.603 11 H MET 1 H MET 1 -2.645 -4.268 -23.997 12 HA MET 1 HA MET 1 -5.317 -3.203 -24.377 13 HB2 MET 1 2HB MET 1 -4.294 -5.465 -22.660 14 HB3 MET 1 1HB MET 1 -5.987 -5.012 -22.797 15 HG2 MET 1 2HG MET 1 -5.937 -5.547 -25.171 16 HG3 MET 1 1HG MET 1 -4.233 -5.978 -25.043 17 HE1 MET 1 3HE MET 1 -4.775 -8.282 -26.199 18 HE2 MET 1 1HE MET 1 -6.482 -7.854 -26.292 19 HE3 MET 1 2HE MET 1 -5.997 -9.412 -25.622 20 H THR 2 H THR 2 -6.456 -2.094 -22.810 21 HA THR 2 HA THR 2 -4.803 -1.054 -20.654 22 HB THR 2 HB THR 2 -7.323 0.052 -21.883 23 HG1 THR 2 1HG THR 2 -4.855 -0.109 -22.722 24 HG21 THR 2 3HG2 THR 2 -6.905 0.822 -19.583 25 HG22 THR 2 1HG2 THR 2 -6.640 2.129 -20.737 26 HG23 THR 2 2HG2 THR 2 -5.262 1.283 -20.029 27 H VAL 3 H VAL 3 -5.215 -1.866 -18.740 28 HA VAL 3 HA VAL 3 -7.893 -2.960 -18.182 29 HB VAL 3 HB VAL 3 -5.358 -3.469 -16.621 30 HG11 VAL 3 1HG1 VAL 3 -7.367 -3.903 -15.384 31 HG12 VAL 3 2HG1 VAL 3 -6.541 -5.416 -15.847 32 HG13 VAL 3 3HG1 VAL 3 -7.973 -4.902 -16.721 33 HG21 VAL 3 3HG2 VAL 3 -6.527 -5.208 -18.781 34 HG22 VAL 3 1HG2 VAL 3 -5.239 -5.642 -17.657 35 HG23 VAL 3 2HG2 VAL 3 -4.973 -4.347 -18.833 36 H TYR 4 H TYR 4 -9.022 -2.137 -16.407 37 HA TYR 4 HA TYR 4 -7.769 0.139 -15.100 38 HB2 TYR 4 2HB TYR 4 -10.689 -0.604 -15.382 39 HB3 TYR 4 1HB TYR 4 -10.053 0.880 -14.669 40 HD1 TYR 4 1HD TYR 4 -9.101 2.628 -16.070 41 HD2 TYR 4 2HD TYR 4 -10.643 -0.930 -17.800 42 HE1 TYR 4 1HE TYR 4 -9.041 3.681 -18.287 43 HE2 TYR 4 2HE TYR 4 -10.589 0.116 -20.018 44 HH TYR 4 HH TYR 4 -10.580 2.335 -21.003 45 H ILE 5 H ILE 5 -7.381 0.073 -12.983 46 HA ILE 5 HA ILE 5 -8.295 -2.293 -11.430 47 HB ILE 5 HB ILE 5 -5.889 -0.557 -10.818 48 HG12 ILE 5 2HG1 ILE 5 -4.429 -2.289 -11.335 49 HG13 ILE 5 1HG1 ILE 5 -5.619 -3.429 -11.842 50 HG21 ILE 5 1HG2 ILE 5 -6.834 -1.572 -8.874 51 HG22 ILE 5 2HG2 ILE 5 -5.268 -2.293 -9.215 52 HG23 ILE 5 3HG2 ILE 5 -6.743 -3.165 -9.615 53 HD11 ILE 5 3HD1 ILE 5 -4.684 -0.907 -13.258 54 HD12 ILE 5 1HD1 ILE 5 -6.080 -1.839 -13.792 55 HD13 ILE 5 2HD1 ILE 5 -4.482 -2.577 -13.794 56 H CYS 6 H CYS 6 -9.859 -1.644 -10.043 57 HA CYS 6 HA CYS 6 -9.196 0.654 -8.395 58 HB2 CYS 6 2HB CYS 6 -11.169 1.256 -9.835 59 HB3 CYS 6 1HB CYS 6 -12.030 -0.099 -9.127 60 HG CYS 6 HG CYS 6 -10.843 2.434 -7.106 61 HA PRO 7 HA PRO 7 -9.319 -3.076 -5.770 62 HB2 PRO 7 2HB PRO 7 -7.836 -1.297 -3.938 63 HB3 PRO 7 1HB PRO 7 -7.379 -2.888 -4.555 64 HG2 PRO 7 2HG PRO 7 -6.143 -0.662 -5.391 65 HG3 PRO 7 1HG PRO 7 -6.466 -2.010 -6.495 66 HD2 PRO 7 2HD PRO 7 -7.933 0.578 -6.182 67 HD3 PRO 7 1HD PRO 7 -7.462 -0.285 -7.670 68 H GLU 8 H GLU 8 -10.505 -0.001 -5.444 69 HA GLU 8 HA GLU 8 -11.406 -0.049 -2.710 70 HB2 GLU 8 2HB GLU 8 -12.209 1.804 -4.916 71 HB3 GLU 8 1HB GLU 8 -12.260 2.098 -3.182 72 HG2 GLU 8 2HG GLU 8 -9.831 2.014 -3.088 73 HG3 GLU 8 1HG GLU 8 -9.851 1.611 -4.816 74 H THR 9 H THR 9 -12.951 -0.078 -5.909 75 HA THR 9 HA THR 9 -15.350 -1.158 -4.646 76 HB THR 9 HB THR 9 -15.743 1.175 -4.861 77 HG1 THR 9 1HG THR 9 -17.071 -0.500 -6.630 78 HG21 THR 9 3HG2 THR 9 -14.066 1.732 -6.505 79 HG22 THR 9 1HG2 THR 9 -15.627 2.373 -7.029 80 HG23 THR 9 2HG2 THR 9 -14.973 0.906 -7.767 81 H GLY 10 H GLY 10 -13.020 -1.760 -6.916 82 HA2 GLY 10 2HA GLY 10 -14.938 -3.165 -8.583 83 HA3 GLY 10 1HA GLY 10 -13.275 -2.919 -9.058 84 H ASP 11 H ASP 11 -12.824 -5.124 -9.300 85 HA ASP 11 HA ASP 11 -12.118 -6.602 -7.017 86 HB2 ASP 11 2HB ASP 11 -14.572 -6.877 -6.820 87 HB3 ASP 11 1HB ASP 11 -14.593 -7.589 -8.432 88 H ASP 12 H ASP 12 -11.058 -8.530 -7.579 89 HA ASP 12 HA ASP 12 -9.918 -8.371 -10.215 90 HB2 ASP 12 2HB ASP 12 -8.379 -10.105 -9.477 91 HB3 ASP 12 1HB ASP 12 -8.480 -8.812 -8.285 92 H GLY 13 H GLY 13 -12.693 -9.823 -9.188 93 HA2 GLY 13 2HA GLY 13 -12.446 -12.091 -10.999 94 HA3 GLY 13 1HA GLY 13 -13.821 -11.713 -9.965 95 H ASN 14 H ASN 14 -13.154 -8.847 -11.194 96 HA ASN 14 HA ASN 14 -15.272 -8.826 -13.054 97 HB2 ASN 14 2HB ASN 14 -13.177 -6.813 -12.280 98 HB3 ASN 14 1HB ASN 14 -14.513 -6.469 -13.366 99 HD21 ASN 14 1HD2 ASN 14 -15.165 -4.874 -11.877 100 HD22 ASN 14 2HD2 ASN 14 -15.993 -5.335 -10.431 101 H ASP 15 H ASP 15 -14.771 -7.477 -15.164 102 HA ASP 15 HA ASP 15 -13.011 -9.137 -16.774 103 HB2 ASP 15 2HB ASP 15 -14.810 -6.851 -17.606 104 HB3 ASP 15 1HB ASP 15 -14.006 -7.985 -18.679 105 H GLY 16 H GLY 16 -12.743 -6.310 -15.059 106 HA2 GLY 16 2HA GLY 16 -11.036 -4.804 -14.885 107 HA3 GLY 16 1HA GLY 16 -10.224 -5.652 -16.196 108 H SER 17 H SER 17 -13.420 -4.503 -16.589 109 HA SER 17 HA SER 17 -12.669 -2.717 -18.714 110 HB2 SER 17 2HB SER 17 -15.358 -3.105 -17.375 111 HB3 SER 17 1HB SER 17 -15.046 -2.478 -18.996 112 HG SER 17 HG SER 17 -13.988 -4.665 -19.305 113 H GLU 18 H GLU 18 -13.855 -0.335 -18.509 114 HA GLU 18 HA GLU 18 -12.642 0.870 -16.333 115 HB2 GLU 18 2HB GLU 18 -13.040 2.037 -18.453 116 HB3 GLU 18 1HB GLU 18 -14.774 1.930 -18.192 117 HG2 GLU 18 2HG GLU 18 -14.557 3.318 -16.203 118 HG3 GLU 18 1HG GLU 18 -12.818 3.378 -16.523 119 H LEU 19 H LEU 19 -15.991 -0.073 -17.008 120 HA LEU 19 HA LEU 19 -16.889 0.895 -14.441 121 HB2 LEU 19 2HB LEU 19 -18.339 -0.498 -16.638 122 HB3 LEU 19 1HB LEU 19 -19.084 -0.008 -15.122 123 HG LEU 19 HG LEU 19 -17.879 1.802 -17.209 124 HD11 LEU 19 1HD1 LEU 19 -20.599 1.390 -16.166 125 HD12 LEU 19 2HD1 LEU 19 -20.009 0.852 -17.749 126 HD13 LEU 19 3HD1 LEU 19 -20.158 2.598 -17.397 127 HD21 LEU 19 3HD2 LEU 19 -17.420 2.730 -15.010 128 HD22 LEU 19 1HD2 LEU 19 -19.102 2.482 -14.529 129 HD23 LEU 19 2HD2 LEU 19 -18.697 3.640 -15.794 130 H LYS 20 H LYS 20 -15.226 -1.736 -15.314 131 HA LYS 20 HA LYS 20 -16.110 -3.209 -12.941 132 HB2 LYS 20 2HB LYS 20 -15.455 -4.661 -15.519 133 HB3 LYS 20 1HB LYS 20 -15.938 -5.342 -14.003 134 HG2 LYS 20 2HG LYS 20 -18.169 -4.332 -14.183 135 HG3 LYS 20 1HG LYS 20 -17.736 -3.722 -15.783 136 HD2 LYS 20 2HD LYS 20 -17.385 -5.989 -16.574 137 HD3 LYS 20 1HD LYS 20 -17.734 -6.624 -14.971 138 HE2 LYS 20 2HE LYS 20 -20.011 -5.639 -15.138 139 HE3 LYS 20 1HE LYS 20 -19.625 -5.143 -16.779 140 HZ1 LYS 20 3HZ LYS 20 -19.295 -7.476 -17.358 141 HZ2 LYS 20 1HZ LYS 20 -20.847 -7.192 -16.768 142 HZ3 LYS 20 2HZ LYS 20 -19.701 -7.930 -15.785 143 HA PRO 21 HA PRO 21 -11.604 -2.543 -13.482 144 HB2 PRO 21 2HB PRO 21 -11.649 -1.386 -10.825 145 HB3 PRO 21 1HB PRO 21 -11.122 -0.653 -12.342 146 HG2 PRO 21 2HG PRO 21 -13.362 0.125 -11.009 147 HG3 PRO 21 1HG PRO 21 -13.169 0.253 -12.766 148 HD2 PRO 21 2HD PRO 21 -14.685 -1.802 -11.193 149 HD3 PRO 21 1HD PRO 21 -15.064 -1.030 -12.737 150 H LEU 22 H LEU 22 -10.000 -3.667 -12.534 151 HA LEU 22 HA LEU 22 -10.766 -5.946 -10.919 152 HB2 LEU 22 2HB LEU 22 -8.074 -5.060 -11.921 153 HB3 LEU 22 1HB LEU 22 -8.449 -6.617 -11.216 154 HG LEU 22 HG LEU 22 -9.565 -5.559 -13.794 155 HD11 LEU 22 1HD1 LEU 22 -8.174 -7.272 -14.815 156 HD12 LEU 22 2HD1 LEU 22 -7.467 -7.613 -13.228 157 HD13 LEU 22 3HD1 LEU 22 -7.243 -6.038 -13.977 158 HD21 LEU 22 3HD2 LEU 22 -9.850 -8.248 -12.474 159 HD22 LEU 22 1HD2 LEU 22 -10.418 -7.834 -14.090 160 HD23 LEU 22 2HD2 LEU 22 -11.121 -7.047 -12.680 161 H ARG 23 H ARG 23 -9.543 -6.478 -8.935 162 HA ARG 23 HA ARG 23 -9.053 -3.980 -7.516 163 HB2 ARG 23 2HB ARG 23 -9.491 -5.112 -5.430 164 HB3 ARG 23 1HB ARG 23 -10.711 -5.526 -6.557 165 HG2 ARG 23 2HG ARG 23 -9.861 -7.703 -6.883 166 HG3 ARG 23 1HG ARG 23 -8.359 -7.288 -6.073 167 HD2 ARG 23 2HD ARG 23 -9.840 -8.632 -4.656 168 HD3 ARG 23 1HD ARG 23 -9.466 -7.069 -3.948 169 HE ARG 23 HE ARG 23 -12.048 -7.858 -5.163 170 HH11 ARG 23 1HH1 ARG 23 -10.187 -5.697 -3.043 171 HH12 ARG 23 2HH1 ARG 23 -11.555 -5.002 -2.320 172 HH21 ARG 23 1HH2 ARG 23 -13.922 -6.917 -4.160 173 HH22 ARG 23 2HH2 ARG 23 -13.727 -5.724 -2.965 174 H THR 24 H THR 24 -7.338 -6.309 -9.089 175 HA THR 24 HA THR 24 -4.968 -5.682 -7.530 176 HB THR 24 HB THR 24 -4.108 -7.974 -8.100 177 HG1 THR 24 1HG THR 24 -5.954 -9.520 -8.474 178 HG21 THR 24 3HG2 THR 24 -5.331 -9.161 -6.322 179 HG22 THR 24 1HG2 THR 24 -6.591 -7.932 -6.377 180 HG23 THR 24 2HG2 THR 24 -4.968 -7.503 -5.843 181 H LEU 25 H LEU 25 -3.139 -5.398 -8.708 182 HA LEU 25 HA LEU 25 -3.423 -4.769 -11.492 183 HB2 LEU 25 2HB LEU 25 -2.031 -3.467 -9.899 184 HB3 LEU 25 1HB LEU 25 -1.010 -4.862 -9.680 185 HG LEU 25 HG LEU 25 -0.209 -4.685 -11.972 186 HD11 LEU 25 1HD1 LEU 25 -2.250 -3.806 -13.017 187 HD12 LEU 25 2HD1 LEU 25 -0.860 -2.788 -13.371 188 HD13 LEU 25 3HD1 LEU 25 -2.033 -2.276 -12.161 189 HD21 LEU 25 3HD2 LEU 25 0.966 -2.526 -11.729 190 HD22 LEU 25 1HD2 LEU 25 0.925 -3.448 -10.225 191 HD23 LEU 25 2HD2 LEU 25 -0.175 -2.092 -10.459 192 H TYR 26 H TYR 26 -2.419 -7.331 -9.497 193 HA TYR 26 HA TYR 26 -0.935 -8.985 -11.156 194 HB2 TYR 26 2HB TYR 26 -1.187 -9.378 -8.771 195 HB3 TYR 26 1HB TYR 26 -2.914 -9.625 -8.963 196 HD1 TYR 26 1HD TYR 26 0.384 -11.040 -9.960 197 HD2 TYR 26 2HD TYR 26 -3.743 -11.784 -9.270 198 HE1 TYR 26 1HE TYR 26 0.763 -13.420 -10.224 199 HE2 TYR 26 2HE TYR 26 -3.345 -14.187 -9.522 200 HH TYR 26 HH TYR 26 -1.680 -15.634 -10.663 201 H GLN 27 H GLN 27 -4.509 -8.882 -10.689 202 HA GLN 27 HA GLN 27 -5.043 -10.878 -12.612 203 HB2 GLN 27 2HB GLN 27 -6.701 -10.318 -10.933 204 HB3 GLN 27 1HB GLN 27 -6.827 -8.678 -11.530 205 HG2 GLN 27 2HG GLN 27 -8.769 -10.002 -12.199 206 HG3 GLN 27 1HG GLN 27 -7.865 -9.519 -13.612 207 HE21 GLN 27 1HE2 GLN 27 -8.726 -11.127 -14.831 208 HE22 GLN 27 2HE2 GLN 27 -8.309 -12.776 -14.700 209 H ALA 28 H ALA 28 -4.542 -7.409 -12.889 210 HA ALA 28 HA ALA 28 -5.481 -7.045 -15.466 211 HB1 ALA 28 1HB ALA 28 -4.882 -5.212 -13.912 212 HB2 ALA 28 2HB ALA 28 -4.093 -5.035 -15.479 213 HB3 ALA 28 3HB ALA 28 -3.182 -5.637 -14.095 214 H MET 29 H MET 29 -2.274 -8.066 -14.279 215 HA MET 29 HA MET 29 -1.311 -8.376 -16.886 216 HB2 MET 29 2HB MET 29 -0.278 -9.104 -14.212 217 HB3 MET 29 1HB MET 29 0.466 -9.811 -15.631 218 HG2 MET 29 2HG MET 29 0.803 -7.442 -16.482 219 HG3 MET 29 1HG MET 29 0.281 -6.880 -14.906 220 HE1 MET 29 3HE MET 29 4.117 -6.302 -15.070 221 HE2 MET 29 1HE MET 29 2.525 -5.545 -14.939 222 HE3 MET 29 2HE MET 29 3.020 -6.286 -16.454 223 H ILE 30 H ILE 30 -2.990 -10.514 -14.719 224 HA ILE 30 HA ILE 30 -2.455 -12.928 -16.051 225 HB ILE 30 HB ILE 30 -5.042 -12.133 -14.674 226 HG12 ILE 30 2HG1 ILE 30 -2.642 -13.649 -13.618 227 HG13 ILE 30 1HG1 ILE 30 -3.147 -12.029 -13.147 228 HG21 ILE 30 1HG2 ILE 30 -5.489 -14.536 -14.480 229 HG22 ILE 30 2HG2 ILE 30 -4.025 -14.875 -15.397 230 HG23 ILE 30 3HG2 ILE 30 -5.375 -14.037 -16.170 231 HD11 ILE 30 3HD1 ILE 30 -5.200 -12.960 -12.205 232 HD12 ILE 30 1HD1 ILE 30 -3.755 -13.660 -11.486 233 HD13 ILE 30 2HD1 ILE 30 -4.673 -14.575 -12.685 234 H ILE 31 H ILE 31 -5.012 -10.577 -16.555 235 HA ILE 31 HA ILE 31 -6.292 -11.943 -18.641 236 HB ILE 31 HB ILE 31 -6.311 -8.976 -18.067 237 HG12 ILE 31 2HG1 ILE 31 -8.137 -11.199 -17.145 238 HG13 ILE 31 1HG1 ILE 31 -7.003 -10.308 -16.139 239 HG21 ILE 31 1HG2 ILE 31 -7.113 -9.599 -20.302 240 HG22 ILE 31 2HG2 ILE 31 -8.431 -9.005 -19.258 241 HG23 ILE 31 3HG2 ILE 31 -8.230 -10.740 -19.511 242 HD11 ILE 31 3HD1 ILE 31 -8.262 -8.262 -16.578 243 HD12 ILE 31 1HD1 ILE 31 -9.247 -9.515 -15.808 244 HD13 ILE 31 2HD1 ILE 31 -9.398 -9.203 -17.548 245 H THR 32 H THR 32 -3.791 -9.373 -18.657 246 HA THR 32 HA THR 32 -3.959 -9.083 -21.482 247 HB THR 32 HB THR 32 -2.025 -7.539 -21.159 248 HG1 THR 32 1HG THR 32 -2.419 -7.624 -18.414 249 HG21 THR 32 3HG2 THR 32 -4.350 -7.059 -19.267 250 HG22 THR 32 1HG2 THR 32 -4.388 -6.746 -20.998 251 HG23 THR 32 2HG2 THR 32 -3.311 -5.831 -19.947 252 H LYS 33 H LYS 33 -1.778 -10.641 -19.183 253 HA LYS 33 HA LYS 33 -0.065 -12.096 -19.394 254 HB2 LYS 33 2HB LYS 33 -1.383 -12.632 -22.060 255 HB3 LYS 33 1HB LYS 33 -0.102 -13.626 -21.391 256 HG2 LYS 33 2HG LYS 33 -1.537 -14.208 -19.501 257 HG3 LYS 33 1HG LYS 33 -2.815 -13.185 -20.148 258 HD2 LYS 33 2HD LYS 33 -1.639 -15.574 -21.578 259 HD3 LYS 33 1HD LYS 33 -3.129 -15.605 -20.638 260 HE2 LYS 33 2HE LYS 33 -2.627 -13.885 -23.076 261 HE3 LYS 33 1HE LYS 33 -3.523 -15.395 -23.059 262 HZ1 LYS 33 3HZ LYS 33 -5.123 -14.419 -21.580 263 HZ2 LYS 33 1HZ LYS 33 -5.001 -13.525 -22.984 264 HZ3 LYS 33 2HZ LYS 33 -4.312 -12.937 -21.556 265 H SER 34 H SER 34 0.023 -9.327 -20.586 266 HA SER 34 HA SER 34 2.053 -9.703 -22.657 267 HB2 SER 34 2HB SER 34 0.557 -7.209 -21.872 268 HB3 SER 34 1HB SER 34 1.651 -7.370 -23.249 269 HG SER 34 HG SER 34 -0.426 -9.214 -22.994 270 H SER 35 H SER 35 1.886 -8.769 -19.328 271 HA SER 35 HA SER 35 3.447 -8.026 -17.824 272 HB2 SER 35 2HB SER 35 4.863 -9.838 -18.706 273 HB3 SER 35 1HB SER 35 5.387 -8.821 -20.038 274 HG SER 35 HG SER 35 6.140 -7.385 -18.286 275 H LYS 36 H LYS 36 2.306 -6.144 -20.017 276 HA LYS 36 HA LYS 36 3.596 -3.814 -19.396 277 HB2 LYS 36 2HB LYS 36 4.497 -3.303 -21.628 278 HB3 LYS 36 1HB LYS 36 5.354 -4.670 -20.933 279 HG2 LYS 36 2HG LYS 36 3.972 -6.199 -22.291 280 HG3 LYS 36 1HG LYS 36 3.169 -4.808 -23.011 281 HD2 LYS 36 2HD LYS 36 6.119 -5.432 -23.199 282 HD3 LYS 36 1HD LYS 36 4.920 -5.727 -24.457 283 HE2 LYS 36 2HE LYS 36 4.465 -3.300 -24.547 284 HE3 LYS 36 1HE LYS 36 5.706 -3.044 -23.321 285 HZ1 LYS 36 3HZ LYS 36 6.585 -2.652 -25.530 286 HZ2 LYS 36 1HZ LYS 36 6.112 -4.199 -26.004 287 HZ3 LYS 36 2HZ LYS 36 7.325 -4.021 -24.851 288 H GLY 37 H GLY 37 2.563 -2.210 -20.778 289 HA2 GLY 37 2HA GLY 37 0.783 -2.021 -22.614 290 HA3 GLY 37 1HA GLY 37 -0.142 -3.088 -21.560 291 H ASP 38 H ASP 38 -1.766 -1.474 -21.382 292 HA ASP 38 HA ASP 38 -0.911 0.821 -19.802 293 HB2 ASP 38 2HB ASP 38 -3.408 0.460 -21.472 294 HB3 ASP 38 1HB ASP 38 -3.126 1.819 -20.400 295 H PHE 39 H PHE 39 -1.179 0.544 -17.769 296 HA PHE 39 HA PHE 39 -3.531 -0.934 -16.875 297 HB2 PHE 39 2HB PHE 39 -0.809 -0.773 -15.552 298 HB3 PHE 39 1HB PHE 39 -2.216 -1.616 -14.909 299 HD1 PHE 39 1HD PHE 39 -3.184 -3.496 -16.310 300 HD2 PHE 39 2HD PHE 39 0.689 -1.896 -16.978 301 HE1 PHE 39 1HE PHE 39 -2.551 -5.541 -17.539 302 HE2 PHE 39 2HE PHE 39 1.323 -3.916 -18.203 303 HZ PHE 39 HZ PHE 39 -0.292 -5.749 -18.484 304 H LEU 40 H LEU 40 -4.915 0.433 -16.056 305 HA LEU 40 HA LEU 40 -3.832 2.922 -14.928 306 HB2 LEU 40 2HB LEU 40 -6.547 2.589 -16.233 307 HB3 LEU 40 1HB LEU 40 -5.790 4.027 -15.577 308 HG LEU 40 HG LEU 40 -4.802 2.555 -18.008 309 HD11 LEU 40 1HD1 LEU 40 -6.330 5.141 -17.773 310 HD12 LEU 40 2HD1 LEU 40 -6.920 3.620 -18.449 311 HD13 LEU 40 3HD1 LEU 40 -5.623 4.496 -19.257 312 HD21 LEU 40 3HD2 LEU 40 -3.002 3.680 -16.849 313 HD22 LEU 40 1HD2 LEU 40 -3.947 5.172 -16.772 314 HD23 LEU 40 2HD2 LEU 40 -3.404 4.550 -18.327 315 H ILE 41 H ILE 41 -4.210 3.250 -12.901 316 HA ILE 41 HA ILE 41 -6.254 1.613 -11.619 317 HB ILE 41 HB ILE 41 -3.735 2.795 -10.392 318 HG12 ILE 41 2HG1 ILE 41 -4.354 0.044 -11.534 319 HG13 ILE 41 1HG1 ILE 41 -3.066 1.133 -11.905 320 HG21 ILE 41 1HG2 ILE 41 -5.775 0.874 -9.265 321 HG22 ILE 41 2HG2 ILE 41 -5.561 2.555 -8.797 322 HG23 ILE 41 3HG2 ILE 41 -4.288 1.378 -8.446 323 HD11 ILE 41 3HD1 ILE 41 -1.945 0.651 -9.840 324 HD12 ILE 41 1HD1 ILE 41 -2.420 -0.859 -10.688 325 HD13 ILE 41 2HD1 ILE 41 -3.344 -0.313 -9.316 326 H ARG 42 H ARG 42 -7.759 2.568 -10.325 327 HA ARG 42 HA ARG 42 -8.492 5.193 -10.848 328 HB2 ARG 42 2HB ARG 42 -9.999 3.315 -10.091 329 HB3 ARG 42 1HB ARG 42 -9.343 3.526 -8.471 330 HG2 ARG 42 2HG ARG 42 -11.332 4.771 -8.466 331 HG3 ARG 42 1HG ARG 42 -10.044 5.953 -8.687 332 HD2 ARG 42 2HD ARG 42 -11.474 6.633 -10.365 333 HD3 ARG 42 1HD ARG 42 -10.487 5.500 -11.222 334 HE ARG 42 HE ARG 42 -12.463 3.913 -10.342 335 HH11 ARG 42 1HH1 ARG 42 -12.431 6.959 -12.219 336 HH12 ARG 42 2HH1 ARG 42 -13.770 6.539 -13.147 337 HH21 ARG 42 1HH2 ARG 42 -14.385 3.375 -11.681 338 HH22 ARG 42 2HH2 ARG 42 -14.852 4.497 -12.866 339 H THR 43 H THR 43 -7.907 7.024 -9.936 340 HA THR 43 HA THR 43 -6.693 7.005 -7.306 341 HB THR 43 HB THR 43 -4.929 7.143 -9.095 342 HG1 THR 43 1HG THR 43 -3.951 9.089 -8.134 343 HG21 THR 43 3HG2 THR 43 -6.233 9.798 -9.663 344 HG22 THR 43 1HG2 THR 43 -6.127 8.423 -10.770 345 HG23 THR 43 2HG2 THR 43 -4.666 9.294 -10.284 346 H LYS 44 H LYS 44 -6.897 9.106 -6.239 347 HA LYS 44 HA LYS 44 -9.238 10.604 -7.226 348 HB2 LYS 44 2HB LYS 44 -7.965 10.734 -4.488 349 HB3 LYS 44 1HB LYS 44 -9.524 11.378 -4.972 350 HG2 LYS 44 2HG LYS 44 -8.768 8.506 -4.764 351 HG3 LYS 44 1HG LYS 44 -9.744 9.412 -3.599 352 HD2 LYS 44 2HD LYS 44 -11.461 9.719 -5.302 353 HD3 LYS 44 1HD LYS 44 -10.453 8.854 -6.475 354 HE2 LYS 44 2HE LYS 44 -11.580 7.733 -3.917 355 HE3 LYS 44 1HE LYS 44 -12.117 7.355 -5.554 356 HZ1 LYS 44 3HZ LYS 44 -10.579 5.679 -4.610 357 HZ2 LYS 44 1HZ LYS 44 -9.385 6.823 -4.517 358 HZ3 LYS 44 2HZ LYS 44 -9.971 6.324 -6.006 359 H LYS 45 H LYS 45 -8.665 12.370 -8.161 360 HA LYS 45 HA LYS 45 -6.269 13.739 -7.207 361 HB2 LYS 45 2HB LYS 45 -5.755 12.358 -9.281 362 HB3 LYS 45 1HB LYS 45 -6.978 13.282 -10.095 363 HG2 LYS 45 2HG LYS 45 -5.694 15.237 -10.038 364 HG3 LYS 45 1HG LYS 45 -4.566 14.533 -8.873 365 HD2 LYS 45 2HD LYS 45 -5.068 13.351 -11.548 366 HD3 LYS 45 1HD LYS 45 -3.765 14.550 -11.307 367 HE2 LYS 45 2HE LYS 45 -2.817 12.952 -9.594 368 HE3 LYS 45 1HE LYS 45 -4.075 11.802 -10.013 369 HZ1 LYS 45 3HZ LYS 45 -2.047 11.256 -11.122 370 HZ2 LYS 45 1HZ LYS 45 -1.933 12.789 -11.818 371 HZ3 LYS 45 2HZ LYS 45 -3.164 11.724 -12.279 372 H ASP 46 H ASP 46 -7.047 15.463 -6.380 373 HA ASP 46 HA ASP 46 -8.076 17.394 -6.014 374 HB2 ASP 46 2HB ASP 46 -8.170 17.500 -9.024 375 HB3 ASP 46 1HB ASP 46 -8.709 18.831 -8.003 376 H GLY 47 H GLY 47 -9.602 15.077 -5.892 377 HA2 GLY 47 2HA GLY 47 -11.745 14.837 -5.040 378 HA3 GLY 47 1HA GLY 47 -12.191 16.368 -5.772 379 H LYS 48 H LYS 48 -10.621 14.429 -7.976 380 HA LYS 48 HA LYS 48 -13.202 13.431 -8.961 381 HB2 LYS 48 2HB LYS 48 -10.760 14.214 -10.548 382 HB3 LYS 48 1HB LYS 48 -12.226 13.523 -11.215 383 HG2 LYS 48 2HG LYS 48 -13.476 15.496 -10.460 384 HG3 LYS 48 1HG LYS 48 -11.970 16.183 -9.846 385 HD2 LYS 48 2HD LYS 48 -11.020 16.118 -12.090 386 HD3 LYS 48 1HD LYS 48 -12.519 15.422 -12.707 387 HE2 LYS 48 2HE LYS 48 -13.725 17.435 -11.974 388 HE3 LYS 48 1HE LYS 48 -12.199 18.120 -11.420 389 HZ1 LYS 48 3HZ LYS 48 -12.839 17.400 -14.224 390 HZ2 LYS 48 1HZ LYS 48 -11.383 18.082 -13.678 391 HZ3 LYS 48 2HZ LYS 48 -12.821 18.946 -13.574 392 H GLN 49 H GLN 49 -13.323 11.309 -9.505 393 HA GLN 49 HA GLN 49 -11.032 9.675 -8.818 394 HB2 GLN 49 2HB GLN 49 -13.788 8.887 -9.825 395 HB3 GLN 49 1HB GLN 49 -12.556 7.792 -9.234 396 HG2 GLN 49 2HG GLN 49 -12.686 8.795 -7.028 397 HG3 GLN 49 1HG GLN 49 -13.918 9.909 -7.606 398 HE21 GLN 49 1HE2 GLN 49 -15.986 9.149 -7.982 399 HE22 GLN 49 2HE2 GLN 49 -16.534 7.616 -7.430 400 H VAL 50 H VAL 50 -9.589 9.190 -10.331 401 HA VAL 50 HA VAL 50 -10.446 9.124 -13.109 402 HB VAL 50 HB VAL 50 -8.451 10.431 -13.829 403 HG11 VAL 50 1HG1 VAL 50 -9.269 12.663 -13.216 404 HG12 VAL 50 2HG1 VAL 50 -10.282 11.941 -11.966 405 HG13 VAL 50 3HG1 VAL 50 -10.585 11.576 -13.664 406 HG21 VAL 50 3HG2 VAL 50 -7.232 11.806 -12.198 407 HG22 VAL 50 1HG2 VAL 50 -7.030 10.085 -11.875 408 HG23 VAL 50 2HG2 VAL 50 -8.138 11.040 -10.892 409 H TRP 51 H TRP 51 -8.493 8.392 -14.461 410 HA TRP 51 HA TRP 51 -7.444 6.056 -13.121 411 HB2 TRP 51 2HB TRP 51 -7.806 6.756 -16.024 412 HB3 TRP 51 1HB TRP 51 -7.105 5.257 -15.513 413 HD1 TRP 51 HD TRP 51 -10.159 6.667 -16.487 414 HE1 TRP 51 1HE TRP 51 -12.199 5.179 -15.792 415 HE3 TRP 51 3HE TRP 51 -7.803 3.673 -13.171 416 HZ2 TRP 51 2HZ TRP 51 -12.652 3.014 -14.027 417 HZ3 TRP 51 3HZ TRP 51 -9.066 1.919 -12.024 418 HH2 TRP 51 HH TRP 51 -11.437 1.592 -12.438 419 H GLU 52 H GLU 52 -5.324 5.735 -12.878 420 HA GLU 52 HA GLU 52 -3.482 7.583 -14.175 421 HB2 GLU 52 2HB GLU 52 -3.850 8.335 -11.899 422 HB3 GLU 52 1HB GLU 52 -3.472 6.737 -11.280 423 HG2 GLU 52 2HG GLU 52 -1.205 6.954 -12.068 424 HG3 GLU 52 1HG GLU 52 -1.586 8.531 -12.761 425 H ALA 53 H ALA 53 -1.660 6.654 -14.904 426 HA ALA 53 HA ALA 53 -1.677 3.859 -15.316 427 HB1 ALA 53 1HB ALA 53 0.561 5.812 -15.821 428 HB2 ALA 53 2HB ALA 53 -0.748 5.445 -16.941 429 HB3 ALA 53 3HB ALA 53 0.412 4.195 -16.499 430 H ALA 54 H ALA 54 -0.499 2.273 -14.538 431 HA ALA 54 HA ALA 54 0.591 2.408 -11.929 432 HB1 ALA 54 1HB ALA 54 0.796 0.208 -13.985 433 HB2 ALA 54 2HB ALA 54 -0.503 0.398 -12.809 434 HB3 ALA 54 3HB ALA 54 1.135 0.049 -12.261 435 H SER 55 H SER 55 2.868 0.992 -11.831 436 HA SER 55 HA SER 55 4.800 2.568 -13.354 437 HB2 SER 55 2HB SER 55 4.666 3.455 -11.075 438 HB3 SER 55 1HB SER 55 4.829 1.827 -10.421 439 HG SER 55 HG SER 55 6.724 3.567 -11.202 440 H LYS 56 H LYS 56 6.775 1.436 -13.741 441 HA LYS 56 HA LYS 56 6.438 -1.265 -14.417 442 HB2 LYS 56 2HB LYS 56 9.019 0.252 -14.064 443 HB3 LYS 56 1HB LYS 56 8.881 -1.319 -14.842 444 HG2 LYS 56 2HG LYS 56 7.396 -0.273 -16.544 445 HG3 LYS 56 1HG LYS 56 7.718 1.294 -15.800 446 HD2 LYS 56 2HD LYS 56 9.777 -0.560 -17.005 447 HD3 LYS 56 1HD LYS 56 9.158 0.911 -17.751 448 HE2 LYS 56 2HE LYS 56 10.739 0.753 -15.169 449 HE3 LYS 56 1HE LYS 56 11.367 1.256 -16.729 450 HZ1 LYS 56 3HZ LYS 56 10.831 3.167 -15.368 451 HZ2 LYS 56 1HZ LYS 56 9.226 2.666 -15.216 452 HZ3 LYS 56 2HZ LYS 56 9.822 3.109 -16.711 453 H THR 57 H THR 57 7.690 0.232 -11.540 454 HA THR 57 HA THR 57 8.855 -2.120 -10.496 455 HB THR 57 HB THR 57 8.857 -0.811 -8.322 456 HG1 THR 57 1HG THR 57 8.216 1.500 -9.760 457 HG21 THR 57 3HG2 THR 57 9.987 0.535 -10.784 458 HG22 THR 57 1HG2 THR 57 10.747 -0.775 -9.884 459 HG23 THR 57 2HG2 THR 57 10.537 0.806 -9.131 460 H ALA 58 H ALA 58 5.682 -0.669 -10.248 461 HA ALA 58 HA ALA 58 4.701 -2.571 -8.321 462 HB1 ALA 58 1HB ALA 58 3.162 -0.760 -10.196 463 HB2 ALA 58 2HB ALA 58 3.648 -0.348 -8.550 464 HB3 ALA 58 3HB ALA 58 2.485 -1.642 -8.830 465 H LEU 59 H LEU 59 4.627 -2.227 -11.802 466 HA LEU 59 HA LEU 59 3.012 -4.424 -12.380 467 HB2 LEU 59 2HB LEU 59 5.211 -3.095 -13.954 468 HB3 LEU 59 1HB LEU 59 4.086 -4.313 -14.607 469 HG LEU 59 HG LEU 59 3.341 -1.574 -13.566 470 HD11 LEU 59 1HD1 LEU 59 4.656 -1.445 -15.628 471 HD12 LEU 59 2HD1 LEU 59 2.968 -1.023 -15.919 472 HD13 LEU 59 3HD1 LEU 59 3.571 -2.609 -16.389 473 HD21 LEU 59 3HD2 LEU 59 1.188 -2.025 -14.511 474 HD22 LEU 59 1HD2 LEU 59 1.578 -3.342 -13.390 475 HD23 LEU 59 2HD2 LEU 59 1.736 -3.573 -15.129 476 H LYS 60 H LYS 60 6.489 -4.153 -11.789 477 HA LYS 60 HA LYS 60 7.220 -6.719 -12.583 478 HB2 LYS 60 2HB LYS 60 8.718 -4.713 -12.177 479 HB3 LYS 60 1HB LYS 60 8.487 -4.952 -10.462 480 HG2 LYS 60 2HG LYS 60 9.763 -6.972 -12.290 481 HG3 LYS 60 1HG LYS 60 10.650 -5.752 -11.397 482 HD2 LYS 60 2HD LYS 60 9.770 -6.685 -9.311 483 HD3 LYS 60 1HD LYS 60 8.919 -7.916 -10.238 484 HE2 LYS 60 2HE LYS 60 11.036 -8.716 -11.152 485 HE3 LYS 60 1HE LYS 60 11.885 -7.467 -10.242 486 HZ1 LYS 60 3HZ LYS 60 12.003 -9.639 -9.190 487 HZ2 LYS 60 1HZ LYS 60 10.340 -9.707 -9.066 488 HZ3 LYS 60 2HZ LYS 60 11.202 -8.548 -8.183 489 H LYS 61 H LYS 61 5.980 -5.429 -9.503 490 HA LYS 61 HA LYS 61 6.357 -7.844 -8.016 491 HB2 LYS 61 2HB LYS 61 4.413 -5.585 -7.492 492 HB3 LYS 61 1HB LYS 61 4.869 -6.837 -6.352 493 HG2 LYS 61 2HG LYS 61 7.173 -5.993 -6.394 494 HG3 LYS 61 1HG LYS 61 6.656 -4.699 -7.481 495 HD2 LYS 61 2HD LYS 61 5.044 -3.965 -5.754 496 HD3 LYS 61 1HD LYS 61 5.683 -5.199 -4.671 497 HE2 LYS 61 2HE LYS 61 6.701 -3.053 -4.158 498 HE3 LYS 61 1HE LYS 61 7.915 -4.152 -4.820 499 HZ1 LYS 61 3HZ LYS 61 8.116 -1.952 -5.768 500 HZ2 LYS 61 1HZ LYS 61 6.504 -1.990 -6.261 501 HZ3 LYS 61 2HZ LYS 61 7.631 -3.039 -6.973 502 H SER 62 H SER 62 3.938 -6.662 -10.169 503 HA SER 62 HA SER 62 1.899 -8.472 -9.310 504 HB2 SER 62 2HB SER 62 2.087 -6.714 -11.764 505 HB3 SER 62 1HB SER 62 0.625 -7.505 -11.163 506 HG SER 62 HG SER 62 2.089 -5.380 -10.032 507 H TRP 63 H TRP 63 4.312 -8.354 -11.935 508 HA TRP 63 HA TRP 63 3.361 -10.750 -13.090 509 HB2 TRP 63 2HB TRP 63 4.634 -9.128 -14.431 510 HB3 TRP 63 1HB TRP 63 6.028 -9.335 -13.381 511 HD1 TRP 63 HD TRP 63 7.456 -11.555 -13.674 512 HE1 TRP 63 1HE TRP 63 7.653 -13.266 -15.595 513 HE3 TRP 63 3HE TRP 63 3.216 -10.344 -16.258 514 HZ2 TRP 63 2HZ TRP 63 6.184 -14.009 -17.891 515 HZ3 TRP 63 3HZ TRP 63 2.680 -11.626 -18.306 516 HH2 TRP 63 HH TRP 63 4.133 -13.404 -19.094 517 H LYS 64 H LYS 64 5.470 -9.891 -10.507 518 HA LYS 64 HA LYS 64 7.100 -12.121 -10.344 519 HB2 LYS 64 2HB LYS 64 7.469 -10.170 -8.937 520 HB3 LYS 64 1HB LYS 64 5.992 -10.509 -8.043 521 HG2 LYS 64 2HG LYS 64 6.925 -12.577 -7.211 522 HG3 LYS 64 1HG LYS 64 8.390 -12.336 -8.154 523 HD2 LYS 64 2HD LYS 64 8.826 -10.284 -6.888 524 HD3 LYS 64 1HD LYS 64 7.388 -10.594 -5.906 525 HE2 LYS 64 2HE LYS 64 8.346 -12.731 -5.192 526 HE3 LYS 64 1HE LYS 64 9.770 -12.415 -6.172 527 HZ1 LYS 64 3HZ LYS 64 8.889 -10.766 -3.860 528 HZ2 LYS 64 1HZ LYS 64 10.258 -10.501 -4.798 529 HZ3 LYS 64 2HZ LYS 64 10.156 -11.878 -3.840 530 H ARG 65 H ARG 65 3.885 -11.715 -8.870 531 HA ARG 65 HA ARG 65 3.949 -14.335 -7.702 532 HB2 ARG 65 2HB ARG 65 2.469 -12.251 -7.043 533 HB3 ARG 65 1HB ARG 65 1.439 -12.770 -8.338 534 HG2 ARG 65 2HG ARG 65 2.071 -14.467 -5.905 535 HG3 ARG 65 1HG ARG 65 0.644 -13.463 -6.118 536 HD2 ARG 65 2HD ARG 65 -0.036 -14.836 -8.025 537 HD3 ARG 65 1HD ARG 65 1.410 -15.827 -7.836 538 HE ARG 65 HE ARG 65 0.394 -16.204 -5.478 539 HH11 ARG 65 1HH1 ARG 65 -1.413 -16.046 -8.523 540 HH12 ARG 65 2HH1 ARG 65 -2.685 -17.043 -7.999 541 HH21 ARG 65 1HH2 ARG 65 -1.321 -17.638 -4.768 542 HH22 ARG 65 2HH2 ARG 65 -2.610 -18.007 -5.805 543 H TYR 66 H TYR 66 2.938 -12.968 -10.730 544 HA TYR 66 HA TYR 66 1.394 -15.114 -11.783 545 HB2 TYR 66 2HB TYR 66 1.434 -12.689 -12.530 546 HB3 TYR 66 1HB TYR 66 2.989 -13.020 -13.268 547 HD1 TYR 66 2HD TYR 66 -0.574 -13.942 -13.315 548 HD2 TYR 66 1HD TYR 66 3.092 -13.950 -15.447 549 HE1 TYR 66 2HE TYR 66 -1.774 -14.623 -15.324 550 HE2 TYR 66 1HE TYR 66 1.912 -14.635 -17.490 551 HH TYR 66 HH TYR 66 -0.183 -15.762 -18.127 552 H GLU 67 H GLU 67 4.811 -14.176 -12.040 553 HA GLU 67 HA GLU 67 5.515 -16.493 -13.585 554 HB2 GLU 67 2HB GLU 67 7.848 -15.809 -13.319 555 HB3 GLU 67 1HB GLU 67 6.863 -14.454 -13.834 556 HG2 GLU 67 2HG GLU 67 6.887 -13.535 -11.659 557 HG3 GLU 67 1HG GLU 67 7.756 -14.914 -11.005 558 H GLN 68 H GLN 68 5.296 -15.900 -10.196 559 HA GLN 68 HA GLN 68 6.717 -18.221 -9.432 560 HB2 GLN 68 2HB GLN 68 4.296 -17.025 -8.055 561 HB3 GLN 68 1HB GLN 68 5.371 -18.217 -7.353 562 HG2 GLN 68 2HG GLN 68 6.044 -15.376 -8.073 563 HG3 GLN 68 1HG GLN 68 5.826 -16.053 -6.463 564 HE21 GLN 68 1HE2 GLN 68 7.895 -15.818 -9.197 565 HE22 GLN 68 2HE2 GLN 68 9.320 -16.445 -8.456 566 H GLU 69 H GLU 69 3.369 -17.680 -10.366 567 HA GLU 69 HA GLU 69 2.474 -20.281 -9.892 568 HB2 GLU 69 2HB GLU 69 1.410 -18.198 -11.786 569 HB3 GLU 69 1HB GLU 69 0.607 -19.732 -11.465 570 HG2 GLU 69 2HG GLU 69 1.227 -17.609 -9.427 571 HG3 GLU 69 1HG GLU 69 -0.354 -17.935 -10.142 572 H MET 70 H MET 70 3.624 -18.891 -12.951 573 HA MET 70 HA MET 70 3.330 -21.395 -14.311 574 HB2 MET 70 2HB MET 70 4.629 -20.402 -16.168 575 HB3 MET 70 1HB MET 70 3.345 -19.339 -15.617 576 HG2 MET 70 2HG MET 70 4.903 -18.022 -14.412 577 HG3 MET 70 1HG MET 70 6.238 -19.085 -14.845 578 HE1 MET 70 3HE MET 70 3.241 -17.880 -17.139 579 HE2 MET 70 1HE MET 70 3.947 -16.448 -17.886 580 HE3 MET 70 2HE MET 70 3.604 -16.459 -16.156 581 H LEU 71 H LEU 71 5.810 -20.077 -12.356 582 HA LEU 71 HA LEU 71 7.834 -21.906 -13.173 583 HB2 LEU 71 2HB LEU 71 8.553 -19.892 -12.368 584 HB3 LEU 71 1HB LEU 71 7.554 -19.878 -10.954 585 HG LEU 71 HG LEU 71 9.028 -21.833 -10.141 586 HD11 LEU 71 1HD1 LEU 71 11.238 -22.047 -11.164 587 HD12 LEU 71 2HD1 LEU 71 10.747 -20.938 -12.444 588 HD13 LEU 71 3HD1 LEU 71 9.946 -22.500 -12.273 589 HD21 LEU 71 3HD2 LEU 71 9.273 -19.579 -9.258 590 HD22 LEU 71 1HD2 LEU 71 10.344 -19.162 -10.596 591 HD23 LEU 71 2HD2 LEU 71 10.842 -20.368 -9.407 592 H LYS 72 H LYS 72 5.528 -21.696 -10.513 593 HA LYS 72 HA LYS 72 6.397 -24.044 -9.158 594 HB2 LYS 72 2HB LYS 72 5.207 -22.225 -8.022 595 HB3 LYS 72 1HB LYS 72 3.791 -22.525 -9.015 596 HG2 LYS 72 2HG LYS 72 3.477 -23.439 -6.789 597 HG3 LYS 72 1HG LYS 72 3.549 -24.739 -7.977 598 HD2 LYS 72 2HD LYS 72 5.852 -25.193 -7.377 599 HD3 LYS 72 1HD LYS 72 5.852 -23.834 -6.250 600 HE2 LYS 72 2HE LYS 72 4.092 -24.947 -4.941 601 HE3 LYS 72 1HE LYS 72 4.127 -26.302 -6.066 602 HZ1 LYS 72 3HZ LYS 72 5.434 -26.750 -4.078 603 HZ2 LYS 72 1HZ LYS 72 6.419 -25.416 -4.395 604 HZ3 LYS 72 2HZ LYS 72 6.400 -26.725 -5.444 605 H ASN 73 H ASN 73 3.734 -23.335 -11.359 606 HA ASN 73 HA ASN 73 2.823 -26.074 -11.299 607 HB2 ASN 73 2HB ASN 73 1.847 -23.669 -12.849 608 HB3 ASN 73 1HB ASN 73 1.124 -25.265 -12.956 609 HD21 ASN 73 1HD2 ASN 73 1.585 -22.469 -10.997 610 HD22 ASN 73 2HD2 ASN 73 0.378 -22.813 -9.809 611 H GLU 74 H GLU 74 3.589 -27.561 -12.547 612 HA GLU 74 HA GLU 74 5.441 -26.953 -14.598 613 HB2 GLU 74 2HB GLU 74 4.228 -29.564 -13.738 614 HB3 GLU 74 1HB GLU 74 5.476 -29.422 -14.968 615 HG2 GLU 74 2HG GLU 74 5.745 -28.523 -12.110 616 HG3 GLU 74 1HG GLU 74 6.382 -30.028 -12.769 617 H LYS 75 H LYS 75 4.654 -25.927 -16.230 618 HA LYS 75 HA LYS 75 2.738 -27.346 -17.952 619 HB2 LYS 75 2HB LYS 75 2.877 -24.337 -17.552 620 HB3 LYS 75 1HB LYS 75 1.858 -25.170 -18.715 621 HG2 LYS 75 2HG LYS 75 0.618 -26.226 -16.898 622 HG3 LYS 75 1HG LYS 75 1.663 -25.438 -15.718 623 HD2 LYS 75 2HD LYS 75 -0.466 -24.244 -15.937 624 HD3 LYS 75 1HD LYS 75 0.876 -23.245 -16.487 625 HE2 LYS 75 2HE LYS 75 0.331 -23.759 -18.805 626 HE3 LYS 75 1HE LYS 75 -0.948 -24.851 -18.277 627 HZ1 LYS 75 3HZ LYS 75 -0.899 -21.889 -17.867 628 HZ2 LYS 75 1HZ LYS 75 -2.088 -22.935 -17.305 629 HZ3 LYS 75 2HZ LYS 75 -1.855 -22.732 -18.943 630 H VAL 76 H VAL 76 4.976 -24.589 -17.982 631 HA VAL 76 HA VAL 76 6.609 -25.831 -19.895 632 HB VAL 76 HB VAL 76 4.944 -25.002 -21.413 633 HG11 VAL 76 1HG1 VAL 76 5.363 -22.270 -20.208 634 HG12 VAL 76 2HG1 VAL 76 3.905 -23.261 -20.109 635 HG13 VAL 76 3HG1 VAL 76 4.418 -22.599 -21.660 636 HG21 VAL 76 3HG2 VAL 76 6.308 -23.523 -22.859 637 HG22 VAL 76 1HG2 VAL 76 7.216 -24.892 -22.217 638 HG23 VAL 76 2HG2 VAL 76 7.424 -23.288 -21.513 639 H ALA 77 H ALA 77 8.410 -25.514 -19.004 640 HA ALA 77 HA ALA 77 9.025 -22.948 -17.708 641 HB1 ALA 77 1HB ALA 77 10.450 -25.600 -17.432 642 HB2 ALA 77 2HB ALA 77 9.304 -24.923 -16.276 643 HB3 ALA 77 3HB ALA 77 10.846 -24.119 -16.562 644 H ALA 78 H ALA 78 9.820 -21.611 -19.217 645 HA ALA 78 HA ALA 78 12.289 -22.325 -20.510 646 HB1 ALA 78 1HB ALA 78 9.853 -21.565 -22.135 647 HB2 ALA 78 2HB ALA 78 10.627 -23.148 -22.113 648 HB3 ALA 78 3HB ALA 78 11.491 -21.755 -22.764 649 H LYS 79 H LYS 79 13.009 -20.328 -21.857 650 HA LYS 79 HA LYS 79 12.708 -18.016 -20.177 651 HB2 LYS 79 2HB LYS 79 14.355 -18.431 -22.671 652 HB3 LYS 79 1HB LYS 79 14.392 -16.996 -21.667 653 HG2 LYS 79 2HG LYS 79 15.180 -18.352 -19.777 654 HG3 LYS 79 1HG LYS 79 15.179 -19.770 -20.822 655 HD2 LYS 79 2HD LYS 79 16.792 -18.707 -22.298 656 HD3 LYS 79 1HD LYS 79 16.768 -17.265 -21.274 657 HE2 LYS 79 2HE LYS 79 17.641 -18.553 -19.406 658 HE3 LYS 79 1HE LYS 79 17.634 -20.016 -20.382 659 HZ1 LYS 79 3HZ LYS 79 19.842 -19.038 -20.267 660 HZ2 LYS 79 1HZ LYS 79 19.277 -17.597 -20.926 661 HZ3 LYS 79 2HZ LYS 79 19.282 -19.019 -21.836 662 H MET 80 H MET 80 10.843 -17.031 -20.447 663 HA MET 80 HA MET 80 9.679 -16.726 -23.082 664 HB2 MET 80 2HB MET 80 8.695 -15.788 -20.380 665 HB3 MET 80 1HB MET 80 7.773 -15.726 -21.879 666 HG2 MET 80 2HG MET 80 7.831 -18.153 -22.038 667 HG3 MET 80 1HG MET 80 8.788 -18.236 -20.565 668 HE1 MET 80 3HE MET 80 7.126 -19.956 -19.517 669 HE2 MET 80 1HE MET 80 6.160 -19.926 -20.991 670 HE3 MET 80 2HE MET 80 5.384 -19.717 -19.420 671 H LEU 81 H LEU 81 11.535 -14.948 -20.840 672 HA LEU 81 HA LEU 81 11.277 -12.556 -22.507 673 HB2 LEU 81 2HB LEU 81 12.395 -12.823 -19.696 674 HB3 LEU 81 1HB LEU 81 12.503 -11.363 -20.644 675 HG LEU 81 HG LEU 81 9.996 -11.228 -20.604 676 HD11 LEU 81 1HD1 LEU 81 9.462 -13.565 -20.173 677 HD12 LEU 81 2HD1 LEU 81 8.751 -12.506 -18.956 678 HD13 LEU 81 3HD1 LEU 81 10.193 -13.441 -18.571 679 HD21 LEU 81 3HD2 LEU 81 11.395 -11.248 -17.936 680 HD22 LEU 81 1HD2 LEU 81 9.868 -10.439 -18.289 681 HD23 LEU 81 2HD2 LEU 81 11.348 -9.911 -19.089 682 H GLU 82 H GLU 82 12.578 -13.092 -24.164 683 HA GLU 82 HA GLU 82 15.224 -14.012 -23.544 684 HB2 GLU 82 2HB GLU 82 15.236 -14.131 -26.221 685 HB3 GLU 82 1HB GLU 82 14.644 -15.434 -25.203 686 HG2 GLU 82 2HG GLU 82 13.155 -14.992 -27.111 687 HG3 GLU 82 1HG GLU 82 12.346 -14.695 -25.585 688 H LYS 83 H LYS 83 14.341 -11.837 -26.183 689 HA LYS 83 HA LYS 83 15.256 -10.033 -27.013 690 HB2 LYS 83 2HB LYS 83 15.602 -9.213 -24.116 691 HB3 LYS 83 1HB LYS 83 15.792 -8.133 -25.478 692 HG2 LYS 83 2HG LYS 83 13.632 -7.702 -24.635 693 HG3 LYS 83 1HG LYS 83 13.381 -8.690 -26.072 694 HD2 LYS 83 2HD LYS 83 13.211 -10.685 -24.580 695 HD3 LYS 83 1HD LYS 83 13.287 -9.599 -23.192 696 HE2 LYS 83 2HE LYS 83 10.985 -10.150 -23.651 697 HE3 LYS 83 1HE LYS 83 11.258 -8.453 -24.049 698 HZ1 LYS 83 3HZ LYS 83 9.963 -9.657 -25.724 699 HZ2 LYS 83 1HZ LYS 83 11.267 -10.679 -26.007 700 HZ3 LYS 83 2HZ LYS 83 11.361 -9.019 -26.378 701 H ASP 84 H ASP 84 16.952 -11.023 -28.056 702 HA ASP 84 HA ASP 84 19.563 -10.867 -26.820 703 HB2 ASP 84 2HB ASP 84 18.743 -11.676 -29.618 704 HB3 ASP 84 1HB ASP 84 20.419 -11.540 -29.117 705 H ALA 85 H ALA 85 20.273 -8.902 -26.531 706 HA ALA 85 HA ALA 85 19.906 -6.928 -28.666 707 HB1 ALA 85 1HB ALA 85 20.567 -5.278 -26.999 708 HB2 ALA 85 2HB ALA 85 20.873 -6.563 -25.831 709 HB3 ALA 85 3HB ALA 85 19.231 -6.264 -26.401 710 H THR 86 H THR 86 21.946 -9.252 -28.053 711 HA THR 86 HA THR 86 24.472 -8.010 -28.047 712 HB THR 86 HB THR 86 25.152 -10.408 -28.663 713 HG1 THR 86 1HG THR 86 23.357 -11.895 -28.116 714 HG21 THR 86 3HG2 THR 86 25.266 -9.516 -26.387 715 HG22 THR 86 1HG2 THR 86 24.728 -11.196 -26.370 716 HG23 THR 86 2HG2 THR 86 23.558 -9.894 -26.149 717 H GLU 87 H GLU 87 25.505 -7.193 -29.708 718 HA GLU 87 HA GLU 87 24.736 -8.009 -32.411 719 HB2 GLU 87 2HB GLU 87 25.967 -5.422 -31.440 720 HB3 GLU 87 1HB GLU 87 25.594 -5.798 -33.119 721 HG2 GLU 87 2HG GLU 87 23.236 -5.935 -32.597 722 HG3 GLU 87 1HG GLU 87 23.578 -5.638 -30.895 723 H VAL 88 H VAL 88 26.452 -8.479 -33.840 724 HA VAL 88 HA VAL 88 28.789 -9.390 -32.392 725 HB VAL 88 HB VAL 88 29.336 -10.736 -34.372 726 HG11 VAL 88 1HG1 VAL 88 27.912 -11.698 -32.657 727 HG12 VAL 88 2HG1 VAL 88 27.435 -12.290 -34.247 728 HG13 VAL 88 3HG1 VAL 88 26.482 -11.039 -33.446 729 HG21 VAL 88 3HG2 VAL 88 28.424 -9.269 -36.109 730 HG22 VAL 88 1HG2 VAL 88 26.791 -9.618 -35.553 731 HG23 VAL 88 2HG2 VAL 88 27.777 -10.902 -36.259 732 H GLY 89 H GLY 89 30.813 -8.758 -32.736 733 HA2 GLY 89 2HA GLY 89 31.201 -6.548 -34.626 734 HA3 GLY 89 1HA GLY 89 32.135 -6.767 -33.140 735 H VAL 90 H VAL 90 32.484 -6.935 -36.329 736 HA VAL 90 HA VAL 90 34.237 -9.258 -36.133 737 HB VAL 90 HB VAL 90 32.234 -9.815 -37.436 738 HG11 VAL 90 1HG1 VAL 90 31.626 -7.661 -38.282 739 HG12 VAL 90 2HG1 VAL 90 31.788 -8.803 -39.610 740 HG13 VAL 90 3HG1 VAL 90 33.060 -7.617 -39.306 741 HG21 VAL 90 3HG2 VAL 90 34.294 -10.960 -38.020 742 HG22 VAL 90 1HG2 VAL 90 34.724 -9.661 -39.137 743 HG23 VAL 90 2HG2 VAL 90 33.327 -10.682 -39.468 744 H LYS 91 H LYS 91 36.200 -9.138 -37.213 745 HA LYS 91 HA LYS 91 37.217 -6.486 -37.722 746 HB2 LYS 91 2HB LYS 91 38.567 -8.073 -36.497 747 HB3 LYS 91 1HB LYS 91 38.516 -9.194 -37.852 748 HG2 LYS 91 2HG LYS 91 39.777 -7.627 -39.217 749 HG3 LYS 91 1HG LYS 91 39.775 -6.466 -37.891 750 HD2 LYS 91 2HD LYS 91 40.968 -7.962 -36.510 751 HD3 LYS 91 1HD LYS 91 40.928 -9.224 -37.749 752 HE2 LYS 91 2HE LYS 91 43.120 -8.122 -37.737 753 HE3 LYS 91 1HE LYS 91 42.262 -7.791 -39.237 754 HZ1 LYS 91 3HZ LYS 91 42.507 -5.927 -36.923 755 HZ2 LYS 91 1HZ LYS 91 41.686 -5.591 -38.362 756 HZ3 LYS 91 2HZ LYS 91 43.347 -5.828 -38.368 757 H ALA 92 H ALA 92 36.460 -5.688 -39.618 758 HA ALA 92 HA ALA 92 36.689 -7.382 -41.980 759 HB1 ALA 92 1HB ALA 92 34.530 -6.245 -41.635 760 HB2 ALA 92 2HB ALA 92 35.306 -5.769 -43.141 761 HB3 ALA 92 3HB ALA 92 35.349 -4.686 -41.750 762 H ALA 93 H ALA 93 38.842 -7.362 -42.288 763 HA ALA 93 HA ALA 93 39.909 -5.041 -43.629 764 HB1 ALA 93 1HB ALA 93 41.964 -5.016 -42.267 765 HB2 ALA 93 2HB ALA 93 41.253 -6.219 -41.185 766 HB3 ALA 93 3HB ALA 93 40.544 -4.609 -41.305 767 H LEU 94 H LEU 94 41.083 -5.738 -45.300 768 HA LEU 94 HA LEU 94 41.177 -8.516 -45.811 769 HB2 LEU 94 2HB LEU 94 42.239 -8.012 -47.953 770 HB3 LEU 94 1HB LEU 94 40.850 -6.996 -47.688 771 HG LEU 94 HG LEU 94 43.721 -6.068 -47.372 772 HD11 LEU 94 1HD1 LEU 94 43.269 -6.691 -49.673 773 HD12 LEU 94 2HD1 LEU 94 43.390 -4.940 -49.514 774 HD13 LEU 94 3HD1 LEU 94 41.809 -5.704 -49.672 775 HD21 LEU 94 3HD2 LEU 94 42.148 -4.687 -46.095 776 HD22 LEU 94 1HD2 LEU 94 41.124 -4.519 -47.524 777 HD23 LEU 94 2HD2 LEU 94 42.734 -3.816 -47.507 778 H GLU 95 H GLU 95 42.509 -9.886 -44.982 779 HA GLU 95 HA GLU 95 45.178 -9.021 -44.186 780 HB2 GLU 95 2HB GLU 95 43.519 -10.547 -42.812 781 HB3 GLU 95 1HB GLU 95 44.023 -11.809 -43.920 782 HG2 GLU 95 2HG GLU 95 45.813 -10.282 -42.029 783 HG3 GLU 95 1HG GLU 95 45.231 -11.919 -41.801 784 H GLU 96 H GLU 96 46.525 -8.988 -45.877 785 HA GLU 96 HA GLU 96 45.932 -10.286 -48.323 786 HB2 GLU 96 2HB GLU 96 48.440 -8.846 -47.516 787 HB3 GLU 96 1HB GLU 96 47.998 -9.318 -49.143 788 HG2 GLU 96 2HG GLU 96 46.064 -7.825 -49.049 789 HG3 GLU 96 1HG GLU 96 46.538 -7.337 -47.418 790 H ALA 97 H ALA 97 46.661 -12.052 -49.204 791 HA ALA 97 HA ALA 97 48.515 -13.736 -47.723 792 HB1 ALA 97 1HB ALA 97 46.764 -14.330 -50.115 793 HB2 ALA 97 2HB ALA 97 46.399 -14.748 -48.444 794 HB3 ALA 97 3HB ALA 97 47.765 -15.505 -49.264 795 H LYS 98 H LYS 98 50.574 -13.639 -48.279 796 HA LYS 98 HA LYS 98 51.461 -12.222 -50.569 797 HB2 LYS 98 2HB LYS 98 52.986 -13.914 -48.586 798 HB3 LYS 98 1HB LYS 98 53.722 -12.955 -49.852 799 HG2 LYS 98 2HG LYS 98 52.931 -10.912 -48.891 800 HG3 LYS 98 1HG LYS 98 51.970 -11.772 -47.702 801 HD2 LYS 98 2HD LYS 98 54.980 -12.030 -47.852 802 HD3 LYS 98 1HD LYS 98 54.191 -10.766 -46.923 803 HE2 LYS 98 2HE LYS 98 54.832 -12.659 -45.491 804 HE3 LYS 98 1HE LYS 98 53.092 -12.456 -45.518 805 HZ1 LYS 98 3HZ LYS 98 53.785 -14.768 -45.627 806 HZ2 LYS 98 1HZ LYS 98 54.599 -14.522 -47.078 807 HZ3 LYS 98 2HZ LYS 98 52.906 -14.359 -46.959 808 H LYS 99 H LYS 99 50.967 -13.065 -52.425 809 HA LYS 99 HA LYS 99 51.135 -15.875 -53.005 810 HB2 LYS 99 2HB LYS 99 49.366 -14.460 -53.920 811 HB3 LYS 99 1HB LYS 99 50.555 -13.486 -54.765 812 HG2 LYS 99 2HG LYS 99 51.165 -15.453 -56.121 813 HG3 LYS 99 1HG LYS 99 49.932 -16.388 -55.274 814 HD2 LYS 99 2HD LYS 99 49.418 -13.917 -56.946 815 HD3 LYS 99 1HD LYS 99 49.143 -15.577 -57.464 816 HE2 LYS 99 2HE LYS 99 47.477 -15.869 -55.687 817 HE3 LYS 99 1HE LYS 99 47.785 -14.230 -55.125 818 HZ1 LYS 99 3HZ LYS 99 46.937 -13.370 -57.194 819 HZ2 LYS 99 1HZ LYS 99 45.791 -14.378 -56.506 820 HZ3 LYS 99 2HZ LYS 99 46.707 -14.909 -57.818 821 H VAL 100 H VAL 100 52.733 -16.884 -54.143 822 HA VAL 100 HA VAL 100 55.236 -15.535 -54.361 823 HB VAL 100 HB VAL 100 56.172 -17.642 -55.157 824 HG11 VAL 100 1HG1 VAL 100 55.891 -17.387 -52.782 825 HG12 VAL 100 2HG1 VAL 100 55.644 -19.074 -53.240 826 HG13 VAL 100 3HG1 VAL 100 54.260 -18.045 -52.874 827 HG21 VAL 100 3HG2 VAL 100 54.358 -18.388 -56.615 828 HG22 VAL 100 1HG2 VAL 100 53.332 -18.680 -55.213 829 HG23 VAL 100 2HG2 VAL 100 54.778 -19.655 -55.466 830 H GLN 101 H GLN 101 56.556 -15.767 -56.435 831 HA GLN 101 HA GLN 101 54.902 -15.491 -58.785 832 HB2 GLN 101 2HB GLN 101 56.140 -13.399 -59.444 833 HB3 GLN 101 1HB GLN 101 55.019 -13.215 -58.106 834 HG2 GLN 101 2HG GLN 101 56.908 -13.343 -56.539 835 HG3 GLN 101 1HG GLN 101 58.002 -13.489 -57.911 836 HE21 GLN 101 1HE2 GLN 101 58.468 -11.639 -59.148 837 HE22 GLN 101 2HE2 GLN 101 57.982 -10.070 -58.602 838 H ILE 102 H ILE 102 55.640 -17.097 -59.901 839 HA ILE 102 HA ILE 102 58.477 -17.628 -60.083 840 HB ILE 102 HB ILE 102 56.136 -18.989 -61.466 841 HG12 ILE 102 2HG1 ILE 102 56.054 -19.311 -59.042 842 HG13 ILE 102 1HG1 ILE 102 56.489 -20.818 -59.840 843 HG21 ILE 102 1HG2 ILE 102 59.031 -19.836 -61.295 844 HG22 ILE 102 2HG2 ILE 102 58.201 -19.258 -62.737 845 HG23 ILE 102 3HG2 ILE 102 57.727 -20.790 -62.002 846 HD11 ILE 102 3HD1 ILE 102 58.388 -18.938 -58.432 847 HD12 ILE 102 1HD1 ILE 102 58.837 -20.441 -59.235 848 HD13 ILE 102 2HD1 ILE 102 57.796 -20.472 -57.810 849 H GLU 103 H GLU 103 59.583 -16.383 -61.344 850 HA GLU 103 HA GLU 103 58.293 -15.185 -63.689 851 HB2 GLU 103 2HB GLU 103 60.793 -14.413 -62.213 852 HB3 GLU 103 1HB GLU 103 60.082 -13.548 -63.560 853 HG2 GLU 103 2HG GLU 103 58.115 -13.061 -62.242 854 HG3 GLU 103 1HG GLU 103 58.786 -13.980 -60.892 855 H LEU 104 H LEU 104 60.899 -17.166 -62.583 856 HA LEU 104 HA LEU 104 62.548 -18.307 -63.524 857 HB2 LEU 104 2HB LEU 104 60.854 -19.183 -65.148 858 HB3 LEU 104 1HB LEU 104 61.149 -17.799 -66.178 859 HG LEU 104 HG LEU 104 63.463 -18.580 -66.541 860 HD11 LEU 104 1HD1 LEU 104 62.588 -20.984 -64.951 861 HD12 LEU 104 2HD1 LEU 104 63.814 -19.805 -64.483 862 HD13 LEU 104 3HD1 LEU 104 64.085 -20.851 -65.870 863 HD21 LEU 104 3HD2 LEU 104 61.340 -20.625 -67.173 864 HD22 LEU 104 1HD2 LEU 104 62.900 -20.480 -67.981 865 HD23 LEU 104 2HD2 LEU 104 61.709 -19.189 -68.124 866 H ASP 105 H ASP 105 63.956 -16.896 -62.869 867 HA ASP 105 HA ASP 105 64.432 -14.354 -63.894 868 HB2 ASP 105 2HB ASP 105 66.214 -16.120 -62.221 869 HB3 ASP 105 1HB ASP 105 66.542 -14.431 -62.572 870 H THR 106 H THR 106 66.355 -17.313 -64.322 871 HA THR 106 HA THR 106 68.114 -17.759 -65.618 872 HB THR 106 HB THR 106 67.815 -17.324 -68.047 873 HG1 THR 106 1HG THR 106 66.136 -15.536 -67.221 874 HG21 THR 106 3HG2 THR 106 65.558 -18.643 -66.553 875 HG22 THR 106 1HG2 THR 106 67.061 -19.395 -67.074 876 HG23 THR 106 2HG2 THR 106 65.871 -18.879 -68.274 877 H SER 107 H SER 107 69.388 -16.353 -64.362 878 HA SER 107 HA SER 107 69.988 -13.771 -65.521 879 HB2 SER 107 2HB SER 107 69.667 -13.949 -63.092 880 HB3 SER 107 1HB SER 107 71.019 -15.067 -62.985 881 HG SER 107 HG SER 107 71.635 -12.682 -64.237 882 H LEU 108 H LEU 108 71.688 -16.825 -64.810 883 HA LEU 108 HA LEU 108 74.228 -15.938 -65.672 884 HB2 LEU 108 2HB LEU 108 73.677 -17.951 -64.190 885 HB3 LEU 108 1HB LEU 108 73.189 -18.790 -65.638 886 HG LEU 108 HG LEU 108 75.399 -19.509 -64.866 887 HD11 LEU 108 1HD1 LEU 108 75.034 -19.653 -67.235 888 HD12 LEU 108 2HD1 LEU 108 76.717 -19.237 -66.897 889 HD13 LEU 108 3HD1 LEU 108 75.593 -17.995 -67.454 890 HD21 LEU 108 3HD2 LEU 108 77.322 -17.994 -64.931 891 HD22 LEU 108 1HD2 LEU 108 76.111 -17.495 -63.752 892 HD23 LEU 108 2HD2 LEU 108 76.234 -16.651 -65.289 893 H SER 109 H SER 109 74.399 -15.098 -67.661 894 HA SER 109 HA SER 109 73.845 -16.765 -69.939 895 HB2 SER 109 2HB SER 109 72.474 -14.915 -71.001 896 HB3 SER 109 1HB SER 109 71.685 -15.792 -69.689 897 HG SER 109 HG SER 109 72.333 -14.118 -68.286 898 H TYR 110 H TYR 110 75.675 -16.583 -71.117 899 HA TYR 110 HA TYR 110 76.834 -13.926 -71.419 900 HB2 TYR 110 2HB TYR 110 78.433 -16.406 -70.748 901 HB3 TYR 110 1HB TYR 110 79.130 -14.864 -71.231 902 HD1 TYR 110 2HD TYR 110 78.505 -12.813 -69.750 903 HD2 TYR 110 1HD TYR 110 78.069 -16.849 -68.494 904 HE1 TYR 110 2HE TYR 110 78.488 -12.072 -67.415 905 HE2 TYR 110 1HE TYR 110 78.046 -16.119 -66.154 906 HH TYR 110 HH TYR 110 78.855 -14.228 -64.866 907 H ILE 111 H ILE 111 77.245 -13.405 -73.432 908 HA ILE 111 HA ILE 111 78.314 -15.130 -75.342 909 HB ILE 111 HB ILE 111 76.124 -16.084 -75.562 910 HG12 ILE 111 2HG1 ILE 111 76.613 -14.163 -77.846 911 HG13 ILE 111 1HG1 ILE 111 77.408 -15.712 -77.621 912 HG21 ILE 111 1HG2 ILE 111 74.746 -14.418 -74.552 913 HG22 ILE 111 2HG2 ILE 111 74.111 -14.794 -76.154 914 HG23 ILE 111 3HG2 ILE 111 75.025 -13.304 -75.887 915 HD11 ILE 111 3HD1 ILE 111 75.317 -16.833 -77.838 916 HD12 ILE 111 1HD1 ILE 111 75.652 -15.848 -79.268 917 HD13 ILE 111 2HD1 ILE 111 74.481 -15.286 -78.053 Start of MODEL 10 1 H1 GLY -1 1HT GLY -1 -1.659 -8.737 -28.604 2 H2 GLY -1 2HT GLY -1 -3.247 -9.210 -28.352 3 H3 GLY -1 3HT GLY -1 -1.978 -10.255 -27.928 4 HA2 GLY -1 1HA GLY -1 -2.917 -9.212 -25.986 5 HA3 GLY -1 2HA GLY -1 -1.253 -8.702 -26.255 6 H SER 0 H SER 0 -1.256 -6.730 -25.436 7 HA SER 0 HA SER 0 -1.682 -4.602 -25.016 8 HB2 SER 0 2HB SER 0 -2.438 -4.556 -27.933 9 HB3 SER 0 1HB SER 0 -2.003 -3.149 -26.965 10 HG SER 0 HG SER 0 -0.426 -5.307 -27.807 11 H MET 1 H MET 1 -3.457 -5.240 -23.596 12 HA MET 1 HA MET 1 -5.998 -4.137 -24.560 13 HB2 MET 1 2HB MET 1 -5.564 -5.973 -22.176 14 HB3 MET 1 1HB MET 1 -7.084 -5.248 -22.632 15 HG2 MET 1 2HG MET 1 -7.141 -7.509 -23.307 16 HG3 MET 1 1HG MET 1 -6.972 -6.533 -24.758 17 HE1 MET 1 3HE MET 1 -6.338 -8.707 -26.116 18 HE2 MET 1 1HE MET 1 -6.506 -9.670 -24.649 19 HE3 MET 1 2HE MET 1 -5.056 -9.818 -25.640 20 H THR 2 H THR 2 -6.892 -2.445 -23.445 21 HA THR 2 HA THR 2 -5.211 -1.207 -21.441 22 HB THR 2 HB THR 2 -7.920 -0.340 -22.511 23 HG1 THR 2 1HG THR 2 -5.463 -0.336 -23.660 24 HG21 THR 2 3HG2 THR 2 -7.285 0.705 -20.377 25 HG22 THR 2 1HG2 THR 2 -7.242 1.886 -21.689 26 HG23 THR 2 2HG2 THR 2 -5.743 1.198 -21.073 27 H VAL 3 H VAL 3 -5.473 -1.785 -19.382 28 HA VAL 3 HA VAL 3 -8.039 -3.012 -18.600 29 HB VAL 3 HB VAL 3 -5.368 -3.431 -17.253 30 HG11 VAL 3 1HG1 VAL 3 -7.150 -3.852 -15.752 31 HG12 VAL 3 2HG1 VAL 3 -6.445 -5.377 -16.347 32 HG13 VAL 3 3HG1 VAL 3 -7.983 -4.836 -16.985 33 HG21 VAL 3 3HG2 VAL 3 -6.739 -5.296 -19.180 34 HG22 VAL 3 1HG2 VAL 3 -5.348 -5.650 -18.154 35 HG23 VAL 3 2HG2 VAL 3 -5.203 -4.437 -19.443 36 H TYR 4 H TYR 4 -9.138 -2.088 -16.984 37 HA TYR 4 HA TYR 4 -7.903 0.174 -15.623 38 HB2 TYR 4 2HB TYR 4 -10.801 -0.635 -15.899 39 HB3 TYR 4 1HB TYR 4 -10.225 0.796 -15.054 40 HD1 TYR 4 2HD TYR 4 -10.719 -0.756 -18.346 41 HD2 TYR 4 1HD TYR 4 -9.441 2.725 -16.280 42 HE1 TYR 4 2HE TYR 4 -10.808 0.493 -20.435 43 HE2 TYR 4 1HE TYR 4 -9.533 4.008 -18.371 44 HH TYR 4 HH TYR 4 -11.122 2.995 -21.070 45 H ILE 5 H ILE 5 -7.448 0.100 -13.551 46 HA ILE 5 HA ILE 5 -8.255 -2.266 -11.960 47 HB ILE 5 HB ILE 5 -5.924 -0.413 -11.468 48 HG12 ILE 5 2HG1 ILE 5 -4.411 -2.158 -11.915 49 HG13 ILE 5 1HG1 ILE 5 -5.604 -3.325 -12.356 50 HG21 ILE 5 1HG2 ILE 5 -6.785 -1.341 -9.435 51 HG22 ILE 5 2HG2 ILE 5 -5.186 -2.022 -9.761 52 HG23 ILE 5 3HG2 ILE 5 -6.646 -2.970 -10.067 53 HD11 ILE 5 3HD1 ILE 5 -4.744 -0.835 -13.870 54 HD12 ILE 5 1HD1 ILE 5 -6.139 -1.798 -14.335 55 HD13 ILE 5 2HD1 ILE 5 -4.528 -2.517 -14.362 56 H CYS 6 H CYS 6 -9.689 -1.774 -10.434 57 HA CYS 6 HA CYS 6 -9.332 0.738 -9.034 58 HB2 CYS 6 2HB CYS 6 -11.402 0.944 -10.309 59 HB3 CYS 6 1HB CYS 6 -11.956 -0.587 -9.640 60 HG CYS 6 HG CYS 6 -11.597 2.368 -7.921 61 HA PRO 7 HA PRO 7 -8.950 -2.513 -5.905 62 HB2 PRO 7 2HB PRO 7 -7.240 -1.184 -4.301 63 HB3 PRO 7 1HB PRO 7 -6.688 -1.984 -5.776 64 HG2 PRO 7 2HG PRO 7 -7.257 0.912 -5.293 65 HG3 PRO 7 1HG PRO 7 -5.922 0.170 -6.188 66 HD2 PRO 7 2HD PRO 7 -8.154 1.238 -7.368 67 HD3 PRO 7 1HD PRO 7 -7.166 -0.044 -8.102 68 H GLU 8 H GLU 8 -10.677 0.100 -6.164 69 HA GLU 8 HA GLU 8 -11.266 0.678 -3.352 70 HB2 GLU 8 2HB GLU 8 -12.582 1.834 -5.790 71 HB3 GLU 8 1HB GLU 8 -12.553 2.482 -4.164 72 HG2 GLU 8 2HG GLU 8 -10.236 3.014 -4.388 73 HG3 GLU 8 1HG GLU 8 -10.227 2.210 -5.977 74 H THR 9 H THR 9 -13.107 0.143 -6.384 75 HA THR 9 HA THR 9 -15.126 -1.247 -4.810 76 HB THR 9 HB THR 9 -16.816 -0.070 -6.199 77 HG1 THR 9 1HG THR 9 -16.103 0.985 -7.869 78 HG21 THR 9 3HG2 THR 9 -14.896 1.742 -4.733 79 HG22 THR 9 1HG2 THR 9 -16.179 0.806 -3.969 80 HG23 THR 9 2HG2 THR 9 -16.585 2.115 -5.093 81 H GLY 10 H GLY 10 -12.868 -2.011 -7.146 82 HA2 GLY 10 2HA GLY 10 -14.901 -3.363 -8.687 83 HA3 GLY 10 1HA GLY 10 -13.317 -3.073 -9.353 84 H ASP 11 H ASP 11 -13.505 -5.451 -9.625 85 HA ASP 11 HA ASP 11 -12.409 -6.768 -7.243 86 HB2 ASP 11 2HB ASP 11 -14.792 -7.364 -7.242 87 HB3 ASP 11 1HB ASP 11 -14.678 -7.886 -8.919 88 H ASP 12 H ASP 12 -11.108 -8.579 -7.713 89 HA ASP 12 HA ASP 12 -9.682 -8.047 -10.120 90 HB2 ASP 12 2HB ASP 12 -7.967 -9.534 -9.284 91 HB3 ASP 12 1HB ASP 12 -8.472 -8.408 -8.038 92 H GLY 13 H GLY 13 -12.297 -9.992 -9.524 93 HA2 GLY 13 2HA GLY 13 -11.403 -12.088 -11.341 94 HA3 GLY 13 1HA GLY 13 -12.871 -12.086 -10.369 95 H ASN 14 H ASN 14 -12.389 -9.119 -11.828 96 HA ASN 14 HA ASN 14 -14.614 -9.599 -13.627 97 HB2 ASN 14 2HB ASN 14 -13.144 -7.089 -12.919 98 HB3 ASN 14 1HB ASN 14 -14.311 -7.093 -14.205 99 HD21 ASN 14 1HD2 ASN 14 -13.734 -6.792 -10.980 100 HD22 ASN 14 2HD2 ASN 14 -15.383 -6.663 -10.444 101 H ASP 15 H ASP 15 -14.443 -8.139 -15.662 102 HA ASP 15 HA ASP 15 -12.668 -9.362 -17.517 103 HB2 ASP 15 2HB ASP 15 -14.921 -8.797 -18.138 104 HB3 ASP 15 1HB ASP 15 -14.665 -7.112 -17.718 105 H GLY 16 H GLY 16 -12.597 -6.463 -15.624 106 HA2 GLY 16 2HA GLY 16 -10.882 -5.018 -15.294 107 HA3 GLY 16 1HA GLY 16 -9.986 -5.808 -16.599 108 H SER 17 H SER 17 -13.138 -4.714 -17.160 109 HA SER 17 HA SER 17 -12.220 -2.663 -18.985 110 HB2 SER 17 2HB SER 17 -14.131 -4.142 -19.583 111 HB3 SER 17 1HB SER 17 -15.025 -3.525 -18.197 112 HG SER 17 HG SER 17 -14.197 -2.130 -20.514 113 H GLU 18 H GLU 18 -13.686 -0.461 -18.750 114 HA GLU 18 HA GLU 18 -12.828 0.675 -16.328 115 HB2 GLU 18 2HB GLU 18 -13.110 1.897 -18.511 116 HB3 GLU 18 1HB GLU 18 -14.849 1.787 -18.288 117 HG2 GLU 18 2HG GLU 18 -14.619 3.024 -16.185 118 HG3 GLU 18 1HG GLU 18 -12.897 3.169 -16.556 119 H LEU 19 H LEU 19 -15.780 -0.792 -17.434 120 HA LEU 19 HA LEU 19 -17.383 0.146 -15.222 121 HB2 LEU 19 2HB LEU 19 -18.015 -1.855 -17.382 122 HB3 LEU 19 1HB LEU 19 -19.144 -1.218 -16.208 123 HG LEU 19 HG LEU 19 -19.582 -0.190 -18.183 124 HD11 LEU 19 1HD1 LEU 19 -19.698 1.346 -16.361 125 HD12 LEU 19 2HD1 LEU 19 -19.162 2.212 -17.799 126 HD13 LEU 19 3HD1 LEU 19 -17.996 1.768 -16.552 127 HD21 LEU 19 3HD2 LEU 19 -17.602 -0.651 -19.490 128 HD22 LEU 19 1HD2 LEU 19 -16.667 0.497 -18.538 129 HD23 LEU 19 2HD2 LEU 19 -17.959 1.072 -19.591 130 H LYS 20 H LYS 20 -15.329 -2.489 -15.864 131 HA LYS 20 HA LYS 20 -16.069 -3.726 -13.295 132 HB2 LYS 20 2HB LYS 20 -15.233 -5.413 -15.646 133 HB3 LYS 20 1HB LYS 20 -15.855 -5.887 -14.100 134 HG2 LYS 20 2HG LYS 20 -18.093 -5.019 -14.683 135 HG3 LYS 20 1HG LYS 20 -17.498 -4.677 -16.312 136 HD2 LYS 20 2HD LYS 20 -16.873 -7.043 -16.560 137 HD3 LYS 20 1HD LYS 20 -17.539 -7.369 -14.965 138 HE2 LYS 20 2HE LYS 20 -19.142 -8.031 -16.588 139 HE3 LYS 20 1HE LYS 20 -19.744 -6.574 -15.799 140 HZ1 LYS 20 3HZ LYS 20 -18.413 -6.672 -18.458 141 HZ2 LYS 20 1HZ LYS 20 -19.048 -5.284 -17.725 142 HZ3 LYS 20 2HZ LYS 20 -20.060 -6.546 -18.191 143 HA PRO 21 HA PRO 21 -11.743 -2.727 -13.893 144 HB2 PRO 21 2HB PRO 21 -11.414 -1.311 -11.617 145 HB3 PRO 21 1HB PRO 21 -12.015 -0.605 -13.119 146 HG2 PRO 21 2HG PRO 21 -13.514 -1.353 -10.662 147 HG3 PRO 21 1HG PRO 21 -13.825 -0.058 -11.824 148 HD2 PRO 21 2HD PRO 21 -15.162 -2.523 -11.739 149 HD3 PRO 21 1HD PRO 21 -15.172 -1.420 -13.072 150 H LEU 22 H LEU 22 -10.040 -3.690 -13.011 151 HA LEU 22 HA LEU 22 -10.604 -5.923 -11.306 152 HB2 LEU 22 2HB LEU 22 -8.017 -4.930 -12.450 153 HB3 LEU 22 1HB LEU 22 -8.245 -6.455 -11.616 154 HG LEU 22 HG LEU 22 -9.543 -5.663 -14.197 155 HD11 LEU 22 1HD1 LEU 22 -8.118 -7.341 -15.173 156 HD12 LEU 22 2HD1 LEU 22 -7.331 -7.587 -13.613 157 HD13 LEU 22 3HD1 LEU 22 -7.192 -6.036 -14.440 158 HD21 LEU 22 3HD2 LEU 22 -9.630 -8.245 -12.652 159 HD22 LEU 22 1HD2 LEU 22 -10.259 -8.009 -14.283 160 HD23 LEU 22 2HD2 LEU 22 -10.974 -7.137 -12.934 161 H ARG 23 H ARG 23 -9.914 -6.218 -9.331 162 HA ARG 23 HA ARG 23 -9.316 -3.840 -7.837 163 HB2 ARG 23 2HB ARG 23 -10.935 -5.075 -6.909 164 HB3 ARG 23 1HB ARG 23 -10.252 -6.624 -7.156 165 HG2 ARG 23 2HG ARG 23 -8.590 -5.993 -5.442 166 HG3 ARG 23 1HG ARG 23 -9.573 -4.545 -5.078 167 HD2 ARG 23 2HD ARG 23 -10.315 -7.459 -4.915 168 HD3 ARG 23 1HD ARG 23 -10.142 -6.365 -3.538 169 HE ARG 23 HE ARG 23 -12.081 -5.283 -5.198 170 HH11 ARG 23 1HH1 ARG 23 -11.770 -8.224 -3.210 171 HH12 ARG 23 2HH1 ARG 23 -13.462 -8.414 -3.075 172 HH21 ARG 23 1HH2 ARG 23 -14.330 -5.601 -4.975 173 HH22 ARG 23 2HH2 ARG 23 -14.912 -6.944 -4.070 174 H THR 24 H THR 24 -7.482 -6.203 -9.412 175 HA THR 24 HA THR 24 -5.142 -5.400 -7.883 176 HB THR 24 HB THR 24 -4.154 -7.654 -8.284 177 HG1 THR 24 1HG THR 24 -5.750 -9.355 -8.815 178 HG21 THR 24 3HG2 THR 24 -5.445 -8.883 -6.566 179 HG22 THR 24 1HG2 THR 24 -6.756 -7.720 -6.734 180 HG23 THR 24 2HG2 THR 24 -5.197 -7.198 -6.104 181 H LEU 25 H LEU 25 -3.317 -5.084 -9.104 182 HA LEU 25 HA LEU 25 -3.595 -4.597 -11.924 183 HB2 LEU 25 2HB LEU 25 -2.251 -3.174 -10.410 184 HB3 LEU 25 1HB LEU 25 -1.210 -4.529 -10.077 185 HG LEU 25 HG LEU 25 -0.362 -4.492 -12.353 186 HD11 LEU 25 1HD1 LEU 25 -2.380 -3.742 -13.510 187 HD12 LEU 25 2HD1 LEU 25 -1.012 -2.711 -13.899 188 HD13 LEU 25 3HD1 LEU 25 -2.240 -2.155 -12.763 189 HD21 LEU 25 3HD2 LEU 25 0.767 -2.314 -12.243 190 HD22 LEU 25 1HD2 LEU 25 0.713 -3.117 -10.669 191 HD23 LEU 25 2HD2 LEU 25 -0.399 -1.799 -11.027 192 H TYR 26 H TYR 26 -2.584 -7.038 -9.843 193 HA TYR 26 HA TYR 26 -0.941 -8.755 -11.289 194 HB2 TYR 26 2HB TYR 26 -1.509 -8.844 -8.926 195 HB3 TYR 26 1HB TYR 26 -3.163 -9.255 -9.325 196 HD1 TYR 26 1HD TYR 26 0.307 -10.449 -9.260 197 HD2 TYR 26 2HD TYR 26 -3.762 -11.529 -9.800 198 HE1 TYR 26 1HE TYR 26 0.889 -12.789 -9.020 199 HE2 TYR 26 2HE TYR 26 -3.171 -13.883 -9.526 200 HH TYR 26 HH TYR 26 -1.194 -15.270 -9.799 201 H GLN 27 H GLN 27 -4.540 -8.718 -11.074 202 HA GLN 27 HA GLN 27 -4.862 -10.812 -12.938 203 HB2 GLN 27 2HB GLN 27 -6.624 -10.292 -11.364 204 HB3 GLN 27 1HB GLN 27 -6.827 -8.687 -12.033 205 HG2 GLN 27 2HG GLN 27 -8.628 -10.124 -12.787 206 HG3 GLN 27 1HG GLN 27 -7.632 -9.697 -14.150 207 HE21 GLN 27 1HE2 GLN 27 -8.327 -11.438 -15.305 208 HE22 GLN 27 2HE2 GLN 27 -7.844 -13.052 -15.046 209 H ALA 28 H ALA 28 -4.620 -7.322 -13.294 210 HA ALA 28 HA ALA 28 -5.417 -7.048 -15.899 211 HB1 ALA 28 1HB ALA 28 -4.954 -5.223 -14.299 212 HB2 ALA 28 2HB ALA 28 -4.137 -4.952 -15.834 213 HB3 ALA 28 3HB ALA 28 -3.239 -5.547 -14.431 214 H MET 29 H MET 29 -2.213 -7.938 -14.567 215 HA MET 29 HA MET 29 -1.117 -8.239 -17.134 216 HB2 MET 29 2HB MET 29 -0.219 -8.898 -14.402 217 HB3 MET 29 1HB MET 29 0.653 -9.607 -15.735 218 HG2 MET 29 2HG MET 29 0.907 -7.180 -16.603 219 HG3 MET 29 1HG MET 29 0.350 -6.684 -15.015 220 HE1 MET 29 3HE MET 29 4.154 -5.977 -15.066 221 HE2 MET 29 1HE MET 29 2.543 -5.296 -14.878 222 HE3 MET 29 2HE MET 29 3.050 -5.892 -16.454 223 H ILE 30 H ILE 30 -2.804 -10.409 -15.014 224 HA ILE 30 HA ILE 30 -2.144 -12.811 -16.370 225 HB ILE 30 HB ILE 30 -4.738 -12.197 -14.905 226 HG12 ILE 30 2HG1 ILE 30 -2.186 -13.458 -13.825 227 HG13 ILE 30 1HG1 ILE 30 -2.811 -11.863 -13.430 228 HG21 ILE 30 1HG2 ILE 30 -4.927 -14.631 -14.629 229 HG22 ILE 30 2HG2 ILE 30 -3.462 -14.842 -15.583 230 HG23 ILE 30 3HG2 ILE 30 -4.912 -14.172 -16.337 231 HD11 ILE 30 3HD1 ILE 30 -4.743 -12.891 -12.389 232 HD12 ILE 30 1HD1 ILE 30 -3.235 -13.474 -11.690 233 HD13 ILE 30 2HD1 ILE 30 -4.131 -14.486 -12.824 234 H ILE 31 H ILE 31 -4.758 -10.511 -16.795 235 HA ILE 31 HA ILE 31 -6.056 -11.924 -18.839 236 HB ILE 31 HB ILE 31 -6.183 -8.958 -18.254 237 HG12 ILE 31 2HG1 ILE 31 -7.911 -11.270 -17.377 238 HG13 ILE 31 1HG1 ILE 31 -6.844 -10.320 -16.354 239 HG21 ILE 31 1HG2 ILE 31 -6.947 -9.573 -20.501 240 HG22 ILE 31 2HG2 ILE 31 -8.296 -9.051 -19.455 241 HG23 ILE 31 3HG2 ILE 31 -8.014 -10.777 -19.739 242 HD11 ILE 31 3HD1 ILE 31 -8.209 -8.345 -16.822 243 HD12 ILE 31 1HD1 ILE 31 -9.128 -9.645 -16.038 244 HD13 ILE 31 2HD1 ILE 31 -9.293 -9.356 -17.778 245 H THR 32 H THR 32 -3.601 -9.347 -18.912 246 HA THR 32 HA THR 32 -3.774 -9.036 -21.722 247 HB THR 32 HB THR 32 -1.725 -7.622 -21.422 248 HG1 THR 32 1HG THR 32 -2.068 -7.706 -18.691 249 HG21 THR 32 3HG2 THR 32 -4.011 -7.065 -19.510 250 HG22 THR 32 1HG2 THR 32 -3.991 -6.670 -21.223 251 HG23 THR 32 2HG2 THR 32 -2.869 -5.872 -20.119 252 H LYS 33 H LYS 33 -1.851 -10.959 -19.545 253 HA LYS 33 HA LYS 33 -0.459 -12.797 -19.867 254 HB2 LYS 33 2HB LYS 33 -1.260 -12.542 -22.793 255 HB3 LYS 33 1HB LYS 33 -0.394 -13.895 -22.106 256 HG2 LYS 33 2HG LYS 33 -3.113 -13.169 -21.095 257 HG3 LYS 33 1HG LYS 33 -2.949 -14.041 -22.609 258 HD2 LYS 33 2HD LYS 33 -3.379 -15.573 -20.757 259 HD3 LYS 33 1HD LYS 33 -1.787 -15.861 -21.427 260 HE2 LYS 33 2HE LYS 33 -0.768 -14.716 -19.567 261 HE3 LYS 33 1HE LYS 33 -2.357 -14.269 -18.926 262 HZ1 LYS 33 3HZ LYS 33 -1.359 -16.166 -17.810 263 HZ2 LYS 33 1HZ LYS 33 -1.338 -17.045 -19.239 264 HZ3 LYS 33 2HZ LYS 33 -2.807 -16.614 -18.555 265 H SER 34 H SER 34 0.154 -9.809 -20.859 266 HA SER 34 HA SER 34 2.535 -10.470 -22.452 267 HB2 SER 34 2HB SER 34 0.860 -9.191 -23.652 268 HB3 SER 34 1HB SER 34 0.896 -7.945 -22.416 269 HG SER 34 HG SER 34 2.133 -7.632 -24.398 270 H SER 35 H SER 35 1.731 -9.268 -19.357 271 HA SER 35 HA SER 35 2.743 -7.967 -17.795 272 HB2 SER 35 2HB SER 35 5.269 -8.163 -17.575 273 HB3 SER 35 1HB SER 35 4.455 -9.709 -17.701 274 HG SER 35 HG SER 35 5.124 -8.905 -20.154 275 H LYS 36 H LYS 36 1.929 -6.750 -20.214 276 HA LYS 36 HA LYS 36 3.103 -4.219 -20.119 277 HB2 LYS 36 2HB LYS 36 3.259 -5.948 -22.618 278 HB3 LYS 36 1HB LYS 36 3.394 -4.205 -22.644 279 HG2 LYS 36 2HG LYS 36 5.289 -6.090 -21.248 280 HG3 LYS 36 1HG LYS 36 5.558 -5.360 -22.828 281 HD2 LYS 36 2HD LYS 36 5.208 -3.831 -20.239 282 HD3 LYS 36 1HD LYS 36 6.753 -4.196 -20.997 283 HE2 LYS 36 2HE LYS 36 4.545 -2.555 -22.261 284 HE3 LYS 36 1HE LYS 36 5.959 -1.890 -21.462 285 HZ1 LYS 36 3HZ LYS 36 6.218 -1.943 -23.859 286 HZ2 LYS 36 1HZ LYS 36 6.048 -3.616 -23.898 287 HZ3 LYS 36 2HZ LYS 36 7.358 -2.913 -23.102 288 H GLY 37 H GLY 37 1.730 -2.933 -21.378 289 HA2 GLY 37 2HA GLY 37 -0.394 -3.216 -22.851 290 HA3 GLY 37 1HA GLY 37 -1.002 -3.933 -21.358 291 H ASP 38 H ASP 38 -2.320 -1.749 -22.102 292 HA ASP 38 HA ASP 38 -1.020 0.384 -20.609 293 HB2 ASP 38 2HB ASP 38 -2.100 0.952 -22.812 294 HB3 ASP 38 1HB ASP 38 -3.651 0.520 -22.101 295 H PHE 39 H PHE 39 -1.328 0.401 -18.591 296 HA PHE 39 HA PHE 39 -3.775 -0.803 -17.532 297 HB2 PHE 39 2HB PHE 39 -1.058 -0.548 -16.226 298 HB3 PHE 39 1HB PHE 39 -2.478 -1.292 -15.503 299 HD1 PHE 39 1HD PHE 39 -3.489 -3.255 -16.821 300 HD2 PHE 39 2HD PHE 39 0.490 -1.888 -17.377 301 HE1 PHE 39 1HE PHE 39 -2.868 -5.435 -17.797 302 HE2 PHE 39 2HE PHE 39 1.105 -4.034 -18.350 303 HZ PHE 39 HZ PHE 39 -0.571 -5.823 -18.560 304 H LEU 40 H LEU 40 -5.082 0.481 -16.489 305 HA LEU 40 HA LEU 40 -4.031 3.058 -15.509 306 HB2 LEU 40 2HB LEU 40 -6.802 2.651 -16.704 307 HB3 LEU 40 1HB LEU 40 -6.102 4.097 -16.032 308 HG LEU 40 HG LEU 40 -5.055 2.773 -18.522 309 HD11 LEU 40 1HD1 LEU 40 -6.851 5.173 -18.192 310 HD12 LEU 40 2HD1 LEU 40 -7.305 3.618 -18.884 311 HD13 LEU 40 3HD1 LEU 40 -6.118 4.638 -19.702 312 HD21 LEU 40 3HD2 LEU 40 -3.388 4.072 -17.344 313 HD22 LEU 40 1HD2 LEU 40 -4.495 5.440 -17.229 314 HD23 LEU 40 2HD2 LEU 40 -3.892 4.925 -18.805 315 H ILE 41 H ILE 41 -4.326 3.334 -13.435 316 HA ILE 41 HA ILE 41 -6.295 1.617 -12.110 317 HB ILE 41 HB ILE 41 -3.768 2.798 -10.921 318 HG12 ILE 41 2HG1 ILE 41 -4.324 0.058 -12.121 319 HG13 ILE 41 1HG1 ILE 41 -3.091 1.215 -12.488 320 HG21 ILE 41 1HG2 ILE 41 -5.762 0.819 -9.832 321 HG22 ILE 41 2HG2 ILE 41 -5.520 2.473 -9.291 322 HG23 ILE 41 3HG2 ILE 41 -4.252 1.265 -9.033 323 HD11 ILE 41 3HD1 ILE 41 -1.930 0.738 -10.420 324 HD12 ILE 41 1HD1 ILE 41 -2.310 -0.765 -11.315 325 HD13 ILE 41 2HD1 ILE 41 -3.275 -0.320 -9.936 326 H ARG 42 H ARG 42 -7.881 2.600 -10.924 327 HA ARG 42 HA ARG 42 -8.023 5.363 -11.092 328 HB2 ARG 42 2HB ARG 42 -9.903 3.723 -11.235 329 HB3 ARG 42 1HB ARG 42 -9.739 3.504 -9.497 330 HG2 ARG 42 2HG ARG 42 -10.417 5.622 -9.027 331 HG3 ARG 42 1HG ARG 42 -10.035 6.207 -10.653 332 HD2 ARG 42 2HD ARG 42 -12.289 6.097 -10.522 333 HD3 ARG 42 1HD ARG 42 -11.810 4.755 -11.511 334 HE ARG 42 HE ARG 42 -12.195 4.088 -8.736 335 HH11 ARG 42 1HH1 ARG 42 -13.698 4.326 -11.937 336 HH12 ARG 42 2HH1 ARG 42 -15.011 3.319 -11.618 337 HH21 ARG 42 1HH2 ARG 42 -14.093 2.659 -8.245 338 HH22 ARG 42 2HH2 ARG 42 -15.231 2.356 -9.449 339 H THR 43 H THR 43 -7.139 6.636 -9.903 340 HA THR 43 HA THR 43 -6.288 5.933 -7.210 341 HB THR 43 HB THR 43 -4.460 6.214 -8.906 342 HG1 THR 43 1HG THR 43 -3.369 7.928 -7.590 343 HG21 THR 43 3HG2 THR 43 -5.394 9.088 -8.956 344 HG22 THR 43 1HG2 THR 43 -5.461 7.948 -10.300 345 HG23 THR 43 2HG2 THR 43 -3.902 8.487 -9.681 346 H LYS 44 H LYS 44 -6.333 7.755 -5.718 347 HA LYS 44 HA LYS 44 -8.471 9.589 -6.461 348 HB2 LYS 44 2HB LYS 44 -7.428 8.745 -3.768 349 HB3 LYS 44 1HB LYS 44 -8.716 9.917 -4.029 350 HG2 LYS 44 2HG LYS 44 -10.139 8.267 -4.978 351 HG3 LYS 44 1HG LYS 44 -8.832 7.081 -5.007 352 HD2 LYS 44 2HD LYS 44 -10.280 6.607 -3.200 353 HD3 LYS 44 1HD LYS 44 -8.713 7.192 -2.601 354 HE2 LYS 44 2HE LYS 44 -10.493 8.174 -1.258 355 HE3 LYS 44 1HE LYS 44 -9.750 9.422 -2.250 356 HZ1 LYS 44 3HZ LYS 44 -12.154 9.601 -2.243 357 HZ2 LYS 44 1HZ LYS 44 -12.323 8.051 -2.806 358 HZ3 LYS 44 2HZ LYS 44 -11.649 9.224 -3.798 359 H LYS 45 H LYS 45 -7.614 11.409 -7.144 360 HA LYS 45 HA LYS 45 -5.108 12.412 -5.967 361 HB2 LYS 45 2HB LYS 45 -5.092 11.719 -8.498 362 HB3 LYS 45 1HB LYS 45 -6.244 13.002 -8.683 363 HG2 LYS 45 2HG LYS 45 -4.634 14.628 -8.047 364 HG3 LYS 45 1HG LYS 45 -3.458 13.362 -7.682 365 HD2 LYS 45 2HD LYS 45 -4.814 13.653 -10.276 366 HD3 LYS 45 1HD LYS 45 -3.215 14.422 -10.004 367 HE2 LYS 45 2HE LYS 45 -4.004 11.469 -10.121 368 HE3 LYS 45 1HE LYS 45 -2.989 12.354 -11.240 369 HZ1 LYS 45 3HZ LYS 45 -2.285 11.679 -8.436 370 HZ2 LYS 45 1HZ LYS 45 -1.319 12.581 -9.501 371 HZ3 LYS 45 2HZ LYS 45 -1.696 10.980 -9.850 372 H ASP 46 H ASP 46 -5.641 13.980 -4.602 373 HA ASP 46 HA ASP 46 -6.543 15.789 -3.637 374 HB2 ASP 46 2HB ASP 46 -5.638 16.920 -5.672 375 HB3 ASP 46 1HB ASP 46 -7.165 16.639 -6.495 376 H GLY 47 H GLY 47 -8.099 13.483 -3.963 377 HA2 GLY 47 2HA GLY 47 -10.184 12.959 -3.051 378 HA3 GLY 47 1HA GLY 47 -10.673 14.627 -3.292 379 H LYS 48 H LYS 48 -9.317 13.286 -6.092 380 HA LYS 48 HA LYS 48 -12.038 12.692 -7.055 381 HB2 LYS 48 2HB LYS 48 -9.716 13.786 -8.652 382 HB3 LYS 48 1HB LYS 48 -11.341 13.491 -9.249 383 HG2 LYS 48 2HG LYS 48 -12.204 15.206 -7.737 384 HG3 LYS 48 1HG LYS 48 -10.566 15.509 -7.154 385 HD2 LYS 48 2HD LYS 48 -9.915 16.106 -9.474 386 HD3 LYS 48 1HD LYS 48 -11.594 15.899 -9.963 387 HE2 LYS 48 2HE LYS 48 -10.568 17.872 -7.924 388 HE3 LYS 48 1HE LYS 48 -11.077 18.256 -9.565 389 HZ1 LYS 48 3HZ LYS 48 -13.315 17.538 -8.987 390 HZ2 LYS 48 1HZ LYS 48 -12.766 18.774 -7.980 391 HZ3 LYS 48 2HZ LYS 48 -12.813 17.193 -7.396 392 H GLN 49 H GLN 49 -12.330 10.729 -7.929 393 HA GLN 49 HA GLN 49 -10.167 8.822 -8.099 394 HB2 GLN 49 2HB GLN 49 -13.049 8.645 -9.008 395 HB3 GLN 49 1HB GLN 49 -11.921 7.308 -8.929 396 HG2 GLN 49 2HG GLN 49 -11.873 7.441 -6.527 397 HG3 GLN 49 1HG GLN 49 -12.879 8.891 -6.562 398 HE21 GLN 49 1HE2 GLN 49 -12.833 5.430 -6.971 399 HE22 GLN 49 2HE2 GLN 49 -14.549 5.235 -6.992 400 H VAL 50 H VAL 50 -8.896 8.753 -9.839 401 HA VAL 50 HA VAL 50 -10.036 9.287 -12.494 402 HB VAL 50 HB VAL 50 -7.963 10.498 -13.161 403 HG11 VAL 50 1HG1 VAL 50 -8.424 12.636 -12.036 404 HG12 VAL 50 2HG1 VAL 50 -9.389 11.780 -10.831 405 HG13 VAL 50 3HG1 VAL 50 -9.908 11.815 -12.517 406 HG21 VAL 50 3HG2 VAL 50 -6.409 11.342 -11.442 407 HG22 VAL 50 1HG2 VAL 50 -6.432 9.574 -11.475 408 HG23 VAL 50 2HG2 VAL 50 -7.288 10.436 -10.212 409 H TRP 51 H TRP 51 -8.717 8.303 -14.238 410 HA TRP 51 HA TRP 51 -7.452 5.880 -13.262 411 HB2 TRP 51 2HB TRP 51 -8.199 6.756 -16.070 412 HB3 TRP 51 1HB TRP 51 -7.557 5.208 -15.702 413 HD1 TRP 51 HD TRP 51 -10.593 6.901 -16.224 414 HE1 TRP 51 1HE TRP 51 -12.659 5.434 -15.531 415 HE3 TRP 51 3HE TRP 51 -8.155 3.430 -13.538 416 HZ2 TRP 51 2HZ TRP 51 -13.105 3.105 -14.022 417 HZ3 TRP 51 3HZ TRP 51 -9.431 1.589 -12.490 418 HH2 TRP 51 HH TRP 51 -11.852 1.443 -12.722 419 H GLU 52 H GLU 52 -5.361 5.970 -12.934 420 HA GLU 52 HA GLU 52 -3.713 7.745 -14.594 421 HB2 GLU 52 2HB GLU 52 -3.816 8.394 -12.209 422 HB3 GLU 52 1HB GLU 52 -3.274 6.789 -11.752 423 HG2 GLU 52 2HG GLU 52 -1.166 7.186 -12.915 424 HG3 GLU 52 1HG GLU 52 -1.712 8.809 -13.335 425 H ALA 53 H ALA 53 -1.805 6.858 -15.379 426 HA ALA 53 HA ALA 53 -1.883 4.128 -16.025 427 HB1 ALA 53 1HB ALA 53 0.469 5.998 -16.181 428 HB2 ALA 53 2HB ALA 53 -0.771 5.821 -17.421 429 HB3 ALA 53 3HB ALA 53 0.294 4.467 -17.033 430 H ALA 54 H ALA 54 -0.947 2.418 -15.250 431 HA ALA 54 HA ALA 54 -0.087 2.254 -12.570 432 HB1 ALA 54 1HB ALA 54 0.371 0.291 -14.813 433 HB2 ALA 54 2HB ALA 54 -1.061 0.351 -13.782 434 HB3 ALA 54 3HB ALA 54 0.512 -0.055 -13.091 435 H SER 55 H SER 55 2.065 1.521 -11.859 436 HA SER 55 HA SER 55 4.058 3.197 -13.123 437 HB2 SER 55 2HB SER 55 3.722 3.491 -10.728 438 HB3 SER 55 1HB SER 55 3.930 1.762 -10.461 439 HG SER 55 HG SER 55 5.748 3.742 -10.704 440 H LYS 56 H LYS 56 5.985 2.346 -13.861 441 HA LYS 56 HA LYS 56 5.955 -0.296 -14.813 442 HB2 LYS 56 2HB LYS 56 8.213 1.677 -14.487 443 HB3 LYS 56 1HB LYS 56 8.515 0.043 -15.040 444 HG2 LYS 56 2HG LYS 56 8.401 1.585 -16.914 445 HG3 LYS 56 1HG LYS 56 7.086 0.428 -16.993 446 HD2 LYS 56 2HD LYS 56 5.542 2.129 -16.141 447 HD3 LYS 56 1HD LYS 56 6.873 3.287 -16.028 448 HE2 LYS 56 2HE LYS 56 7.240 3.098 -18.451 449 HE3 LYS 56 1HE LYS 56 5.921 1.943 -18.558 450 HZ1 LYS 56 3HZ LYS 56 5.306 4.249 -19.203 451 HZ2 LYS 56 1HZ LYS 56 5.630 4.742 -17.638 452 HZ3 LYS 56 2HZ LYS 56 4.373 3.671 -17.915 453 H THR 57 H THR 57 7.236 1.117 -11.905 454 HA THR 57 HA THR 57 8.510 -1.229 -10.978 455 HB THR 57 HB THR 57 7.544 1.208 -9.462 456 HG1 THR 57 1HG THR 57 9.620 0.668 -11.152 457 HG21 THR 57 3HG2 THR 57 9.592 -0.902 -8.705 458 HG22 THR 57 1HG2 THR 57 8.001 -0.715 -7.969 459 HG23 THR 57 2HG2 THR 57 9.217 0.547 -7.770 460 H ALA 58 H ALA 58 5.284 0.166 -10.429 461 HA ALA 58 HA ALA 58 4.476 -1.795 -8.508 462 HB1 ALA 58 1HB ALA 58 2.713 -0.110 -10.301 463 HB2 ALA 58 2HB ALA 58 3.324 0.387 -8.721 464 HB3 ALA 58 3HB ALA 58 2.201 -0.967 -8.848 465 H LEU 59 H LEU 59 4.297 -1.614 -11.984 466 HA LEU 59 HA LEU 59 2.757 -3.893 -12.423 467 HB2 LEU 59 2HB LEU 59 4.801 -2.390 -13.997 468 HB3 LEU 59 1HB LEU 59 4.016 -3.877 -14.663 469 HG LEU 59 HG LEU 59 2.632 -1.315 -13.832 470 HD11 LEU 59 1HD1 LEU 59 4.144 -0.929 -15.739 471 HD12 LEU 59 2HD1 LEU 59 2.455 -0.881 -16.238 472 HD13 LEU 59 3HD1 LEU 59 3.430 -2.307 -16.576 473 HD21 LEU 59 3HD2 LEU 59 0.771 -2.213 -15.017 474 HD22 LEU 59 1HD2 LEU 59 1.281 -3.440 -13.843 475 HD23 LEU 59 2HD2 LEU 59 1.701 -3.594 -15.548 476 H LYS 60 H LYS 60 6.224 -3.463 -11.837 477 HA LYS 60 HA LYS 60 7.049 -6.075 -12.462 478 HB2 LYS 60 2HB LYS 60 8.278 -4.263 -10.361 479 HB3 LYS 60 1HB LYS 60 9.036 -5.664 -11.103 480 HG2 LYS 60 2HG LYS 60 8.274 -3.109 -12.477 481 HG3 LYS 60 1HG LYS 60 9.899 -3.612 -12.015 482 HD2 LYS 60 2HD LYS 60 9.752 -5.499 -13.565 483 HD3 LYS 60 1HD LYS 60 8.110 -5.017 -14.007 484 HE2 LYS 60 2HE LYS 60 8.979 -2.852 -14.762 485 HE3 LYS 60 1HE LYS 60 10.610 -3.393 -14.374 486 HZ1 LYS 60 3HZ LYS 60 8.820 -4.666 -16.384 487 HZ2 LYS 60 1HZ LYS 60 10.397 -5.134 -16.053 488 HZ3 LYS 60 2HZ LYS 60 10.087 -3.618 -16.744 489 H LYS 61 H LYS 61 5.780 -4.735 -9.441 490 HA LYS 61 HA LYS 61 6.179 -7.092 -7.900 491 HB2 LYS 61 2HB LYS 61 4.296 -4.767 -7.503 492 HB3 LYS 61 1HB LYS 61 4.258 -6.155 -6.438 493 HG2 LYS 61 2HG LYS 61 5.535 -4.342 -5.452 494 HG3 LYS 61 1HG LYS 61 6.579 -5.717 -5.789 495 HD2 LYS 61 2HD LYS 61 7.403 -4.605 -7.790 496 HD3 LYS 61 1HD LYS 61 6.324 -3.243 -7.497 497 HE2 LYS 61 2HE LYS 61 8.594 -2.751 -6.753 498 HE3 LYS 61 1HE LYS 61 7.468 -2.773 -5.399 499 HZ1 LYS 61 3HZ LYS 61 8.285 -4.966 -4.776 500 HZ2 LYS 61 1HZ LYS 61 9.568 -3.894 -4.947 501 HZ3 LYS 61 2HZ LYS 61 9.270 -5.012 -6.151 502 H SER 62 H SER 62 3.633 -6.095 -10.035 503 HA SER 62 HA SER 62 1.757 -8.077 -9.251 504 HB2 SER 62 2HB SER 62 1.973 -6.427 -11.783 505 HB3 SER 62 1HB SER 62 0.539 -7.290 -11.226 506 HG SER 62 HG SER 62 1.741 -4.979 -10.198 507 H TRP 63 H TRP 63 4.266 -7.799 -11.760 508 HA TRP 63 HA TRP 63 3.585 -10.266 -12.966 509 HB2 TRP 63 2HB TRP 63 4.633 -8.495 -14.246 510 HB3 TRP 63 1HB TRP 63 6.051 -8.557 -13.205 511 HD1 TRP 63 HD TRP 63 7.886 -10.130 -13.871 512 HE1 TRP 63 1HE TRP 63 8.205 -11.947 -15.721 513 HE3 TRP 63 3HE TRP 63 3.090 -10.407 -15.568 514 HZ2 TRP 63 2HZ TRP 63 6.599 -13.288 -17.611 515 HZ3 TRP 63 3HZ TRP 63 2.566 -12.013 -17.395 516 HH2 TRP 63 HH TRP 63 4.288 -13.391 -18.375 517 H LYS 64 H LYS 64 5.921 -9.239 -10.530 518 HA LYS 64 HA LYS 64 7.383 -11.649 -10.386 519 HB2 LYS 64 2HB LYS 64 8.089 -9.556 -9.347 520 HB3 LYS 64 1HB LYS 64 6.777 -9.703 -8.184 521 HG2 LYS 64 2HG LYS 64 7.712 -11.793 -7.370 522 HG3 LYS 64 1HG LYS 64 9.021 -11.666 -8.537 523 HD2 LYS 64 2HD LYS 64 8.386 -9.663 -6.451 524 HD3 LYS 64 1HD LYS 64 9.593 -10.964 -6.264 525 HE2 LYS 64 2HE LYS 64 10.813 -10.004 -8.212 526 HE3 LYS 64 1HE LYS 64 9.632 -8.698 -8.279 527 HZ1 LYS 64 3HZ LYS 64 10.333 -7.992 -6.085 528 HZ2 LYS 64 1HZ LYS 64 11.655 -8.045 -7.121 529 HZ3 LYS 64 2HZ LYS 64 11.443 -9.260 -5.999 530 H ARG 65 H ARG 65 4.405 -10.636 -8.856 531 HA ARG 65 HA ARG 65 4.201 -13.020 -7.316 532 HB2 ARG 65 2HB ARG 65 3.114 -10.797 -6.758 533 HB3 ARG 65 1HB ARG 65 2.011 -11.103 -8.057 534 HG2 ARG 65 2HG ARG 65 1.050 -12.992 -6.982 535 HG3 ARG 65 1HG ARG 65 2.293 -12.980 -5.733 536 HD2 ARG 65 2HD ARG 65 0.315 -10.774 -6.228 537 HD3 ARG 65 1HD ARG 65 0.146 -12.017 -4.989 538 HE ARG 65 HE ARG 65 2.630 -10.862 -4.638 539 HH11 ARG 65 1HH1 ARG 65 -0.726 -9.801 -4.473 540 HH12 ARG 65 2HH1 ARG 65 -0.466 -8.629 -3.275 541 HH21 ARG 65 1HH2 ARG 65 3.008 -9.240 -2.956 542 HH22 ARG 65 2HH2 ARG 65 1.698 -8.300 -2.409 543 H TYR 66 H TYR 66 3.224 -12.030 -10.458 544 HA TYR 66 HA TYR 66 1.501 -14.193 -11.221 545 HB2 TYR 66 2HB TYR 66 1.791 -12.032 -12.444 546 HB3 TYR 66 1HB TYR 66 3.411 -12.537 -12.878 547 HD1 TYR 66 2HD TYR 66 -0.150 -13.033 -13.450 548 HD2 TYR 66 1HD TYR 66 3.757 -14.191 -14.573 549 HE1 TYR 66 2HE TYR 66 -1.056 -14.071 -15.461 550 HE2 TYR 66 1HE TYR 66 2.886 -15.229 -16.587 551 HH TYR 66 HH TYR 66 0.926 -16.139 -17.405 552 H GLU 67 H GLU 67 5.023 -13.687 -11.565 553 HA GLU 67 HA GLU 67 5.939 -16.148 -12.614 554 HB2 GLU 67 2HB GLU 67 7.162 -14.578 -10.329 555 HB3 GLU 67 1HB GLU 67 7.990 -15.736 -11.348 556 HG2 GLU 67 2HG GLU 67 6.705 -13.310 -12.390 557 HG3 GLU 67 1HG GLU 67 8.341 -13.245 -11.737 558 H GLN 68 H GLN 68 5.254 -15.179 -9.296 559 HA GLN 68 HA GLN 68 6.078 -17.319 -7.914 560 HB2 GLN 68 2HB GLN 68 5.577 -15.192 -7.036 561 HB3 GLN 68 1HB GLN 68 3.927 -15.287 -7.595 562 HG2 GLN 68 2HG GLN 68 4.056 -15.474 -5.349 563 HG3 GLN 68 1HG GLN 68 3.510 -17.011 -6.073 564 HE21 GLN 68 1HE2 GLN 68 4.107 -18.162 -4.168 565 HE22 GLN 68 2HE2 GLN 68 5.754 -18.511 -3.786 566 H GLU 69 H GLU 69 2.755 -16.762 -9.300 567 HA GLU 69 HA GLU 69 1.967 -19.318 -8.250 568 HB2 GLU 69 2HB GLU 69 -0.218 -19.054 -9.209 569 HB3 GLU 69 1HB GLU 69 0.256 -17.523 -8.510 570 HG2 GLU 69 2HG GLU 69 0.582 -16.549 -10.628 571 HG3 GLU 69 1HG GLU 69 0.492 -18.119 -11.438 572 H MET 70 H MET 70 2.891 -18.164 -11.441 573 HA MET 70 HA MET 70 2.080 -20.589 -12.666 574 HB2 MET 70 2HB MET 70 3.114 -19.762 -14.755 575 HB3 MET 70 1HB MET 70 2.057 -18.589 -14.013 576 HG2 MET 70 2HG MET 70 3.917 -17.418 -14.864 577 HG3 MET 70 1HG MET 70 4.088 -17.439 -13.117 578 HE1 MET 70 3HE MET 70 4.859 -20.337 -15.692 579 HE2 MET 70 1HE MET 70 6.563 -20.037 -16.028 580 HE3 MET 70 2HE MET 70 5.349 -18.860 -16.530 581 H LEU 71 H LEU 71 5.114 -19.559 -11.302 582 HA LEU 71 HA LEU 71 6.645 -21.693 -12.365 583 HB2 LEU 71 2HB LEU 71 7.560 -19.570 -11.626 584 HB3 LEU 71 1HB LEU 71 7.033 -19.841 -9.992 585 HG LEU 71 HG LEU 71 8.566 -21.817 -9.967 586 HD11 LEU 71 1HD1 LEU 71 10.394 -21.822 -11.642 587 HD12 LEU 71 2HD1 LEU 71 9.559 -20.545 -12.525 588 HD13 LEU 71 3HD1 LEU 71 8.815 -22.137 -12.368 589 HD21 LEU 71 3HD2 LEU 71 9.157 -19.738 -8.874 590 HD22 LEU 71 1HD2 LEU 71 9.769 -19.085 -10.391 591 HD23 LEU 71 2HD2 LEU 71 10.589 -20.447 -9.622 592 H LYS 72 H LYS 72 4.500 -21.218 -9.746 593 HA LYS 72 HA LYS 72 5.235 -23.487 -8.165 594 HB2 LYS 72 2HB LYS 72 4.111 -21.386 -7.318 595 HB3 LYS 72 1HB LYS 72 2.683 -21.848 -8.203 596 HG2 LYS 72 2HG LYS 72 3.871 -23.401 -5.899 597 HG3 LYS 72 1HG LYS 72 2.557 -22.245 -5.760 598 HD2 LYS 72 2HD LYS 72 1.264 -23.717 -7.367 599 HD3 LYS 72 1HD LYS 72 2.568 -24.888 -7.209 600 HE2 LYS 72 2HE LYS 72 0.739 -25.423 -5.699 601 HE3 LYS 72 1HE LYS 72 2.197 -24.997 -4.801 602 HZ1 LYS 72 3HZ LYS 72 -0.077 -23.152 -5.327 603 HZ2 LYS 72 1HZ LYS 72 1.284 -22.804 -4.395 604 HZ3 LYS 72 2HZ LYS 72 0.201 -23.968 -3.886 605 H ASN 73 H ASN 73 2.615 -22.692 -10.445 606 HA ASN 73 HA ASN 73 1.570 -25.343 -10.379 607 HB2 ASN 73 2HB ASN 73 0.880 -23.011 -12.143 608 HB3 ASN 73 1HB ASN 73 0.145 -24.594 -12.353 609 HD21 ASN 73 1HD2 ASN 73 -1.224 -25.383 -10.769 610 HD22 ASN 73 2HD2 ASN 73 -1.924 -24.366 -9.569 611 H GLU 74 H GLU 74 3.985 -23.868 -12.314 612 HA GLU 74 HA GLU 74 4.018 -26.008 -14.256 613 HB2 GLU 74 2HB GLU 74 4.865 -23.722 -14.780 614 HB3 GLU 74 1HB GLU 74 6.117 -23.919 -13.566 615 HG2 GLU 74 2HG GLU 74 7.152 -25.657 -14.864 616 HG3 GLU 74 1HG GLU 74 5.848 -25.602 -16.048 617 H LYS 75 H LYS 75 4.783 -25.600 -11.154 618 HA LYS 75 HA LYS 75 5.738 -26.628 -9.527 619 HB2 LYS 75 2HB LYS 75 4.295 -28.468 -10.270 620 HB3 LYS 75 1HB LYS 75 5.607 -29.097 -11.251 621 HG2 LYS 75 2HG LYS 75 6.934 -29.511 -9.280 622 HG3 LYS 75 1HG LYS 75 5.684 -28.798 -8.260 623 HD2 LYS 75 2HD LYS 75 4.127 -30.554 -9.012 624 HD3 LYS 75 1HD LYS 75 5.438 -31.274 -9.952 625 HE2 LYS 75 2HE LYS 75 5.167 -32.417 -7.810 626 HE3 LYS 75 1HE LYS 75 6.725 -31.600 -7.906 627 HZ1 LYS 75 3HZ LYS 75 4.322 -30.585 -6.474 628 HZ2 LYS 75 1HZ LYS 75 5.822 -29.798 -6.547 629 HZ3 LYS 75 2HZ LYS 75 5.671 -31.285 -5.774 630 H VAL 76 H VAL 76 7.473 -25.206 -10.168 631 HA VAL 76 HA VAL 76 9.925 -26.827 -10.315 632 HB VAL 76 HB VAL 76 9.634 -23.808 -10.572 633 HG11 VAL 76 1HG1 VAL 76 11.962 -23.859 -11.334 634 HG12 VAL 76 2HG1 VAL 76 12.024 -25.597 -11.041 635 HG13 VAL 76 3HG1 VAL 76 11.810 -24.482 -9.692 636 HG21 VAL 76 3HG2 VAL 76 10.123 -25.875 -12.708 637 HG22 VAL 76 1HG2 VAL 76 10.129 -24.130 -12.954 638 HG23 VAL 76 2HG2 VAL 76 8.638 -24.951 -12.486 639 H ALA 77 H ALA 77 8.001 -24.616 -8.537 640 HA ALA 77 HA ALA 77 9.320 -25.421 -6.093 641 HB1 ALA 77 1HB ALA 77 10.286 -23.234 -6.631 642 HB2 ALA 77 2HB ALA 77 9.215 -23.140 -5.229 643 HB3 ALA 77 3HB ALA 77 8.663 -22.561 -6.801 644 H ALA 78 H ALA 78 7.608 -26.703 -5.655 645 HA ALA 78 HA ALA 78 5.194 -25.326 -4.839 646 HB1 ALA 78 1HB ALA 78 3.714 -26.896 -5.953 647 HB2 ALA 78 2HB ALA 78 5.096 -27.736 -6.644 648 HB3 ALA 78 3HB ALA 78 4.735 -26.083 -7.144 649 H LYS 79 H LYS 79 5.598 -25.738 -2.764 650 HA LYS 79 HA LYS 79 5.413 -28.514 -1.851 651 HB2 LYS 79 2HB LYS 79 7.125 -26.310 -0.661 652 HB3 LYS 79 1HB LYS 79 6.910 -27.907 0.029 653 HG2 LYS 79 2HG LYS 79 8.200 -27.329 -2.635 654 HG3 LYS 79 1HG LYS 79 9.068 -27.632 -1.131 655 HD2 LYS 79 2HD LYS 79 8.104 -29.873 -1.014 656 HD3 LYS 79 1HD LYS 79 7.170 -29.561 -2.474 657 HE2 LYS 79 2HE LYS 79 9.199 -30.884 -2.927 658 HE3 LYS 79 1HE LYS 79 9.195 -29.338 -3.773 659 HZ1 LYS 79 3HZ LYS 79 10.696 -29.984 -1.289 660 HZ2 LYS 79 1HZ LYS 79 10.662 -28.476 -2.057 661 HZ3 LYS 79 2HZ LYS 79 11.333 -29.802 -2.836 662 H MET 80 H MET 80 3.591 -28.680 -0.709 663 HA MET 80 HA MET 80 2.659 -26.308 0.731 664 HB2 MET 80 2HB MET 80 1.357 -26.550 -1.340 665 HB3 MET 80 1HB MET 80 0.956 -28.199 -0.886 666 HG2 MET 80 2HG MET 80 -0.207 -27.342 1.107 667 HG3 MET 80 1HG MET 80 0.155 -25.702 0.580 668 HE1 MET 80 3HE MET 80 -1.833 -29.004 -0.190 669 HE2 MET 80 1HE MET 80 -0.855 -28.794 -1.643 670 HE3 MET 80 2HE MET 80 -2.598 -28.599 -1.727 671 H LEU 81 H LEU 81 2.801 -26.830 2.779 672 HA LEU 81 HA LEU 81 2.627 -29.542 3.671 673 HB2 LEU 81 2HB LEU 81 2.864 -26.969 5.246 674 HB3 LEU 81 1HB LEU 81 2.821 -28.552 5.983 675 HG LEU 81 HG LEU 81 4.955 -29.092 4.777 676 HD11 LEU 81 1HD1 LEU 81 6.318 -27.277 3.892 677 HD12 LEU 81 2HD1 LEU 81 4.975 -26.154 4.110 678 HD13 LEU 81 3HD1 LEU 81 4.835 -27.486 2.961 679 HD21 LEU 81 3HD2 LEU 81 6.376 -27.784 6.283 680 HD22 LEU 81 1HD2 LEU 81 4.952 -28.423 7.105 681 HD23 LEU 81 2HD2 LEU 81 5.009 -26.725 6.637 682 H GLU 82 H GLU 82 0.693 -30.316 3.296 683 HA GLU 82 HA GLU 82 -1.626 -28.944 4.421 684 HB2 GLU 82 2HB GLU 82 -2.954 -30.419 2.963 685 HB3 GLU 82 1HB GLU 82 -1.776 -29.499 2.047 686 HG2 GLU 82 2HG GLU 82 -0.308 -31.495 2.032 687 HG3 GLU 82 1HG GLU 82 -1.587 -32.395 2.834 688 H LYS 83 H LYS 83 -3.061 -30.111 5.789 689 HA LYS 83 HA LYS 83 -2.138 -32.654 6.789 690 HB2 LYS 83 2HB LYS 83 -0.839 -31.041 8.093 691 HB3 LYS 83 1HB LYS 83 -2.305 -30.204 8.556 692 HG2 LYS 83 2HG LYS 83 -1.491 -31.547 10.389 693 HG3 LYS 83 1HG LYS 83 -3.023 -32.198 9.810 694 HD2 LYS 83 2HD LYS 83 -1.845 -33.953 8.598 695 HD3 LYS 83 1HD LYS 83 -0.294 -33.255 9.070 696 HE2 LYS 83 2HE LYS 83 -0.795 -33.680 11.410 697 HE3 LYS 83 1HE LYS 83 -2.372 -34.347 10.977 698 HZ1 LYS 83 3HZ LYS 83 -1.196 -36.119 9.787 699 HZ2 LYS 83 1HZ LYS 83 -0.775 -36.077 11.405 700 HZ3 LYS 83 2HZ LYS 83 0.292 -35.486 10.266 701 H ASP 84 H ASP 84 -4.108 -33.430 5.996 702 HA ASP 84 HA ASP 84 -6.369 -32.724 7.717 703 HB2 ASP 84 2HB ASP 84 -6.803 -32.125 5.319 704 HB3 ASP 84 1HB ASP 84 -6.533 -33.806 4.882 705 H ALA 85 H ALA 85 -5.832 -34.199 9.238 706 HA ALA 85 HA ALA 85 -6.572 -36.879 8.621 707 HB1 ALA 85 1HB ALA 85 -4.188 -36.955 8.048 708 HB2 ALA 85 2HB ALA 85 -4.517 -37.930 9.480 709 HB3 ALA 85 3HB ALA 85 -3.780 -36.334 9.647 710 H THR 86 H THR 86 -8.198 -36.403 9.969 711 HA THR 86 HA THR 86 -7.593 -36.865 12.744 712 HB THR 86 HB THR 86 -7.562 -34.393 12.606 713 HG1 THR 86 1HG THR 86 -8.513 -35.443 14.444 714 HG21 THR 86 3HG2 THR 86 -8.965 -34.056 10.643 715 HG22 THR 86 1HG2 THR 86 -9.598 -33.128 12.001 716 HG23 THR 86 2HG2 THR 86 -10.377 -34.639 11.520 717 H GLU 87 H GLU 87 -8.836 -38.209 10.396 718 HA GLU 87 HA GLU 87 -11.656 -38.281 10.906 719 HB2 GLU 87 2HB GLU 87 -9.951 -40.193 9.302 720 HB3 GLU 87 1HB GLU 87 -11.702 -40.141 9.306 721 HG2 GLU 87 2HG GLU 87 -11.597 -37.864 8.366 722 HG3 GLU 87 1HG GLU 87 -9.842 -38.028 8.278 723 H VAL 88 H VAL 88 -12.454 -39.217 12.596 724 HA VAL 88 HA VAL 88 -11.155 -41.617 13.570 725 HB VAL 88 HB VAL 88 -12.009 -40.970 15.912 726 HG11 VAL 88 1HG1 VAL 88 -9.639 -40.790 15.307 727 HG12 VAL 88 2HG1 VAL 88 -10.119 -39.446 16.344 728 HG13 VAL 88 3HG1 VAL 88 -9.936 -39.199 14.609 729 HG21 VAL 88 3HG2 VAL 88 -13.588 -39.240 15.205 730 HG22 VAL 88 1HG2 VAL 88 -12.256 -38.266 14.586 731 HG23 VAL 88 2HG2 VAL 88 -12.384 -38.583 16.319 732 H GLY 89 H GLY 89 -12.358 -43.137 12.740 733 HA2 GLY 89 2HA GLY 89 -15.232 -42.948 12.592 734 HA3 GLY 89 1HA GLY 89 -14.246 -44.310 12.085 735 H VAL 90 H VAL 90 -14.764 -42.656 15.136 736 HA VAL 90 HA VAL 90 -14.950 -45.236 16.405 737 HB VAL 90 HB VAL 90 -13.384 -43.715 17.468 738 HG11 VAL 90 1HG1 VAL 90 -14.053 -41.647 18.566 739 HG12 VAL 90 2HG1 VAL 90 -15.671 -41.814 17.884 740 HG13 VAL 90 3HG1 VAL 90 -14.283 -41.583 16.820 741 HG21 VAL 90 3HG2 VAL 90 -14.212 -43.739 19.790 742 HG22 VAL 90 1HG2 VAL 90 -14.524 -45.259 18.951 743 HG23 VAL 90 2HG2 VAL 90 -15.829 -44.101 19.187 744 H LYS 91 H LYS 91 -16.841 -45.936 15.819 745 HA LYS 91 HA LYS 91 -19.152 -44.746 17.139 746 HB2 LYS 91 2HB LYS 91 -19.169 -44.076 14.759 747 HB3 LYS 91 1HB LYS 91 -19.104 -45.773 14.308 748 HG2 LYS 91 2HG LYS 91 -21.258 -46.162 15.335 749 HG3 LYS 91 1HG LYS 91 -21.313 -44.490 15.892 750 HD2 LYS 91 2HD LYS 91 -21.258 -43.707 13.659 751 HD3 LYS 91 1HD LYS 91 -21.138 -45.361 13.036 752 HE2 LYS 91 2HE LYS 91 -23.336 -45.868 14.060 753 HE3 LYS 91 1HE LYS 91 -23.457 -44.197 14.596 754 HZ1 LYS 91 3HZ LYS 91 -23.292 -45.075 11.770 755 HZ2 LYS 91 1HZ LYS 91 -23.464 -43.486 12.293 756 HZ3 LYS 91 2HZ LYS 91 -24.699 -44.600 12.542 757 H ALA 92 H ALA 92 -20.602 -46.299 17.834 758 HA ALA 92 HA ALA 92 -19.547 -48.832 18.436 759 HB1 ALA 92 1HB ALA 92 -22.412 -47.893 18.599 760 HB2 ALA 92 2HB ALA 92 -21.186 -47.660 19.841 761 HB3 ALA 92 3HB ALA 92 -21.719 -49.291 19.431 762 H ALA 93 H ALA 93 -19.266 -50.375 17.039 763 HA ALA 93 HA ALA 93 -21.290 -50.840 14.972 764 HB1 ALA 93 1HB ALA 93 -19.111 -50.206 14.026 765 HB2 ALA 93 2HB ALA 93 -19.507 -51.883 13.642 766 HB3 ALA 93 3HB ALA 93 -18.347 -51.518 14.921 767 H LEU 94 H LEU 94 -22.572 -52.248 16.061 768 HA LEU 94 HA LEU 94 -21.377 -54.818 16.671 769 HB2 LEU 94 2HB LEU 94 -22.481 -55.033 18.811 770 HB3 LEU 94 1HB LEU 94 -21.428 -53.642 18.842 771 HG LEU 94 HG LEU 94 -24.448 -53.519 18.565 772 HD11 LEU 94 1HD1 LEU 94 -24.421 -52.740 20.889 773 HD12 LEU 94 2HD1 LEU 94 -22.687 -53.057 20.963 774 HD13 LEU 94 3HD1 LEU 94 -23.822 -54.388 20.728 775 HD21 LEU 94 3HD2 LEU 94 -24.179 -51.133 19.104 776 HD22 LEU 94 1HD2 LEU 94 -23.326 -51.546 17.617 777 HD23 LEU 94 2HD2 LEU 94 -22.428 -51.339 19.117 778 H GLU 95 H GLU 95 -22.995 -56.487 16.840 779 HA GLU 95 HA GLU 95 -25.448 -55.747 15.435 780 HB2 GLU 95 2HB GLU 95 -25.428 -58.006 14.454 781 HB3 GLU 95 1HB GLU 95 -24.044 -57.046 13.953 782 HG2 GLU 95 2HG GLU 95 -22.647 -58.235 15.571 783 HG3 GLU 95 1HG GLU 95 -24.044 -59.190 16.068 784 H GLU 96 H GLU 96 -27.273 -57.060 15.960 785 HA GLU 96 HA GLU 96 -27.266 -57.702 18.760 786 HB2 GLU 96 2HB GLU 96 -29.699 -58.002 18.479 787 HB3 GLU 96 1HB GLU 96 -29.151 -56.444 17.884 788 HG2 GLU 96 2HG GLU 96 -29.234 -57.322 15.590 789 HG3 GLU 96 1HG GLU 96 -29.844 -58.852 16.220 790 H ALA 97 H ALA 97 -27.572 -59.701 19.631 791 HA ALA 97 HA ALA 97 -27.534 -61.928 17.750 792 HB1 ALA 97 1HB ALA 97 -25.949 -63.109 19.178 793 HB2 ALA 97 2HB ALA 97 -25.900 -61.740 20.281 794 HB3 ALA 97 3HB ALA 97 -25.261 -61.575 18.645 795 H LYS 98 H LYS 98 -29.595 -62.423 18.001 796 HA LYS 98 HA LYS 98 -30.367 -63.422 20.640 797 HB2 LYS 98 2HB LYS 98 -31.433 -61.168 19.977 798 HB3 LYS 98 1HB LYS 98 -32.226 -62.041 18.688 799 HG2 LYS 98 2HG LYS 98 -32.616 -62.600 21.627 800 HG3 LYS 98 1HG LYS 98 -33.665 -61.579 20.662 801 HD2 LYS 98 2HD LYS 98 -34.178 -63.559 19.240 802 HD3 LYS 98 1HD LYS 98 -33.196 -64.546 20.328 803 HE2 LYS 98 2HE LYS 98 -34.650 -63.906 22.206 804 HE3 LYS 98 1HE LYS 98 -35.620 -62.937 21.110 805 HZ1 LYS 98 3HZ LYS 98 -36.177 -65.001 19.898 806 HZ2 LYS 98 1HZ LYS 98 -36.665 -65.021 21.494 807 HZ3 LYS 98 2HZ LYS 98 -35.329 -65.896 21.058 808 H LYS 99 H LYS 99 -30.044 -65.504 20.153 809 HA LYS 99 HA LYS 99 -31.149 -66.591 17.645 810 HB2 LYS 99 2HB LYS 99 -28.710 -66.917 18.120 811 HB3 LYS 99 1HB LYS 99 -29.173 -67.844 19.545 812 HG2 LYS 99 2HG LYS 99 -30.453 -69.363 18.084 813 HG3 LYS 99 1HG LYS 99 -29.848 -68.473 16.697 814 HD2 LYS 99 2HD LYS 99 -27.569 -69.071 17.309 815 HD3 LYS 99 1HD LYS 99 -28.193 -69.978 18.700 816 HE2 LYS 99 2HE LYS 99 -29.592 -71.269 17.131 817 HE3 LYS 99 1HE LYS 99 -28.776 -70.453 15.813 818 HZ1 LYS 99 3HZ LYS 99 -26.661 -71.410 16.543 819 HZ2 LYS 99 1HZ LYS 99 -27.782 -72.631 16.246 820 HZ3 LYS 99 2HZ LYS 99 -27.437 -72.199 17.821 821 H VAL 100 H VAL 100 -32.416 -68.412 17.742 822 HA VAL 100 HA VAL 100 -33.697 -68.828 20.329 823 HB VAL 100 HB VAL 100 -35.562 -69.834 19.059 824 HG11 VAL 100 1HG1 VAL 100 -34.754 -67.103 18.076 825 HG12 VAL 100 2HG1 VAL 100 -35.626 -67.457 19.566 826 HG13 VAL 100 3HG1 VAL 100 -36.379 -67.780 18.004 827 HG21 VAL 100 3HG2 VAL 100 -33.997 -69.020 16.617 828 HG22 VAL 100 1HG2 VAL 100 -35.639 -69.660 16.625 829 HG23 VAL 100 2HG2 VAL 100 -34.298 -70.680 17.148 830 H GLN 101 H GLN 101 -34.687 -71.237 20.272 831 HA GLN 101 HA GLN 101 -32.526 -73.051 19.517 832 HB2 GLN 101 2HB GLN 101 -32.815 -74.252 21.659 833 HB3 GLN 101 1HB GLN 101 -32.254 -72.608 21.907 834 HG2 GLN 101 2HG GLN 101 -34.526 -71.918 22.480 835 HG3 GLN 101 1HG GLN 101 -35.089 -73.570 22.234 836 HE21 GLN 101 1HE2 GLN 101 -35.181 -71.893 24.585 837 HE22 GLN 101 2HE2 GLN 101 -34.379 -72.735 25.856 838 H ILE 102 H ILE 102 -33.328 -75.326 19.623 839 HA ILE 102 HA ILE 102 -36.177 -75.439 19.144 840 HB ILE 102 HB ILE 102 -35.811 -77.235 17.415 841 HG12 ILE 102 2HG1 ILE 102 -33.595 -77.107 16.121 842 HG13 ILE 102 1HG1 ILE 102 -32.924 -76.297 17.524 843 HG21 ILE 102 1HG2 ILE 102 -35.359 -75.711 15.557 844 HG22 ILE 102 2HG2 ILE 102 -34.839 -74.495 16.721 845 HG23 ILE 102 3HG2 ILE 102 -36.504 -75.076 16.739 846 HD11 ILE 102 3HD1 ILE 102 -34.030 -79.103 17.437 847 HD12 ILE 102 1HD1 ILE 102 -33.363 -78.306 18.864 848 HD13 ILE 102 2HD1 ILE 102 -32.326 -78.652 17.477 849 H GLU 103 H GLU 103 -37.257 -77.205 19.900 850 HA GLU 103 HA GLU 103 -35.723 -78.649 21.880 851 HB2 GLU 103 2HB GLU 103 -38.703 -78.565 21.416 852 HB3 GLU 103 1HB GLU 103 -37.932 -79.538 22.657 853 HG2 GLU 103 2HG GLU 103 -38.798 -77.643 23.740 854 HG3 GLU 103 1HG GLU 103 -37.072 -77.349 23.604 855 H LEU 104 H LEU 104 -35.483 -80.769 21.939 856 HA LEU 104 HA LEU 104 -36.787 -82.455 20.009 857 HB2 LEU 104 2HB LEU 104 -34.612 -81.880 18.949 858 HB3 LEU 104 1HB LEU 104 -33.781 -82.410 20.400 859 HG LEU 104 HG LEU 104 -34.565 -84.711 20.002 860 HD11 LEU 104 1HD1 LEU 104 -36.621 -84.244 18.797 861 HD12 LEU 104 2HD1 LEU 104 -35.576 -85.301 17.855 862 HD13 LEU 104 3HD1 LEU 104 -35.699 -83.590 17.445 863 HD21 LEU 104 3HD2 LEU 104 -33.139 -83.466 17.657 864 HD22 LEU 104 1HD2 LEU 104 -33.141 -85.180 18.069 865 HD23 LEU 104 2HD2 LEU 104 -32.394 -84.011 19.160 866 H ASP 105 H ASP 105 -37.942 -83.182 21.666 867 HA ASP 105 HA ASP 105 -36.770 -83.832 24.179 868 HB2 ASP 105 2HB ASP 105 -39.528 -84.508 23.127 869 HB3 ASP 105 1HB ASP 105 -38.998 -84.601 24.798 870 H THR 106 H THR 106 -38.332 -85.708 21.644 871 HA THR 106 HA THR 106 -38.561 -87.903 21.395 872 HB THR 106 HB THR 106 -36.751 -87.421 19.873 873 HG1 THR 106 1HG THR 106 -37.112 -89.465 19.732 874 HG21 THR 106 3HG2 THR 106 -35.091 -86.456 21.412 875 HG22 THR 106 1HG2 THR 106 -34.363 -87.735 20.435 876 HG23 THR 106 2HG2 THR 106 -34.813 -88.058 22.106 877 H SER 107 H SER 107 -39.523 -88.514 23.263 878 HA SER 107 HA SER 107 -37.775 -89.515 25.363 879 HB2 SER 107 2HB SER 107 -40.708 -88.857 25.392 880 HB3 SER 107 1HB SER 107 -39.787 -89.435 26.780 881 HG SER 107 HG SER 107 -38.354 -87.578 26.181 882 H LEU 108 H LEU 108 -39.745 -90.604 22.845 883 HA LEU 108 HA LEU 108 -40.464 -92.594 22.141 884 HB2 LEU 108 2HB LEU 108 -38.156 -93.341 22.526 885 HB3 LEU 108 1HB LEU 108 -38.551 -93.695 24.195 886 HG LEU 108 HG LEU 108 -40.084 -95.450 23.463 887 HD11 LEU 108 1HD1 LEU 108 -40.035 -96.229 21.139 888 HD12 LEU 108 2HD1 LEU 108 -39.039 -94.840 20.696 889 HD13 LEU 108 3HD1 LEU 108 -40.692 -94.599 21.270 890 HD21 LEU 108 3HD2 LEU 108 -37.282 -95.699 22.382 891 HD22 LEU 108 1HD2 LEU 108 -38.363 -97.043 22.735 892 HD23 LEU 108 2HD2 LEU 108 -37.794 -96.008 24.043 893 H SER 109 H SER 109 -42.543 -92.613 22.628 894 HA SER 109 HA SER 109 -43.488 -93.120 25.261 895 HB2 SER 109 2HB SER 109 -44.945 -93.108 22.615 896 HB3 SER 109 1HB SER 109 -45.708 -93.074 24.205 897 HG SER 109 HG SER 109 -43.940 -91.197 24.255 898 H TYR 110 H TYR 110 -42.786 -95.028 25.970 899 HA TYR 110 HA TYR 110 -43.033 -97.374 24.345 900 HB2 TYR 110 2HB TYR 110 -41.952 -98.575 26.225 901 HB3 TYR 110 1HB TYR 110 -41.017 -97.191 25.695 902 HD1 TYR 110 1HD TYR 110 -40.963 -95.136 27.171 903 HD2 TYR 110 2HD TYR 110 -42.726 -98.783 28.445 904 HE1 TYR 110 1HE TYR 110 -40.812 -94.386 29.514 905 HE2 TYR 110 2HE TYR 110 -42.591 -98.037 30.794 906 HH TYR 110 HH TYR 110 -41.910 -94.837 31.647 907 H ILE 111 H ILE 111 -44.589 -98.731 24.334 908 HA ILE 111 HA ILE 111 -46.379 -98.912 26.531 909 HB ILE 111 HB ILE 111 -48.370 -98.949 24.853 910 HG12 ILE 111 2HG1 ILE 111 -48.150 -97.184 23.034 911 HG13 ILE 111 1HG1 ILE 111 -46.419 -97.222 23.300 912 HG21 ILE 111 1HG2 ILE 111 -48.248 -97.403 26.655 913 HG22 ILE 111 2HG2 ILE 111 -48.814 -96.566 25.209 914 HG23 ILE 111 3HG2 ILE 111 -47.147 -96.365 25.751 915 HD11 ILE 111 3HD1 ILE 111 -48.128 -99.496 22.323 916 HD12 ILE 111 1HD1 ILE 111 -46.389 -99.558 22.607 917 HD13 ILE 111 2HD1 ILE 111 -47.034 -98.498 21.356 Start of MODEL 11 1 H1 GLY -1 1HT GLY -1 -2.387 -7.101 -29.133 2 H2 GLY -1 2HT GLY -1 -1.234 -6.112 -29.820 3 H3 GLY -1 3HT GLY -1 -2.386 -6.875 -30.799 4 HA2 GLY -1 1HA GLY -1 -2.948 -4.534 -30.464 5 HA3 GLY -1 2HA GLY -1 -4.142 -5.609 -29.740 6 H SER 0 H SER 0 -3.441 -2.825 -29.032 7 HA SER 0 HA SER 0 -2.135 -3.141 -26.511 8 HB2 SER 0 2HB SER 0 -2.527 -0.629 -26.391 9 HB3 SER 0 1HB SER 0 -1.496 -1.194 -27.711 10 HG SER 0 HG SER 0 -2.990 0.291 -28.471 11 H MET 1 H MET 1 -3.399 -4.293 -25.234 12 HA MET 1 HA MET 1 -6.191 -3.672 -24.862 13 HB2 MET 1 2HB MET 1 -4.386 -5.572 -23.351 14 HB3 MET 1 1HB MET 1 -6.124 -5.434 -23.130 15 HG2 MET 1 2HG MET 1 -6.492 -6.169 -25.403 16 HG3 MET 1 1HG MET 1 -4.755 -6.261 -25.682 17 HE1 MET 1 3HE MET 1 -7.856 -7.807 -23.844 18 HE2 MET 1 1HE MET 1 -6.838 -7.355 -22.475 19 HE3 MET 1 2HE MET 1 -7.112 -9.056 -22.842 20 H THR 2 H THR 2 -7.065 -2.492 -23.250 21 HA THR 2 HA THR 2 -5.200 -1.278 -21.366 22 HB THR 2 HB THR 2 -7.822 -0.205 -22.432 23 HG1 THR 2 1HG THR 2 -5.325 -0.285 -23.468 24 HG21 THR 2 3HG2 THR 2 -7.179 0.650 -20.207 25 HG22 THR 2 1HG2 THR 2 -7.058 1.912 -21.436 26 HG23 THR 2 2HG2 THR 2 -5.600 1.114 -20.853 27 H VAL 3 H VAL 3 -5.490 -1.997 -19.375 28 HA VAL 3 HA VAL 3 -8.122 -3.097 -18.619 29 HB VAL 3 HB VAL 3 -5.510 -3.564 -17.179 30 HG11 VAL 3 1HG1 VAL 3 -7.436 -4.019 -15.845 31 HG12 VAL 3 2HG1 VAL 3 -6.624 -5.528 -16.359 32 HG13 VAL 3 3HG1 VAL 3 -8.101 -5.022 -17.155 33 HG21 VAL 3 3HG2 VAL 3 -6.729 -5.392 -19.234 34 HG22 VAL 3 1HG2 VAL 3 -5.370 -5.738 -18.156 35 HG23 VAL 3 2HG2 VAL 3 -5.201 -4.496 -19.404 36 H TYR 4 H TYR 4 -9.137 -2.215 -16.825 37 HA TYR 4 HA TYR 4 -7.781 0.061 -15.599 38 HB2 TYR 4 2HB TYR 4 -10.730 -0.594 -15.779 39 HB3 TYR 4 1HB TYR 4 -10.032 0.828 -15.001 40 HD1 TYR 4 2HD TYR 4 -10.404 -0.874 -18.283 41 HD2 TYR 4 1HD TYR 4 -9.487 2.743 -16.263 42 HE1 TYR 4 2HE TYR 4 -10.450 0.310 -20.420 43 HE2 TYR 4 1HE TYR 4 -9.530 3.951 -18.395 44 HH TYR 4 HH TYR 4 -10.746 2.517 -21.271 45 H ILE 5 H ILE 5 -7.344 0.049 -13.507 46 HA ILE 5 HA ILE 5 -8.228 -2.270 -11.886 47 HB ILE 5 HB ILE 5 -5.755 -0.590 -11.441 48 HG12 ILE 5 2HG1 ILE 5 -4.372 -2.386 -11.977 49 HG13 ILE 5 1HG1 ILE 5 -5.622 -3.500 -12.389 50 HG21 ILE 5 1HG2 ILE 5 -6.635 -1.520 -9.416 51 HG22 ILE 5 2HG2 ILE 5 -5.104 -2.312 -9.811 52 HG23 ILE 5 3HG2 ILE 5 -6.639 -3.130 -10.110 53 HD11 ILE 5 3HD1 ILE 5 -4.683 -1.042 -13.920 54 HD12 ILE 5 1HD1 ILE 5 -6.129 -1.947 -14.361 55 HD13 ILE 5 2HD1 ILE 5 -4.553 -2.728 -14.413 56 H CYS 6 H CYS 6 -9.669 -1.599 -10.406 57 HA CYS 6 HA CYS 6 -8.934 0.766 -8.905 58 HB2 CYS 6 2HB CYS 6 -10.985 1.322 -10.182 59 HB3 CYS 6 1HB CYS 6 -11.787 -0.075 -9.471 60 HG CYS 6 HG CYS 6 -12.883 1.901 -8.100 61 HA PRO 7 HA PRO 7 -8.544 -2.818 -6.145 62 HB2 PRO 7 2HB PRO 7 -7.337 -0.695 -4.463 63 HB3 PRO 7 1HB PRO 7 -6.692 -2.278 -4.910 64 HG2 PRO 7 2HG PRO 7 -5.714 -0.062 -6.003 65 HG3 PRO 7 1HG PRO 7 -5.929 -1.535 -6.964 66 HD2 PRO 7 2HD PRO 7 -7.615 0.937 -6.894 67 HD3 PRO 7 1HD PRO 7 -7.120 -0.076 -8.275 68 H GLU 8 H GLU 8 -10.085 0.258 -5.694 69 HA GLU 8 HA GLU 8 -11.027 -0.265 -3.091 70 HB2 GLU 8 2HB GLU 8 -10.344 1.952 -3.931 71 HB3 GLU 8 1HB GLU 8 -11.647 1.862 -5.092 72 HG2 GLU 8 2HG GLU 8 -13.227 1.700 -3.352 73 HG3 GLU 8 1HG GLU 8 -11.893 1.755 -2.174 74 H THR 9 H THR 9 -12.651 0.508 -6.211 75 HA THR 9 HA THR 9 -15.068 -0.628 -5.079 76 HB THR 9 HB THR 9 -16.239 0.718 -6.791 77 HG1 THR 9 1HG THR 9 -14.995 2.236 -7.922 78 HG21 THR 9 3HG2 THR 9 -14.248 2.226 -5.097 79 HG22 THR 9 1HG2 THR 9 -15.803 1.617 -4.538 80 HG23 THR 9 2HG2 THR 9 -15.744 2.893 -5.762 81 H GLY 10 H GLY 10 -12.710 -1.564 -7.266 82 HA2 GLY 10 2HA GLY 10 -14.696 -2.994 -8.849 83 HA3 GLY 10 1HA GLY 10 -13.045 -2.845 -9.377 84 H ASP 11 H ASP 11 -12.889 -5.112 -9.603 85 HA ASP 11 HA ASP 11 -12.286 -6.522 -7.190 86 HB2 ASP 11 2HB ASP 11 -14.735 -6.798 -7.219 87 HB3 ASP 11 1HB ASP 11 -14.621 -7.513 -8.829 88 H ASP 12 H ASP 12 -11.240 -8.390 -7.502 89 HA ASP 12 HA ASP 12 -9.430 -8.556 -9.615 90 HB2 ASP 12 2HB ASP 12 -9.075 -9.482 -7.352 91 HB3 ASP 12 1HB ASP 12 -10.277 -10.715 -7.684 92 H GLY 13 H GLY 13 -12.529 -10.263 -9.171 93 HA2 GLY 13 2HA GLY 13 -11.949 -12.017 -11.427 94 HA3 GLY 13 1HA GLY 13 -13.341 -12.100 -10.370 95 H ASN 14 H ASN 14 -12.577 -9.030 -11.786 96 HA ASN 14 HA ASN 14 -15.034 -9.198 -13.346 97 HB2 ASN 14 2HB ASN 14 -13.242 -6.860 -12.735 98 HB3 ASN 14 1HB ASN 14 -14.646 -6.770 -13.785 99 HD21 ASN 14 1HD2 ASN 14 -14.104 -5.389 -11.332 100 HD22 ASN 14 2HD2 ASN 14 -15.398 -5.809 -10.263 101 H ASP 15 H ASP 15 -14.894 -7.749 -15.472 102 HA ASP 15 HA ASP 15 -13.197 -9.150 -17.313 103 HB2 ASP 15 2HB ASP 15 -15.064 -6.800 -17.739 104 HB3 ASP 15 1HB ASP 15 -14.236 -7.658 -19.026 105 H GLY 16 H GLY 16 -12.817 -6.413 -15.395 106 HA2 GLY 16 2HA GLY 16 -11.092 -5.007 -15.135 107 HA3 GLY 16 1HA GLY 16 -10.243 -5.865 -16.415 108 H SER 17 H SER 17 -13.298 -4.571 -17.158 109 HA SER 17 HA SER 17 -12.109 -2.571 -18.877 110 HB2 SER 17 2HB SER 17 -15.006 -3.239 -18.320 111 HB3 SER 17 1HB SER 17 -14.427 -2.196 -19.620 112 HG SER 17 HG SER 17 -13.095 -4.485 -19.710 113 H GLU 18 H GLU 18 -13.446 -0.292 -18.778 114 HA GLU 18 HA GLU 18 -12.666 0.842 -16.374 115 HB2 GLU 18 2HB GLU 18 -12.809 2.065 -18.521 116 HB3 GLU 18 1HB GLU 18 -14.561 1.940 -18.467 117 HG2 GLU 18 2HG GLU 18 -14.539 3.236 -16.359 118 HG3 GLU 18 1HG GLU 18 -12.786 3.358 -16.566 119 H LEU 19 H LEU 19 -15.688 -0.447 -17.546 120 HA LEU 19 HA LEU 19 -17.316 0.620 -15.471 121 HB2 LEU 19 2HB LEU 19 -17.880 -1.594 -17.435 122 HB3 LEU 19 1HB LEU 19 -19.051 -0.890 -16.346 123 HG LEU 19 HG LEU 19 -19.460 -0.023 -18.420 124 HD11 LEU 19 1HD1 LEU 19 -19.642 1.647 -16.709 125 HD12 LEU 19 2HD1 LEU 19 -19.104 2.399 -18.214 126 HD13 LEU 19 3HD1 LEU 19 -17.947 2.089 -16.922 127 HD21 LEU 19 3HD2 LEU 19 -17.425 -0.542 -19.612 128 HD22 LEU 19 1HD2 LEU 19 -16.552 0.716 -18.738 129 HD23 LEU 19 2HD2 LEU 19 -17.830 1.154 -19.870 130 H LYS 20 H LYS 20 -15.366 -2.207 -15.843 131 HA LYS 20 HA LYS 20 -16.105 -3.100 -13.107 132 HB2 LYS 20 2HB LYS 20 -15.422 -5.031 -15.314 133 HB3 LYS 20 1HB LYS 20 -15.958 -5.350 -13.690 134 HG2 LYS 20 2HG LYS 20 -18.197 -4.560 -14.182 135 HG3 LYS 20 1HG LYS 20 -17.711 -4.196 -15.845 136 HD2 LYS 20 2HD LYS 20 -17.075 -6.561 -16.142 137 HD3 LYS 20 1HD LYS 20 -17.664 -6.899 -14.520 138 HE2 LYS 20 2HE LYS 20 -19.911 -6.226 -15.199 139 HE3 LYS 20 1HE LYS 20 -19.314 -5.853 -16.815 140 HZ1 LYS 20 3HZ LYS 20 -20.287 -8.031 -16.813 141 HZ2 LYS 20 1HZ LYS 20 -19.321 -8.530 -15.528 142 HZ3 LYS 20 2HZ LYS 20 -18.616 -8.170 -17.018 143 HA PRO 21 HA PRO 21 -11.667 -2.490 -13.796 144 HB2 PRO 21 2HB PRO 21 -11.203 -1.259 -11.411 145 HB3 PRO 21 1HB PRO 21 -11.646 -0.394 -12.880 146 HG2 PRO 21 2HG PRO 21 -13.346 -1.150 -10.549 147 HG3 PRO 21 1HG PRO 21 -13.382 0.316 -11.539 148 HD2 PRO 21 2HD PRO 21 -15.144 -1.740 -11.810 149 HD3 PRO 21 1HD PRO 21 -14.692 -0.645 -13.129 150 H LEU 22 H LEU 22 -10.026 -3.635 -12.891 151 HA LEU 22 HA LEU 22 -10.760 -5.876 -11.215 152 HB2 LEU 22 2HB LEU 22 -8.086 -5.003 -12.269 153 HB3 LEU 22 1HB LEU 22 -8.439 -6.543 -11.513 154 HG LEU 22 HG LEU 22 -9.583 -5.570 -14.110 155 HD11 LEU 22 1HD1 LEU 22 -8.196 -7.284 -15.089 156 HD12 LEU 22 2HD1 LEU 22 -7.491 -7.611 -13.505 157 HD13 LEU 22 3HD1 LEU 22 -7.248 -6.045 -14.269 158 HD21 LEU 22 3HD2 LEU 22 -9.842 -8.217 -12.700 159 HD22 LEU 22 1HD2 LEU 22 -10.419 -7.859 -14.327 160 HD23 LEU 22 2HD2 LEU 22 -11.126 -7.035 -12.942 161 H ARG 23 H ARG 23 -9.597 -6.315 -9.220 162 HA ARG 23 HA ARG 23 -9.110 -3.764 -7.890 163 HB2 ARG 23 2HB ARG 23 -9.601 -4.810 -5.803 164 HB3 ARG 23 1HB ARG 23 -10.740 -5.447 -6.940 165 HG2 ARG 23 2HG ARG 23 -9.380 -7.488 -7.141 166 HG3 ARG 23 1HG ARG 23 -8.284 -6.833 -5.920 167 HD2 ARG 23 2HD ARG 23 -10.255 -6.658 -4.373 168 HD3 ARG 23 1HD ARG 23 -11.193 -7.548 -5.571 169 HE ARG 23 HE ARG 23 -8.725 -8.704 -4.536 170 HH11 ARG 23 1HH1 ARG 23 -12.311 -9.044 -4.895 171 HH12 ARG 23 2HH1 ARG 23 -12.313 -10.469 -3.996 172 HH21 ARG 23 1HH2 ARG 23 -8.874 -10.665 -3.314 173 HH22 ARG 23 2HH2 ARG 23 -10.394 -11.413 -3.097 174 H THR 24 H THR 24 -7.409 -6.139 -9.417 175 HA THR 24 HA THR 24 -4.998 -5.576 -7.880 176 HB THR 24 HB THR 24 -4.229 -7.858 -8.484 177 HG1 THR 24 1HG THR 24 -6.404 -9.179 -9.036 178 HG21 THR 24 3HG2 THR 24 -5.622 -9.093 -6.877 179 HG22 THR 24 1HG2 THR 24 -6.846 -7.829 -6.976 180 HG23 THR 24 2HG2 THR 24 -5.269 -7.467 -6.275 181 H LEU 25 H LEU 25 -3.200 -5.200 -9.111 182 HA LEU 25 HA LEU 25 -3.523 -4.695 -11.924 183 HB2 LEU 25 2HB LEU 25 -2.130 -3.278 -10.471 184 HB3 LEU 25 1HB LEU 25 -1.104 -4.648 -10.125 185 HG LEU 25 HG LEU 25 -0.276 -4.668 -12.399 186 HD11 LEU 25 1HD1 LEU 25 -2.294 -3.952 -13.572 187 HD12 LEU 25 2HD1 LEU 25 -0.932 -2.924 -13.996 188 HD13 LEU 25 3HD1 LEU 25 -2.160 -2.343 -12.876 189 HD21 LEU 25 3HD2 LEU 25 0.844 -2.467 -12.375 190 HD22 LEU 25 1HD2 LEU 25 0.836 -3.246 -10.787 191 HD23 LEU 25 2HD2 LEU 25 -0.291 -1.937 -11.144 192 H TYR 26 H TYR 26 -2.487 -7.163 -9.850 193 HA TYR 26 HA TYR 26 -0.972 -8.887 -11.396 194 HB2 TYR 26 2HB TYR 26 -1.440 -9.072 -8.987 195 HB3 TYR 26 1HB TYR 26 -3.107 -9.471 -9.346 196 HD1 TYR 26 1HD TYR 26 0.369 -10.635 -9.789 197 HD2 TYR 26 2HD TYR 26 -3.728 -11.740 -9.631 198 HE1 TYR 26 1HE TYR 26 0.998 -12.976 -9.723 199 HE2 TYR 26 2HE TYR 26 -3.076 -14.110 -9.559 200 HH TYR 26 HH TYR 26 -1.115 -15.550 -10.176 201 H GLN 27 H GLN 27 -4.581 -8.796 -11.033 202 HA GLN 27 HA GLN 27 -5.014 -10.840 -12.915 203 HB2 GLN 27 2HB GLN 27 -6.705 -10.309 -11.263 204 HB3 GLN 27 1HB GLN 27 -6.878 -8.684 -11.885 205 HG2 GLN 27 2HG GLN 27 -8.764 -10.076 -12.551 206 HG3 GLN 27 1HG GLN 27 -7.871 -9.583 -13.958 207 HE21 GLN 27 1HE2 GLN 27 -8.702 -11.253 -15.138 208 HE22 GLN 27 2HE2 GLN 27 -8.187 -12.882 -14.981 209 H ALA 28 H ALA 28 -4.669 -7.345 -13.269 210 HA ALA 28 HA ALA 28 -5.559 -7.083 -15.863 211 HB1 ALA 28 1HB ALA 28 -5.048 -5.198 -14.338 212 HB2 ALA 28 2HB ALA 28 -4.253 -5.023 -15.889 213 HB3 ALA 28 3HB ALA 28 -3.330 -5.569 -14.485 214 H MET 29 H MET 29 -2.342 -7.958 -14.592 215 HA MET 29 HA MET 29 -1.306 -8.290 -17.166 216 HB2 MET 29 2HB MET 29 -0.322 -8.988 -14.453 217 HB3 MET 29 1HB MET 29 0.489 -9.617 -15.869 218 HG2 MET 29 2HG MET 29 0.762 -7.173 -16.626 219 HG3 MET 29 1HG MET 29 0.205 -6.711 -15.033 220 HE1 MET 29 3HE MET 29 4.019 -6.053 -15.080 221 HE2 MET 29 1HE MET 29 2.424 -5.341 -14.899 222 HE3 MET 29 2HE MET 29 2.927 -5.941 -16.476 223 H ILE 30 H ILE 30 -2.972 -10.432 -14.971 224 HA ILE 30 HA ILE 30 -2.353 -12.851 -16.339 225 HB ILE 30 HB ILE 30 -4.890 -12.227 -14.792 226 HG12 ILE 30 2HG1 ILE 30 -2.327 -13.559 -13.839 227 HG13 ILE 30 1HG1 ILE 30 -2.917 -11.970 -13.372 228 HG21 ILE 30 1HG2 ILE 30 -5.116 -14.671 -14.563 229 HG22 ILE 30 2HG2 ILE 30 -3.690 -14.881 -15.579 230 HG23 ILE 30 3HG2 ILE 30 -5.152 -14.163 -16.256 231 HD11 ILE 30 3HD1 ILE 30 -4.851 -12.995 -12.323 232 HD12 ILE 30 1HD1 ILE 30 -3.342 -13.619 -11.659 233 HD13 ILE 30 2HD1 ILE 30 -4.271 -14.588 -12.802 234 H ILE 31 H ILE 31 -4.966 -10.562 -16.723 235 HA ILE 31 HA ILE 31 -6.363 -11.974 -18.693 236 HB ILE 31 HB ILE 31 -6.297 -8.996 -18.165 237 HG12 ILE 31 2HG1 ILE 31 -8.200 -11.176 -17.319 238 HG13 ILE 31 1HG1 ILE 31 -7.098 -10.284 -16.275 239 HG21 ILE 31 1HG2 ILE 31 -7.040 -9.493 -20.411 240 HG22 ILE 31 2HG2 ILE 31 -8.398 -8.930 -19.396 241 HG23 ILE 31 3HG2 ILE 31 -8.202 -10.656 -19.737 242 HD11 ILE 31 3HD1 ILE 31 -8.334 -8.233 -16.788 243 HD12 ILE 31 1HD1 ILE 31 -9.339 -9.468 -16.018 244 HD13 ILE 31 2HD1 ILE 31 -9.458 -9.185 -17.761 245 H THR 32 H THR 32 -3.821 -9.524 -18.930 246 HA THR 32 HA THR 32 -4.023 -9.456 -21.779 247 HB THR 32 HB THR 32 -2.084 -7.887 -21.597 248 HG1 THR 32 1HG THR 32 -2.397 -7.749 -18.851 249 HG21 THR 32 3HG2 THR 32 -4.398 -7.268 -19.707 250 HG22 THR 32 1HG2 THR 32 -4.427 -7.047 -21.445 251 HG23 THR 32 2HG2 THR 32 -3.329 -6.092 -20.455 252 H LYS 33 H LYS 33 -1.864 -10.855 -19.360 253 HA LYS 33 HA LYS 33 -0.145 -12.251 -19.386 254 HB2 LYS 33 2HB LYS 33 -1.415 -13.217 -21.945 255 HB3 LYS 33 1HB LYS 33 -0.040 -14.003 -21.177 256 HG2 LYS 33 2HG LYS 33 -1.404 -14.319 -19.149 257 HG3 LYS 33 1HG LYS 33 -2.774 -13.613 -19.996 258 HD2 LYS 33 2HD LYS 33 -2.893 -16.036 -20.008 259 HD3 LYS 33 1HD LYS 33 -2.671 -15.416 -21.649 260 HE2 LYS 33 2HE LYS 33 -0.310 -15.983 -21.572 261 HE3 LYS 33 1HE LYS 33 -0.470 -16.472 -19.885 262 HZ1 LYS 33 3HZ LYS 33 -0.468 -18.347 -21.504 263 HZ2 LYS 33 1HZ LYS 33 -1.913 -17.758 -22.122 264 HZ3 LYS 33 2HZ LYS 33 -1.856 -18.268 -20.531 265 H SER 34 H SER 34 -0.036 -9.692 -20.841 266 HA SER 34 HA SER 34 2.247 -10.239 -22.596 267 HB2 SER 34 2HB SER 34 0.415 -8.876 -23.537 268 HB3 SER 34 1HB SER 34 0.632 -7.703 -22.242 269 HG SER 34 HG SER 34 1.639 -7.341 -24.355 270 H SER 35 H SER 35 1.462 -9.110 -19.469 271 HA SER 35 HA SER 35 2.466 -7.959 -17.819 272 HB2 SER 35 2HB SER 35 4.927 -8.360 -17.468 273 HB3 SER 35 1HB SER 35 4.031 -9.835 -17.772 274 HG SER 35 HG SER 35 4.892 -8.859 -20.097 275 H LYS 36 H LYS 36 1.977 -6.609 -20.367 276 HA LYS 36 HA LYS 36 3.242 -4.136 -19.989 277 HB2 LYS 36 2HB LYS 36 3.632 -5.851 -22.453 278 HB3 LYS 36 1HB LYS 36 3.839 -4.117 -22.473 279 HG2 LYS 36 2HG LYS 36 5.454 -6.001 -20.760 280 HG3 LYS 36 1HG LYS 36 5.954 -5.442 -22.356 281 HD2 LYS 36 2HD LYS 36 5.395 -3.663 -19.977 282 HD3 LYS 36 1HD LYS 36 7.000 -4.150 -20.522 283 HE2 LYS 36 2HE LYS 36 6.538 -3.096 -22.710 284 HE3 LYS 36 1HE LYS 36 4.989 -2.540 -22.096 285 HZ1 LYS 36 3HZ LYS 36 6.123 -1.172 -20.483 286 HZ2 LYS 36 1HZ LYS 36 6.707 -0.870 -22.033 287 HZ3 LYS 36 2HZ LYS 36 7.623 -1.791 -20.981 288 H GLY 37 H GLY 37 2.072 -2.733 -21.345 289 HA2 GLY 37 2HA GLY 37 0.223 -2.792 -23.162 290 HA3 GLY 37 1HA GLY 37 -0.637 -3.714 -21.928 291 H ASP 38 H ASP 38 -2.218 -1.936 -22.049 292 HA ASP 38 HA ASP 38 -1.222 0.424 -20.647 293 HB2 ASP 38 2HB ASP 38 -3.801 0.050 -22.188 294 HB3 ASP 38 1HB ASP 38 -3.339 1.518 -21.335 295 H PHE 39 H PHE 39 -1.464 0.357 -18.604 296 HA PHE 39 HA PHE 39 -3.819 -0.993 -17.517 297 HB2 PHE 39 2HB PHE 39 -1.061 -0.791 -16.288 298 HB3 PHE 39 1HB PHE 39 -2.457 -1.578 -15.564 299 HD1 PHE 39 1HD PHE 39 -3.481 -3.511 -16.906 300 HD2 PHE 39 2HD PHE 39 0.437 -2.033 -17.565 301 HE1 PHE 39 1HE PHE 39 -2.861 -5.637 -17.997 302 HE2 PHE 39 2HE PHE 39 1.059 -4.131 -18.656 303 HZ PHE 39 HZ PHE 39 -0.589 -5.944 -18.869 304 H LEU 40 H LEU 40 -5.117 0.426 -16.630 305 HA LEU 40 HA LEU 40 -3.901 2.899 -15.586 306 HB2 LEU 40 2HB LEU 40 -6.756 2.694 -16.636 307 HB3 LEU 40 1HB LEU 40 -5.881 4.067 -16.035 308 HG LEU 40 HG LEU 40 -5.154 2.640 -18.579 309 HD11 LEU 40 1HD1 LEU 40 -6.614 5.238 -18.131 310 HD12 LEU 40 2HD1 LEU 40 -7.303 3.750 -18.785 311 HD13 LEU 40 3HD1 LEU 40 -6.069 4.622 -19.691 312 HD21 LEU 40 3HD2 LEU 40 -3.250 3.720 -17.526 313 HD22 LEU 40 1HD2 LEU 40 -4.167 5.219 -17.353 314 HD23 LEU 40 2HD2 LEU 40 -3.748 4.616 -18.955 315 H ILE 41 H ILE 41 -4.092 3.193 -13.511 316 HA ILE 41 HA ILE 41 -6.062 1.545 -12.136 317 HB ILE 41 HB ILE 41 -3.446 2.604 -11.034 318 HG12 ILE 41 2HG1 ILE 41 -4.196 -0.090 -12.221 319 HG13 ILE 41 1HG1 ILE 41 -2.889 0.973 -12.619 320 HG21 ILE 41 1HG2 ILE 41 -5.506 0.740 -9.881 321 HG22 ILE 41 2HG2 ILE 41 -5.138 2.368 -9.339 322 HG23 ILE 41 3HG2 ILE 41 -3.937 1.077 -9.138 323 HD11 ILE 41 3HD1 ILE 41 -1.723 0.426 -10.569 324 HD12 ILE 41 1HD1 ILE 41 -2.222 -1.047 -11.456 325 HD13 ILE 41 2HD1 ILE 41 -3.123 -0.542 -10.061 326 H ARG 42 H ARG 42 -7.411 2.451 -10.797 327 HA ARG 42 HA ARG 42 -8.005 5.214 -11.027 328 HB2 ARG 42 2HB ARG 42 -9.570 3.259 -10.563 329 HB3 ARG 42 1HB ARG 42 -9.005 3.335 -8.909 330 HG2 ARG 42 2HG ARG 42 -11.080 4.534 -8.986 331 HG3 ARG 42 1HG ARG 42 -9.782 5.696 -8.858 332 HD2 ARG 42 2HD ARG 42 -10.050 6.517 -10.920 333 HD3 ARG 42 1HD ARG 42 -10.695 4.999 -11.619 334 HE ARG 42 HE ARG 42 -12.454 6.142 -9.739 335 HH11 ARG 42 1HH1 ARG 42 -11.255 6.693 -13.045 336 HH12 ARG 42 2HH1 ARG 42 -12.621 7.558 -13.543 337 HH21 ARG 42 1HH2 ARG 42 -14.328 7.309 -10.429 338 HH22 ARG 42 2HH2 ARG 42 -14.424 7.912 -12.022 339 H THR 43 H THR 43 -7.347 6.816 -9.815 340 HA THR 43 HA THR 43 -6.098 6.284 -7.226 341 HB THR 43 HB THR 43 -4.293 6.676 -8.956 342 HG1 THR 43 1HG THR 43 -3.152 8.005 -7.677 343 HG21 THR 43 3HG2 THR 43 -5.557 9.411 -9.161 344 HG22 THR 43 1HG2 THR 43 -5.497 8.188 -10.433 345 HG23 THR 43 2HG2 THR 43 -4.008 8.946 -9.868 346 H LYS 44 H LYS 44 -6.254 8.128 -5.778 347 HA LYS 44 HA LYS 44 -8.567 9.775 -6.485 348 HB2 LYS 44 2HB LYS 44 -8.880 8.140 -4.681 349 HB3 LYS 44 1HB LYS 44 -7.580 8.924 -3.785 350 HG2 LYS 44 2HG LYS 44 -8.929 10.917 -3.530 351 HG3 LYS 44 1HG LYS 44 -10.192 10.229 -4.552 352 HD2 LYS 44 2HD LYS 44 -10.476 8.389 -2.947 353 HD3 LYS 44 1HD LYS 44 -9.266 9.120 -1.898 354 HE2 LYS 44 2HE LYS 44 -11.844 10.435 -2.731 355 HE3 LYS 44 1HE LYS 44 -11.622 9.555 -1.227 356 HZ1 LYS 44 3HZ LYS 44 -10.012 11.161 -0.521 357 HZ2 LYS 44 1HZ LYS 44 -11.401 11.949 -0.965 358 HZ3 LYS 44 2HZ LYS 44 -10.062 11.993 -1.981 359 H LYS 45 H LYS 45 -8.130 11.682 -6.867 360 HA LYS 45 HA LYS 45 -5.950 13.114 -5.525 361 HB2 LYS 45 2HB LYS 45 -5.164 12.348 -7.705 362 HB3 LYS 45 1HB LYS 45 -6.473 13.127 -8.537 363 HG2 LYS 45 2HG LYS 45 -5.603 15.298 -7.595 364 HG3 LYS 45 1HG LYS 45 -4.186 14.374 -7.081 365 HD2 LYS 45 2HD LYS 45 -3.608 15.228 -9.238 366 HD3 LYS 45 1HD LYS 45 -4.084 13.519 -9.402 367 HE2 LYS 45 2HE LYS 45 -5.044 14.869 -11.204 368 HE3 LYS 45 1HE LYS 45 -6.283 14.135 -10.204 369 HZ1 LYS 45 3HZ LYS 45 -5.404 16.969 -10.220 370 HZ2 LYS 45 1HZ LYS 45 -6.433 16.361 -9.012 371 HZ3 LYS 45 2HZ LYS 45 -6.904 16.331 -10.615 372 H ASP 46 H ASP 46 -6.723 14.923 -4.662 373 HA ASP 46 HA ASP 46 -7.996 16.747 -4.149 374 HB2 ASP 46 2HB ASP 46 -8.792 16.613 -7.075 375 HB3 ASP 46 1HB ASP 46 -9.182 17.949 -6.015 376 H GLY 47 H GLY 47 -9.041 14.092 -3.845 377 HA2 GLY 47 2HA GLY 47 -10.999 13.276 -2.931 378 HA3 GLY 47 1HA GLY 47 -11.791 14.782 -3.360 379 H LYS 48 H LYS 48 -10.400 13.902 -6.148 380 HA LYS 48 HA LYS 48 -12.809 12.470 -7.050 381 HB2 LYS 48 2HB LYS 48 -10.846 14.061 -8.747 382 HB3 LYS 48 1HB LYS 48 -12.398 13.348 -9.193 383 HG2 LYS 48 2HG LYS 48 -12.139 15.543 -7.178 384 HG3 LYS 48 1HG LYS 48 -12.436 15.817 -8.891 385 HD2 LYS 48 2HD LYS 48 -14.130 13.972 -7.317 386 HD3 LYS 48 1HD LYS 48 -14.463 15.714 -7.240 387 HE2 LYS 48 2HE LYS 48 -15.938 14.680 -8.877 388 HE3 LYS 48 1HE LYS 48 -14.746 15.634 -9.738 389 HZ1 LYS 48 3HZ LYS 48 -14.694 12.680 -9.416 390 HZ2 LYS 48 1HZ LYS 48 -13.588 13.588 -10.333 391 HZ3 LYS 48 2HZ LYS 48 -15.195 13.536 -10.765 392 H GLN 49 H GLN 49 -12.516 10.642 -8.435 393 HA GLN 49 HA GLN 49 -9.872 9.505 -8.160 394 HB2 GLN 49 2HB GLN 49 -12.531 8.160 -8.668 395 HB3 GLN 49 1HB GLN 49 -10.991 7.349 -8.420 396 HG2 GLN 49 2HG GLN 49 -10.874 8.216 -6.152 397 HG3 GLN 49 1HG GLN 49 -12.389 9.077 -6.390 398 HE21 GLN 49 1HE2 GLN 49 -10.892 6.014 -5.761 399 HE22 GLN 49 2HE2 GLN 49 -12.358 5.168 -5.428 400 H VAL 50 H VAL 50 -8.767 9.014 -9.899 401 HA VAL 50 HA VAL 50 -9.991 9.337 -12.559 402 HB VAL 50 HB VAL 50 -8.055 10.626 -13.375 403 HG11 VAL 50 1HG1 VAL 50 -8.452 12.761 -12.243 404 HG12 VAL 50 2HG1 VAL 50 -9.281 11.908 -10.941 405 HG13 VAL 50 3HG1 VAL 50 -9.958 11.904 -12.567 406 HG21 VAL 50 3HG2 VAL 50 -6.370 11.539 -11.822 407 HG22 VAL 50 1HG2 VAL 50 -6.345 9.774 -11.854 408 HG23 VAL 50 2HG2 VAL 50 -7.097 10.615 -10.508 409 H TRP 51 H TRP 51 -8.280 8.554 -14.299 410 HA TRP 51 HA TRP 51 -7.223 6.060 -13.259 411 HB2 TRP 51 2HB TRP 51 -7.644 6.973 -16.120 412 HB3 TRP 51 1HB TRP 51 -7.033 5.424 -15.686 413 HD1 TRP 51 HD TRP 51 -9.999 7.014 -16.611 414 HE1 TRP 51 1HE TRP 51 -12.107 5.595 -16.043 415 HE3 TRP 51 3HE TRP 51 -7.855 3.731 -13.388 416 HZ2 TRP 51 2HZ TRP 51 -12.719 3.367 -14.406 417 HZ3 TRP 51 3HZ TRP 51 -9.239 1.983 -12.366 418 HH2 TRP 51 HH TRP 51 -11.618 1.802 -12.858 419 H GLU 52 H GLU 52 -5.169 5.816 -12.876 420 HA GLU 52 HA GLU 52 -3.229 7.665 -14.055 421 HB2 GLU 52 2HB GLU 52 -3.469 7.943 -11.666 422 HB3 GLU 52 1HB GLU 52 -3.297 6.217 -11.410 423 HG2 GLU 52 2HG GLU 52 -0.991 6.312 -12.088 424 HG3 GLU 52 1HG GLU 52 -1.151 8.016 -12.498 425 H ALA 53 H ALA 53 -1.757 6.756 -15.304 426 HA ALA 53 HA ALA 53 -1.885 4.039 -16.053 427 HB1 ALA 53 1HB ALA 53 0.351 6.012 -16.522 428 HB2 ALA 53 2HB ALA 53 -1.056 5.787 -17.560 429 HB3 ALA 53 3HB ALA 53 0.120 4.486 -17.374 430 H ALA 54 H ALA 54 -0.925 2.290 -15.331 431 HA ALA 54 HA ALA 54 0.169 2.159 -12.795 432 HB1 ALA 54 1HB ALA 54 0.482 0.147 -15.007 433 HB2 ALA 54 2HB ALA 54 -0.911 0.278 -13.931 434 HB3 ALA 54 3HB ALA 54 0.668 -0.155 -13.280 435 H SER 55 H SER 55 2.255 1.556 -12.075 436 HA SER 55 HA SER 55 4.312 2.974 -13.556 437 HB2 SER 55 2HB SER 55 3.881 3.714 -11.253 438 HB3 SER 55 1HB SER 55 4.122 2.072 -10.667 439 HG SER 55 HG SER 55 5.918 3.316 -10.361 440 H LYS 56 H LYS 56 6.287 1.955 -13.936 441 HA LYS 56 HA LYS 56 6.107 -0.765 -14.583 442 HB2 LYS 56 2HB LYS 56 8.569 0.942 -14.271 443 HB3 LYS 56 1HB LYS 56 8.554 -0.660 -15.013 444 HG2 LYS 56 2HG LYS 56 6.966 0.217 -16.709 445 HG3 LYS 56 1HG LYS 56 7.141 1.815 -16.010 446 HD2 LYS 56 2HD LYS 56 9.380 0.183 -17.240 447 HD3 LYS 56 1HD LYS 56 8.511 1.471 -18.054 448 HE2 LYS 56 2HE LYS 56 10.589 2.390 -17.337 449 HE3 LYS 56 1HE LYS 56 9.373 3.031 -16.249 450 HZ1 LYS 56 3HZ LYS 56 11.180 0.746 -15.642 451 HZ2 LYS 56 1HZ LYS 56 10.145 1.509 -14.519 452 HZ3 LYS 56 2HZ LYS 56 11.439 2.329 -15.196 453 H THR 57 H THR 57 7.303 0.871 -11.741 454 HA THR 57 HA THR 57 8.594 -1.274 -10.494 455 HB THR 57 HB THR 57 7.037 0.948 -9.170 456 HG1 THR 57 1HG THR 57 8.647 2.237 -9.598 457 HG21 THR 57 3HG2 THR 57 9.418 -0.665 -8.239 458 HG22 THR 57 1HG2 THR 57 7.766 -0.820 -7.644 459 HG23 THR 57 2HG2 THR 57 8.672 0.665 -7.352 460 H ALA 58 H ALA 58 5.211 -0.169 -10.368 461 HA ALA 58 HA ALA 58 4.375 -2.194 -8.518 462 HB1 ALA 58 1HB ALA 58 2.712 -0.394 -10.286 463 HB2 ALA 58 2HB ALA 58 3.238 -0.017 -8.643 464 HB3 ALA 58 3HB ALA 58 2.119 -1.345 -8.927 465 H LEU 59 H LEU 59 4.292 -1.789 -12.008 466 HA LEU 59 HA LEU 59 2.764 -4.032 -12.599 467 HB2 LEU 59 2HB LEU 59 4.858 -2.499 -14.103 468 HB3 LEU 59 1HB LEU 59 3.996 -3.932 -14.799 469 HG LEU 59 HG LEU 59 2.689 -1.370 -13.870 470 HD11 LEU 59 1HD1 LEU 59 4.246 -0.913 -15.724 471 HD12 LEU 59 2HD1 LEU 59 2.569 -0.795 -16.248 472 HD13 LEU 59 3HD1 LEU 59 3.518 -2.226 -16.649 473 HD21 LEU 59 3HD2 LEU 59 0.826 -2.186 -15.154 474 HD22 LEU 59 1HD2 LEU 59 1.301 -3.461 -14.017 475 HD23 LEU 59 2HD2 LEU 59 1.764 -3.555 -15.708 476 H LYS 60 H LYS 60 6.281 -3.662 -12.159 477 HA LYS 60 HA LYS 60 6.942 -6.322 -12.774 478 HB2 LYS 60 2HB LYS 60 8.379 -4.439 -10.895 479 HB3 LYS 60 1HB LYS 60 9.024 -5.965 -11.468 480 HG2 LYS 60 2HG LYS 60 8.373 -3.558 -13.137 481 HG3 LYS 60 1HG LYS 60 9.980 -4.121 -12.681 482 HD2 LYS 60 2HD LYS 60 9.566 -6.204 -13.917 483 HD3 LYS 60 1HD LYS 60 7.988 -5.584 -14.417 484 HE2 LYS 60 2HE LYS 60 9.106 -3.680 -15.464 485 HE3 LYS 60 1HE LYS 60 10.663 -4.374 -15.015 486 HZ1 LYS 60 3HZ LYS 60 8.673 -5.563 -16.872 487 HZ2 LYS 60 1HZ LYS 60 10.092 -6.328 -16.378 488 HZ3 LYS 60 2HZ LYS 60 10.175 -4.903 -17.287 489 H LYS 61 H LYS 61 5.955 -4.870 -9.723 490 HA LYS 61 HA LYS 61 6.425 -7.147 -8.120 491 HB2 LYS 61 2HB LYS 61 4.423 -4.920 -7.748 492 HB3 LYS 61 1HB LYS 61 4.837 -6.113 -6.526 493 HG2 LYS 61 2HG LYS 61 7.136 -5.322 -6.542 494 HG3 LYS 61 1HG LYS 61 6.704 -4.106 -7.746 495 HD2 LYS 61 2HD LYS 61 5.129 -3.103 -6.193 496 HD3 LYS 61 1HD LYS 61 5.509 -4.341 -4.989 497 HE2 LYS 61 2HE LYS 61 7.833 -3.572 -4.960 498 HE3 LYS 61 1HE LYS 61 7.426 -2.320 -6.132 499 HZ1 LYS 61 3HZ LYS 61 5.909 -1.362 -4.540 500 HZ2 LYS 61 1HZ LYS 61 7.449 -1.477 -3.863 501 HZ3 LYS 61 2HZ LYS 61 6.257 -2.577 -3.421 502 H SER 62 H SER 62 3.710 -6.155 -10.072 503 HA SER 62 HA SER 62 1.880 -8.096 -9.116 504 HB2 SER 62 2HB SER 62 1.940 -6.513 -11.684 505 HB3 SER 62 1HB SER 62 0.541 -7.362 -11.020 506 HG SER 62 HG SER 62 1.869 -5.072 -10.049 507 H TRP 63 H TRP 63 4.177 -7.974 -11.880 508 HA TRP 63 HA TRP 63 3.306 -10.489 -12.812 509 HB2 TRP 63 2HB TRP 63 4.269 -8.760 -14.290 510 HB3 TRP 63 1HB TRP 63 5.816 -8.950 -13.468 511 HD1 TRP 63 HD TRP 63 7.307 -10.796 -14.220 512 HE1 TRP 63 1HE TRP 63 7.163 -12.694 -16.022 513 HE3 TRP 63 3HE TRP 63 2.403 -10.367 -15.410 514 HZ2 TRP 63 2HZ TRP 63 5.178 -13.816 -17.698 515 HZ3 TRP 63 3HZ TRP 63 1.423 -11.879 -17.099 516 HH2 TRP 63 HH TRP 63 2.788 -13.557 -18.220 517 H LYS 64 H LYS 64 5.722 -9.349 -10.586 518 HA LYS 64 HA LYS 64 7.332 -11.603 -10.379 519 HB2 LYS 64 2HB LYS 64 7.850 -9.473 -9.281 520 HB3 LYS 64 1HB LYS 64 6.491 -9.692 -8.193 521 HG2 LYS 64 2HG LYS 64 7.567 -11.673 -7.246 522 HG3 LYS 64 1HG LYS 64 8.933 -11.439 -8.339 523 HD2 LYS 64 2HD LYS 64 9.354 -9.269 -7.349 524 HD3 LYS 64 1HD LYS 64 7.997 -9.495 -6.241 525 HE2 LYS 64 2HE LYS 64 9.112 -11.488 -5.314 526 HE3 LYS 64 1HE LYS 64 10.462 -11.221 -6.413 527 HZ1 LYS 64 3HZ LYS 64 9.603 -9.364 -4.257 528 HZ2 LYS 64 1HZ LYS 64 10.895 -9.110 -5.302 529 HZ3 LYS 64 2HZ LYS 64 10.929 -10.391 -4.213 530 H ARG 65 H ARG 65 4.220 -10.859 -8.947 531 HA ARG 65 HA ARG 65 4.112 -13.193 -7.305 532 HB2 ARG 65 2HB ARG 65 2.798 -11.058 -6.928 533 HB3 ARG 65 1HB ARG 65 1.835 -11.503 -8.300 534 HG2 ARG 65 2HG ARG 65 1.044 -13.504 -7.233 535 HG3 ARG 65 1HG ARG 65 2.076 -13.205 -5.834 536 HD2 ARG 65 2HD ARG 65 0.852 -11.158 -5.363 537 HD3 ARG 65 1HD ARG 65 -0.163 -11.422 -6.784 538 HE ARG 65 HE ARG 65 -0.439 -13.687 -5.357 539 HH11 ARG 65 1HH1 ARG 65 -0.900 -10.269 -4.535 540 HH12 ARG 65 2HH1 ARG 65 -2.127 -10.592 -3.381 541 HH21 ARG 65 1HH2 ARG 65 -2.130 -14.092 -3.782 542 HH22 ARG 65 2HH2 ARG 65 -2.824 -12.786 -2.955 543 H TYR 66 H TYR 66 3.279 -12.415 -10.554 544 HA TYR 66 HA TYR 66 1.668 -14.705 -11.293 545 HB2 TYR 66 2HB TYR 66 2.037 -12.493 -12.575 546 HB3 TYR 66 1HB TYR 66 3.577 -13.180 -13.066 547 HD1 TYR 66 1HD TYR 66 3.373 -15.598 -14.160 548 HD2 TYR 66 2HD TYR 66 0.238 -12.750 -13.933 549 HE1 TYR 66 1HE TYR 66 2.275 -16.689 -16.030 550 HE2 TYR 66 2HE TYR 66 -0.888 -13.798 -15.789 551 HH TYR 66 HH TYR 66 -0.099 -16.881 -16.920 552 H GLU 67 H GLU 67 5.121 -13.966 -11.431 553 HA GLU 67 HA GLU 67 6.250 -16.346 -12.385 554 HB2 GLU 67 2HB GLU 67 7.173 -14.589 -10.123 555 HB3 GLU 67 1HB GLU 67 8.163 -15.789 -10.930 556 HG2 GLU 67 2HG GLU 67 6.847 -13.521 -12.230 557 HG3 GLU 67 1HG GLU 67 8.500 -13.406 -11.618 558 H GLN 68 H GLN 68 5.276 -15.444 -9.233 559 HA GLN 68 HA GLN 68 6.128 -17.687 -7.807 560 HB2 GLN 68 2HB GLN 68 3.669 -16.051 -7.189 561 HB3 GLN 68 1HB GLN 68 4.460 -17.153 -6.079 562 HG2 GLN 68 2HG GLN 68 5.685 -14.660 -7.244 563 HG3 GLN 68 1HG GLN 68 4.989 -14.809 -5.637 564 HE21 GLN 68 1HE2 GLN 68 6.898 -14.228 -4.683 565 HE22 GLN 68 2HE2 GLN 68 8.281 -15.266 -4.596 566 H GLU 69 H GLU 69 2.923 -17.247 -9.386 567 HA GLU 69 HA GLU 69 2.185 -19.907 -8.607 568 HB2 GLU 69 2HB GLU 69 0.152 -19.682 -9.956 569 HB3 GLU 69 1HB GLU 69 0.365 -18.290 -8.916 570 HG2 GLU 69 2HG GLU 69 0.957 -16.908 -10.738 571 HG3 GLU 69 1HG GLU 69 1.148 -18.295 -11.812 572 H MET 70 H MET 70 3.463 -18.480 -11.620 573 HA MET 70 HA MET 70 2.986 -20.706 -13.161 574 HB2 MET 70 2HB MET 70 3.225 -18.506 -14.071 575 HB3 MET 70 1HB MET 70 4.852 -18.380 -13.412 576 HG2 MET 70 2HG MET 70 5.624 -20.042 -14.807 577 HG3 MET 70 1HG MET 70 3.984 -20.401 -15.380 578 HE1 MET 70 3HE MET 70 6.040 -16.332 -16.237 579 HE2 MET 70 1HE MET 70 6.792 -17.605 -15.269 580 HE3 MET 70 2HE MET 70 5.324 -16.815 -14.700 581 H LEU 71 H LEU 71 5.731 -19.729 -11.157 582 HA LEU 71 HA LEU 71 7.400 -21.856 -12.039 583 HB2 LEU 71 2HB LEU 71 8.275 -19.760 -11.264 584 HB3 LEU 71 1HB LEU 71 7.525 -19.930 -9.705 585 HG LEU 71 HG LEU 71 8.996 -21.890 -9.307 586 HD11 LEU 71 1HD1 LEU 71 10.971 -22.182 -10.768 587 HD12 LEU 71 2HD1 LEU 71 10.309 -20.976 -11.876 588 HD13 LEU 71 3HD1 LEU 71 9.463 -22.500 -11.624 589 HD21 LEU 71 3HD2 LEU 71 9.578 -19.714 -8.415 590 HD22 LEU 71 1HD2 LEU 71 10.367 -19.283 -9.935 591 HD23 LEU 71 2HD2 LEU 71 11.038 -20.563 -8.926 592 H LYS 72 H LYS 72 4.907 -21.432 -9.746 593 HA LYS 72 HA LYS 72 5.551 -23.577 -7.955 594 HB2 LYS 72 2HB LYS 72 4.166 -21.521 -7.405 595 HB3 LYS 72 1HB LYS 72 2.912 -22.166 -8.420 596 HG2 LYS 72 2HG LYS 72 3.911 -23.554 -5.934 597 HG3 LYS 72 1HG LYS 72 2.578 -22.413 -5.943 598 HD2 LYS 72 2HD LYS 72 1.377 -23.888 -7.516 599 HD3 LYS 72 1HD LYS 72 2.712 -25.038 -7.427 600 HE2 LYS 72 2HE LYS 72 0.897 -25.691 -5.931 601 HE3 LYS 72 1HE LYS 72 2.351 -25.271 -5.027 602 HZ1 LYS 72 3HZ LYS 72 -0.004 -23.496 -5.428 603 HZ2 LYS 72 1HZ LYS 72 1.364 -23.108 -4.528 604 HZ3 LYS 72 2HZ LYS 72 0.358 -24.358 -4.035 605 H ASN 73 H ASN 73 3.481 -23.144 -10.763 606 HA ASN 73 HA ASN 73 2.348 -25.759 -10.638 607 HB2 ASN 73 2HB ASN 73 2.342 -23.675 -12.821 608 HB3 ASN 73 1HB ASN 73 1.670 -25.275 -13.083 609 HD21 ASN 73 1HD2 ASN 73 1.294 -22.248 -11.371 610 HD22 ASN 73 2HD2 ASN 73 -0.336 -22.506 -10.901 611 H GLU 74 H GLU 74 2.575 -27.428 -12.178 612 HA GLU 74 HA GLU 74 3.630 -28.941 -13.387 613 HB2 GLU 74 2HB GLU 74 5.473 -26.678 -14.100 614 HB3 GLU 74 1HB GLU 74 5.825 -28.316 -14.621 615 HG2 GLU 74 2HG GLU 74 4.716 -27.037 -16.376 616 HG3 GLU 74 1HG GLU 74 3.730 -28.391 -15.858 617 H LYS 75 H LYS 75 4.450 -28.101 -10.554 618 HA LYS 75 HA LYS 75 6.898 -29.623 -10.339 619 HB2 LYS 75 2HB LYS 75 5.100 -28.486 -8.179 620 HB3 LYS 75 1HB LYS 75 6.604 -29.339 -7.857 621 HG2 LYS 75 2HG LYS 75 7.820 -27.611 -9.143 622 HG3 LYS 75 1HG LYS 75 6.301 -26.744 -9.358 623 HD2 LYS 75 2HD LYS 75 6.103 -26.469 -6.935 624 HD3 LYS 75 1HD LYS 75 7.599 -27.376 -6.697 625 HE2 LYS 75 2HE LYS 75 8.798 -25.694 -8.011 626 HE3 LYS 75 1HE LYS 75 7.317 -24.763 -8.182 627 HZ1 LYS 75 3HZ LYS 75 8.733 -23.898 -6.445 628 HZ2 LYS 75 1HZ LYS 75 8.730 -25.352 -5.624 629 HZ3 LYS 75 2HZ LYS 75 7.316 -24.433 -5.748 630 H VAL 76 H VAL 76 6.998 -31.541 -8.875 631 HA VAL 76 HA VAL 76 5.180 -33.479 -9.887 632 HB VAL 76 HB VAL 76 7.254 -33.794 -7.695 633 HG11 VAL 76 1HG1 VAL 76 7.170 -36.191 -8.216 634 HG12 VAL 76 2HG1 VAL 76 5.862 -35.891 -9.360 635 HG13 VAL 76 3HG1 VAL 76 5.615 -35.599 -7.638 636 HG21 VAL 76 3HG2 VAL 76 8.693 -34.715 -9.460 637 HG22 VAL 76 1HG2 VAL 76 8.253 -33.039 -9.791 638 HG23 VAL 76 2HG2 VAL 76 7.451 -34.350 -10.656 639 H ALA 77 H ALA 77 5.720 -32.192 -6.655 640 HA ALA 77 HA ALA 77 2.965 -32.848 -5.979 641 HB1 ALA 77 1HB ALA 77 4.292 -34.731 -5.149 642 HB2 ALA 77 2HB ALA 77 3.644 -33.774 -3.814 643 HB3 ALA 77 3HB ALA 77 5.338 -33.611 -4.276 644 H ALA 78 H ALA 78 5.976 -31.562 -4.538 645 HA ALA 78 HA ALA 78 6.497 -29.677 -3.414 646 HB1 ALA 78 1HB ALA 78 5.492 -27.576 -4.182 647 HB2 ALA 78 2HB ALA 78 4.219 -28.477 -5.006 648 HB3 ALA 78 3HB ALA 78 5.891 -28.618 -5.548 649 H LYS 79 H LYS 79 4.508 -31.505 -2.299 650 HA LYS 79 HA LYS 79 3.132 -29.631 -0.536 651 HB2 LYS 79 2HB LYS 79 1.514 -30.551 -2.069 652 HB3 LYS 79 1HB LYS 79 2.015 -32.184 -1.659 653 HG2 LYS 79 2HG LYS 79 1.258 -31.852 0.631 654 HG3 LYS 79 1HG LYS 79 0.743 -30.214 0.234 655 HD2 LYS 79 2HD LYS 79 -0.826 -31.059 -1.377 656 HD3 LYS 79 1HD LYS 79 -0.266 -32.711 -1.094 657 HE2 LYS 79 2HE LYS 79 -1.025 -32.562 1.233 658 HE3 LYS 79 1HE LYS 79 -1.612 -30.926 0.940 659 HZ1 LYS 79 3HZ LYS 79 -2.546 -33.363 -0.449 660 HZ2 LYS 79 1HZ LYS 79 -3.161 -31.818 -0.665 661 HZ3 LYS 79 2HZ LYS 79 -3.374 -32.605 0.812 662 H MET 80 H MET 80 4.196 -29.746 1.236 663 HA MET 80 HA MET 80 4.135 -32.242 2.745 664 HB2 MET 80 2HB MET 80 6.507 -31.793 1.961 665 HB3 MET 80 1HB MET 80 6.434 -30.222 2.746 666 HG2 MET 80 2HG MET 80 6.214 -31.303 4.927 667 HG3 MET 80 1HG MET 80 6.212 -32.885 4.161 668 HE1 MET 80 3HE MET 80 8.475 -32.565 1.920 669 HE2 MET 80 1HE MET 80 8.334 -33.964 2.986 670 HE3 MET 80 2HE MET 80 9.882 -33.144 2.806 671 H LEU 81 H LEU 81 2.197 -30.493 2.592 672 HA LEU 81 HA LEU 81 2.148 -29.114 5.137 673 HB2 LEU 81 2HB LEU 81 3.042 -27.515 3.381 674 HB3 LEU 81 1HB LEU 81 1.565 -27.742 2.493 675 HG LEU 81 HG LEU 81 1.776 -26.407 5.219 676 HD11 LEU 81 1HD1 LEU 81 2.879 -25.135 3.489 677 HD12 LEU 81 2HD1 LEU 81 1.384 -24.341 3.988 678 HD13 LEU 81 3HD1 LEU 81 1.443 -25.235 2.469 679 HD21 LEU 81 3HD2 LEU 81 -0.499 -25.612 4.782 680 HD22 LEU 81 1HD2 LEU 81 -0.458 -27.375 4.814 681 HD23 LEU 81 2HD2 LEU 81 -0.538 -26.524 3.273 682 H GLU 82 H GLU 82 0.413 -30.218 5.913 683 HA GLU 82 HA GLU 82 -1.745 -31.019 4.180 684 HB2 GLU 82 2HB GLU 82 -1.500 -31.180 7.210 685 HB3 GLU 82 1HB GLU 82 -2.825 -31.839 6.282 686 HG2 GLU 82 2HG GLU 82 -1.383 -33.631 6.903 687 HG3 GLU 82 1HG GLU 82 -1.206 -33.373 5.172 688 H LYS 83 H LYS 83 -3.909 -30.199 4.341 689 HA LYS 83 HA LYS 83 -3.967 -27.397 4.548 690 HB2 LYS 83 2HB LYS 83 -6.299 -29.320 4.435 691 HB3 LYS 83 1HB LYS 83 -6.428 -27.576 4.309 692 HG2 LYS 83 2HG LYS 83 -4.942 -29.359 2.392 693 HG3 LYS 83 1HG LYS 83 -6.527 -28.634 2.125 694 HD2 LYS 83 2HD LYS 83 -3.943 -27.138 2.554 695 HD3 LYS 83 1HD LYS 83 -4.754 -27.360 1.001 696 HE2 LYS 83 2HE LYS 83 -5.848 -25.861 3.393 697 HE3 LYS 83 1HE LYS 83 -5.176 -25.134 1.953 698 HZ1 LYS 83 3HZ LYS 83 -7.579 -25.158 1.886 699 HZ2 LYS 83 1HZ LYS 83 -7.622 -26.832 2.033 700 HZ3 LYS 83 2HZ LYS 83 -6.976 -26.121 0.655 701 H ASP 84 H ASP 84 -4.792 -29.856 6.893 702 HA ASP 84 HA ASP 84 -4.943 -27.683 8.834 703 HB2 ASP 84 2HB ASP 84 -7.256 -28.685 8.095 704 HB3 ASP 84 1HB ASP 84 -6.749 -30.083 9.037 705 H ALA 85 H ALA 85 -4.794 -28.850 11.085 706 HA ALA 85 HA ALA 85 -3.171 -31.268 10.968 707 HB1 ALA 85 1HB ALA 85 -2.116 -28.687 12.128 708 HB2 ALA 85 2HB ALA 85 -1.526 -29.484 10.670 709 HB3 ALA 85 3HB ALA 85 -1.323 -30.257 12.244 710 H THR 86 H THR 86 -5.706 -29.863 12.200 711 HA THR 86 HA THR 86 -5.457 -31.244 14.742 712 HB THR 86 HB THR 86 -6.353 -28.367 14.460 713 HG1 THR 86 1HG THR 86 -3.974 -29.195 14.689 714 HG21 THR 86 3HG2 THR 86 -6.675 -28.422 16.915 715 HG22 THR 86 1HG2 THR 86 -6.303 -30.147 16.919 716 HG23 THR 86 2HG2 THR 86 -7.744 -29.560 16.098 717 H GLU 87 H GLU 87 -7.578 -29.355 12.593 718 HA GLU 87 HA GLU 87 -9.719 -29.409 12.079 719 HB2 GLU 87 2HB GLU 87 -9.128 -31.563 11.051 720 HB3 GLU 87 1HB GLU 87 -9.470 -32.392 12.562 721 HG2 GLU 87 2HG GLU 87 -11.818 -31.745 12.392 722 HG3 GLU 87 1HG GLU 87 -11.475 -30.890 10.890 723 H VAL 88 H VAL 88 -10.605 -28.197 13.621 724 HA VAL 88 HA VAL 88 -11.313 -29.393 16.129 725 HB VAL 88 HB VAL 88 -12.224 -27.165 16.770 726 HG11 VAL 88 1HG1 VAL 88 -10.068 -25.995 16.820 727 HG12 VAL 88 2HG1 VAL 88 -9.435 -27.138 15.633 728 HG13 VAL 88 3HG1 VAL 88 -9.912 -27.703 17.234 729 HG21 VAL 88 3HG2 VAL 88 -12.938 -26.376 14.558 730 HG22 VAL 88 1HG2 VAL 88 -11.254 -26.298 14.036 731 HG23 VAL 88 2HG2 VAL 88 -11.831 -25.225 15.307 732 H GLY 89 H GLY 89 -13.122 -30.324 16.633 733 HA2 GLY 89 2HA GLY 89 -15.366 -30.070 14.781 734 HA3 GLY 89 1HA GLY 89 -15.091 -31.406 15.902 735 H VAL 90 H VAL 90 -17.029 -28.862 15.434 736 HA VAL 90 HA VAL 90 -16.982 -28.035 18.183 737 HB VAL 90 HB VAL 90 -18.676 -26.327 17.573 738 HG11 VAL 90 1HG1 VAL 90 -16.316 -25.796 17.483 739 HG12 VAL 90 2HG1 VAL 90 -17.182 -24.951 16.202 740 HG13 VAL 90 3HG1 VAL 90 -16.221 -26.378 15.824 741 HG21 VAL 90 3HG2 VAL 90 -18.313 -27.382 14.762 742 HG22 VAL 90 1HG2 VAL 90 -19.204 -25.927 15.203 743 HG23 VAL 90 2HG2 VAL 90 -19.787 -27.507 15.723 744 H LYS 91 H LYS 91 -18.141 -28.796 19.676 745 HA LYS 91 HA LYS 91 -20.397 -30.536 19.029 746 HB2 LYS 91 2HB LYS 91 -18.742 -30.150 21.492 747 HB3 LYS 91 1HB LYS 91 -20.274 -31.028 21.605 748 HG2 LYS 91 2HG LYS 91 -18.518 -32.618 21.498 749 HG3 LYS 91 1HG LYS 91 -19.230 -32.601 19.889 750 HD2 LYS 91 2HD LYS 91 -16.849 -32.595 19.586 751 HD3 LYS 91 1HD LYS 91 -17.499 -30.967 19.270 752 HE2 LYS 91 2HE LYS 91 -16.770 -30.168 21.400 753 HE3 LYS 91 1HE LYS 91 -16.249 -31.781 21.881 754 HZ1 LYS 91 3HZ LYS 91 -15.083 -30.222 19.634 755 HZ2 LYS 91 1HZ LYS 91 -14.566 -31.724 20.181 756 HZ3 LYS 91 2HZ LYS 91 -14.394 -30.385 21.175 757 H ALA 92 H ALA 92 -22.443 -30.164 19.842 758 HA ALA 92 HA ALA 92 -22.855 -27.449 20.850 759 HB1 ALA 92 1HB ALA 92 -24.717 -29.225 19.273 760 HB2 ALA 92 2HB ALA 92 -23.853 -27.821 18.651 761 HB3 ALA 92 3HB ALA 92 -25.109 -27.620 19.876 762 H ALA 93 H ALA 93 -24.050 -27.189 22.666 763 HA ALA 93 HA ALA 93 -24.292 -29.513 24.329 764 HB1 ALA 93 1HB ALA 93 -23.410 -27.423 25.246 765 HB2 ALA 93 2HB ALA 93 -24.862 -27.941 26.109 766 HB3 ALA 93 3HB ALA 93 -24.954 -26.636 24.925 767 H LEU 94 H LEU 94 -26.158 -30.250 25.309 768 HA LEU 94 HA LEU 94 -28.575 -29.635 23.806 769 HB2 LEU 94 2HB LEU 94 -29.428 -31.831 24.665 770 HB3 LEU 94 1HB LEU 94 -28.054 -31.939 23.601 771 HG LEU 94 HG LEU 94 -26.607 -32.312 25.633 772 HD11 LEU 94 1HD1 LEU 94 -27.656 -33.066 27.703 773 HD12 LEU 94 2HD1 LEU 94 -29.239 -32.621 27.063 774 HD13 LEU 94 3HD1 LEU 94 -28.022 -31.374 27.356 775 HD21 LEU 94 3HD2 LEU 94 -28.811 -34.294 25.114 776 HD22 LEU 94 1HD2 LEU 94 -27.277 -34.655 25.906 777 HD23 LEU 94 2HD2 LEU 94 -27.301 -34.143 24.218 778 H GLU 95 H GLU 95 -30.637 -29.642 24.975 779 HA GLU 95 HA GLU 95 -30.286 -28.395 27.601 780 HB2 GLU 95 2HB GLU 95 -32.524 -27.418 27.232 781 HB3 GLU 95 1HB GLU 95 -31.401 -26.953 25.963 782 HG2 GLU 95 2HG GLU 95 -32.358 -28.593 24.477 783 HG3 GLU 95 1HG GLU 95 -33.465 -29.135 25.741 784 H GLU 96 H GLU 96 -31.771 -29.006 29.271 785 HA GLU 96 HA GLU 96 -32.431 -31.793 29.178 786 HB2 GLU 96 2HB GLU 96 -31.498 -30.801 31.226 787 HB3 GLU 96 1HB GLU 96 -32.859 -29.699 31.327 788 HG2 GLU 96 2HG GLU 96 -33.060 -31.531 32.914 789 HG3 GLU 96 1HG GLU 96 -34.361 -31.566 31.725 790 H ALA 97 H ALA 97 -34.550 -32.605 29.557 791 HA ALA 97 HA ALA 97 -36.621 -30.906 28.380 792 HB1 ALA 97 1HB ALA 97 -36.204 -33.053 27.272 793 HB2 ALA 97 2HB ALA 97 -37.825 -32.992 27.962 794 HB3 ALA 97 3HB ALA 97 -36.551 -33.898 28.779 795 H LYS 98 H LYS 98 -38.009 -30.007 29.718 796 HA LYS 98 HA LYS 98 -38.148 -30.863 32.453 797 HB2 LYS 98 2HB LYS 98 -38.202 -28.479 31.927 798 HB3 LYS 98 1HB LYS 98 -39.659 -28.699 30.972 799 HG2 LYS 98 2HG LYS 98 -40.866 -29.385 32.999 800 HG3 LYS 98 1HG LYS 98 -39.405 -29.108 33.947 801 HD2 LYS 98 2HD LYS 98 -39.430 -26.750 33.304 802 HD3 LYS 98 1HD LYS 98 -40.868 -27.029 32.318 803 HE2 LYS 98 2HE LYS 98 -42.111 -27.688 34.320 804 HE3 LYS 98 1HE LYS 98 -40.676 -27.416 35.301 805 HZ1 LYS 98 3HZ LYS 98 -40.741 -25.100 34.734 806 HZ2 LYS 98 1HZ LYS 98 -42.207 -25.556 35.394 807 HZ3 LYS 98 2HZ LYS 98 -42.083 -25.310 33.733 808 H LYS 99 H LYS 99 -39.169 -32.791 32.644 809 HA LYS 99 HA LYS 99 -41.584 -33.281 31.179 810 HB2 LYS 99 2HB LYS 99 -40.250 -34.899 33.355 811 HB3 LYS 99 1HB LYS 99 -41.697 -35.377 32.487 812 HG2 LYS 99 2HG LYS 99 -40.433 -35.436 30.398 813 HG3 LYS 99 1HG LYS 99 -38.981 -34.931 31.268 814 HD2 LYS 99 2HD LYS 99 -39.011 -37.355 30.895 815 HD3 LYS 99 1HD LYS 99 -39.065 -36.969 32.616 816 HE2 LYS 99 2HE LYS 99 -41.504 -37.335 32.606 817 HE3 LYS 99 1HE LYS 99 -41.427 -37.723 30.887 818 HZ1 LYS 99 3HZ LYS 99 -40.063 -39.639 31.422 819 HZ2 LYS 99 1HZ LYS 99 -41.512 -39.686 32.292 820 HZ3 LYS 99 2HZ LYS 99 -40.092 -39.229 33.061 821 H VAL 100 H VAL 100 -43.211 -32.068 31.763 822 HA VAL 100 HA VAL 100 -44.001 -32.193 34.550 823 HB VAL 100 HB VAL 100 -42.923 -30.008 34.275 824 HG11 VAL 100 1HG1 VAL 100 -44.944 -29.458 32.117 825 HG12 VAL 100 2HG1 VAL 100 -43.202 -29.653 31.911 826 HG13 VAL 100 3HG1 VAL 100 -43.835 -28.273 32.811 827 HG21 VAL 100 3HG2 VAL 100 -44.778 -30.133 35.834 828 HG22 VAL 100 1HG2 VAL 100 -45.920 -29.784 34.537 829 HG23 VAL 100 2HG2 VAL 100 -44.763 -28.556 35.046 830 H GLN 101 H GLN 101 -45.953 -32.831 34.800 831 HA GLN 101 HA GLN 101 -47.753 -32.908 32.509 832 HB2 GLN 101 2HB GLN 101 -49.064 -34.516 33.866 833 HB3 GLN 101 1HB GLN 101 -47.405 -35.044 33.653 834 HG2 GLN 101 2HG GLN 101 -46.873 -34.226 35.916 835 HG3 GLN 101 1HG GLN 101 -48.551 -33.742 36.123 836 HE21 GLN 101 1HE2 GLN 101 -46.932 -35.623 37.618 837 HE22 GLN 101 2HE2 GLN 101 -47.792 -37.123 37.590 838 H ILE 102 H ILE 102 -49.751 -31.878 32.571 839 HA ILE 102 HA ILE 102 -49.948 -29.818 34.599 840 HB ILE 102 HB ILE 102 -51.817 -28.904 33.293 841 HG12 ILE 102 2HG1 ILE 102 -51.265 -31.161 31.344 842 HG13 ILE 102 1HG1 ILE 102 -52.681 -31.045 32.384 843 HG21 ILE 102 1HG2 ILE 102 -50.520 -28.222 31.320 844 HG22 ILE 102 2HG2 ILE 102 -49.340 -29.482 31.688 845 HG23 ILE 102 3HG2 ILE 102 -49.582 -28.148 32.811 846 HD11 ILE 102 3HD1 ILE 102 -51.929 -29.143 30.182 847 HD12 ILE 102 1HD1 ILE 102 -53.351 -29.010 31.214 848 HD13 ILE 102 2HD1 ILE 102 -53.190 -30.376 30.112 849 H GLU 103 H GLU 103 -51.883 -29.419 35.732 850 HA GLU 103 HA GLU 103 -53.165 -31.879 36.564 851 HB2 GLU 103 2HB GLU 103 -52.229 -30.351 38.268 852 HB3 GLU 103 1HB GLU 103 -53.297 -29.080 37.691 853 HG2 GLU 103 2HG GLU 103 -55.231 -30.411 38.384 854 HG3 GLU 103 1HG GLU 103 -54.144 -31.671 38.967 855 H LEU 104 H LEU 104 -54.654 -32.335 35.019 856 HA LEU 104 HA LEU 104 -56.451 -30.231 34.178 857 HB2 LEU 104 2HB LEU 104 -55.363 -31.840 32.545 858 HB3 LEU 104 1HB LEU 104 -56.276 -33.124 33.285 859 HG LEU 104 HG LEU 104 -57.589 -30.793 31.857 860 HD11 LEU 104 1HD1 LEU 104 -57.805 -32.311 29.949 861 HD12 LEU 104 2HD1 LEU 104 -56.827 -33.507 30.802 862 HD13 LEU 104 3HD1 LEU 104 -56.117 -31.971 30.322 863 HD21 LEU 104 3HD2 LEU 104 -59.489 -32.309 31.699 864 HD22 LEU 104 1HD2 LEU 104 -59.031 -32.078 33.388 865 HD23 LEU 104 2HD2 LEU 104 -58.574 -33.559 32.540 866 H ASP 105 H ASP 105 -58.372 -29.993 35.004 867 HA ASP 105 HA ASP 105 -59.002 -31.152 37.469 868 HB2 ASP 105 2HB ASP 105 -59.623 -28.915 36.980 869 HB3 ASP 105 1HB ASP 105 -60.635 -29.420 35.638 870 H THR 106 H THR 106 -60.665 -31.484 34.389 871 HA THR 106 HA THR 106 -62.113 -32.865 33.523 872 HB THR 106 HB THR 106 -60.264 -34.450 33.460 873 HG1 THR 106 1HG THR 106 -62.817 -35.496 33.996 874 HG21 THR 106 3HG2 THR 106 -61.319 -35.580 36.074 875 HG22 THR 106 1HG2 THR 106 -59.792 -34.723 35.873 876 HG23 THR 106 2HG2 THR 106 -60.034 -36.293 35.100 877 H SER 107 H SER 107 -62.784 -31.934 36.510 878 HA SER 107 HA SER 107 -64.754 -33.882 37.132 879 HB2 SER 107 2HB SER 107 -64.339 -31.089 38.235 880 HB3 SER 107 1HB SER 107 -65.393 -32.328 38.932 881 HG SER 107 HG SER 107 -63.339 -33.643 38.883 882 H LEU 108 H LEU 108 -64.727 -30.649 35.713 883 HA LEU 108 HA LEU 108 -66.122 -29.578 34.245 884 HB2 LEU 108 2HB LEU 108 -67.215 -32.351 33.749 885 HB3 LEU 108 1HB LEU 108 -67.454 -30.963 32.710 886 HG LEU 108 HG LEU 108 -64.849 -32.380 33.241 887 HD11 LEU 108 1HD1 LEU 108 -64.995 -33.032 30.891 888 HD12 LEU 108 2HD1 LEU 108 -66.578 -32.265 30.778 889 HD13 LEU 108 3HD1 LEU 108 -66.347 -33.659 31.832 890 HD21 LEU 108 3HD2 LEU 108 -64.457 -30.002 32.891 891 HD22 LEU 108 1HD2 LEU 108 -65.444 -30.046 31.424 892 HD23 LEU 108 2HD2 LEU 108 -63.921 -30.935 31.493 893 H SER 109 H SER 109 -68.732 -29.754 33.525 894 HA SER 109 HA SER 109 -70.160 -29.481 36.035 895 HB2 SER 109 2HB SER 109 -71.000 -28.792 33.202 896 HB3 SER 109 1HB SER 109 -71.888 -28.401 34.668 897 HG SER 109 HG SER 109 -70.394 -26.786 33.642 898 H TYR 110 H TYR 110 -70.938 -31.313 36.715 899 HA TYR 110 HA TYR 110 -72.261 -33.133 34.830 900 HB2 TYR 110 2HB TYR 110 -70.013 -33.973 35.532 901 HB3 TYR 110 1HB TYR 110 -70.518 -33.862 37.205 902 HD1 TYR 110 2HD TYR 110 -70.823 -35.735 34.082 903 HD2 TYR 110 1HD TYR 110 -72.029 -35.539 38.148 904 HE1 TYR 110 2HE TYR 110 -71.622 -38.063 33.954 905 HE2 TYR 110 1HE TYR 110 -72.825 -37.859 38.035 906 HH TYR 110 HH TYR 110 -73.553 -39.425 36.408 907 H ILE 111 H ILE 111 -74.359 -33.290 35.402 908 HA ILE 111 HA ILE 111 -74.960 -32.956 38.219 909 HB ILE 111 HB ILE 111 -75.877 -31.059 37.020 910 HG12 ILE 111 2HG1 ILE 111 -78.303 -31.258 37.572 911 HG13 ILE 111 1HG1 ILE 111 -78.066 -32.980 37.817 912 HG21 ILE 111 1HG2 ILE 111 -77.584 -31.245 35.278 913 HG22 ILE 111 2HG2 ILE 111 -77.332 -32.993 35.257 914 HG23 ILE 111 3HG2 ILE 111 -76.021 -31.909 34.798 915 HD11 ILE 111 3HD1 ILE 111 -76.757 -30.776 39.398 916 HD12 ILE 111 1HD1 ILE 111 -76.520 -32.507 39.652 917 HD13 ILE 111 2HD1 ILE 111 -78.104 -31.782 39.927 Start of MODEL 12 1 H1 GLY -1 1HT GLY -1 -1.115 -0.184 -28.846 2 H2 GLY -1 2HT GLY -1 -1.364 0.248 -30.441 3 H3 GLY -1 3HT GLY -1 -0.690 -1.258 -30.062 4 HA2 GLY -1 1HA GLY -1 -3.441 -0.411 -29.405 5 HA3 GLY -1 2HA GLY -1 -2.991 -1.499 -30.714 6 H SER 0 H SER 0 -2.207 -1.163 -27.251 7 HA SER 0 HA SER 0 -2.335 -4.060 -27.016 8 HB2 SER 0 2HB SER 0 -1.319 -1.949 -25.097 9 HB3 SER 0 1HB SER 0 -1.156 -3.693 -24.898 10 HG SER 0 HG SER 0 -0.119 -3.593 -27.031 11 H MET 1 H MET 1 -3.280 -4.793 -24.839 12 HA MET 1 HA MET 1 -5.990 -3.901 -24.732 13 HB2 MET 1 2HB MET 1 -4.483 -5.778 -22.905 14 HB3 MET 1 1HB MET 1 -6.218 -5.511 -22.863 15 HG2 MET 1 2HG MET 1 -6.393 -6.420 -25.133 16 HG3 MET 1 1HG MET 1 -4.654 -6.704 -25.143 17 HE1 MET 1 3HE MET 1 -5.055 -9.253 -25.769 18 HE2 MET 1 1HE MET 1 -6.801 -8.988 -25.761 19 HE3 MET 1 2HE MET 1 -6.108 -10.331 -24.853 20 H THR 2 H THR 2 -7.003 -2.691 -23.170 21 HA THR 2 HA THR 2 -5.238 -1.390 -21.253 22 HB THR 2 HB THR 2 -7.855 -0.441 -22.442 23 HG1 THR 2 1HG THR 2 -5.293 -0.375 -23.274 24 HG21 THR 2 3HG2 THR 2 -7.428 0.435 -20.178 25 HG22 THR 2 1HG2 THR 2 -7.270 1.707 -21.388 26 HG23 THR 2 2HG2 THR 2 -5.828 0.974 -20.686 27 H VAL 3 H VAL 3 -5.530 -2.099 -19.272 28 HA VAL 3 HA VAL 3 -8.153 -3.226 -18.534 29 HB VAL 3 HB VAL 3 -5.545 -3.669 -17.080 30 HG11 VAL 3 1HG1 VAL 3 -7.474 -4.080 -15.731 31 HG12 VAL 3 2HG1 VAL 3 -6.663 -5.586 -16.186 32 HG13 VAL 3 3HG1 VAL 3 -8.143 -5.120 -17.015 33 HG21 VAL 3 3HG2 VAL 3 -6.794 -5.518 -19.101 34 HG22 VAL 3 1HG2 VAL 3 -5.449 -5.862 -18.014 35 HG23 VAL 3 2HG2 VAL 3 -5.261 -4.633 -19.280 36 H TYR 4 H TYR 4 -9.254 -2.264 -16.846 37 HA TYR 4 HA TYR 4 -7.920 -0.031 -15.553 38 HB2 TYR 4 2HB TYR 4 -10.847 -0.754 -15.769 39 HB3 TYR 4 1HB TYR 4 -10.205 0.668 -14.950 40 HD1 TYR 4 2HD TYR 4 -10.703 -0.928 -18.242 41 HD2 TYR 4 1HD TYR 4 -9.457 2.565 -16.181 42 HE1 TYR 4 2HE TYR 4 -10.740 0.315 -20.353 43 HE2 TYR 4 1HE TYR 4 -9.487 3.826 -18.281 44 HH TYR 4 HH TYR 4 -10.928 2.616 -21.121 45 H ILE 5 H ILE 5 -7.459 -0.068 -13.477 46 HA ILE 5 HA ILE 5 -8.283 -2.413 -11.865 47 HB ILE 5 HB ILE 5 -5.866 -0.657 -11.424 48 HG12 ILE 5 2HG1 ILE 5 -4.427 -2.425 -11.941 49 HG13 ILE 5 1HG1 ILE 5 -5.651 -3.569 -12.350 50 HG21 ILE 5 1HG2 ILE 5 -6.720 -1.578 -9.400 51 HG22 ILE 5 2HG2 ILE 5 -5.162 -2.315 -9.774 52 HG23 ILE 5 3HG2 ILE 5 -6.656 -3.208 -10.067 53 HD11 ILE 5 3HD1 ILE 5 -4.776 -1.098 -13.886 54 HD12 ILE 5 1HD1 ILE 5 -6.200 -2.035 -14.324 55 HD13 ILE 5 2HD1 ILE 5 -4.606 -2.783 -14.376 56 H CYS 6 H CYS 6 -9.743 -1.775 -10.379 57 HA CYS 6 HA CYS 6 -9.053 0.590 -8.868 58 HB2 CYS 6 2HB CYS 6 -11.119 1.137 -10.108 59 HB3 CYS 6 1HB CYS 6 -11.891 -0.306 -9.453 60 HG CYS 6 HG CYS 6 -13.064 1.482 -7.903 61 HA PRO 7 HA PRO 7 -8.679 -3.029 -6.178 62 HB2 PRO 7 2HB PRO 7 -7.259 -1.744 -4.241 63 HB3 PRO 7 1HB PRO 7 -6.526 -2.399 -5.707 64 HG2 PRO 7 2HG PRO 7 -7.321 0.416 -5.083 65 HG3 PRO 7 1HG PRO 7 -5.862 -0.183 -5.896 66 HD2 PRO 7 2HD PRO 7 -7.941 0.871 -7.227 67 HD3 PRO 7 1HD PRO 7 -6.944 -0.425 -7.921 68 H GLU 8 H GLU 8 -10.428 -0.253 -5.828 69 HA GLU 8 HA GLU 8 -11.228 -0.831 -3.068 70 HB2 GLU 8 2HB GLU 8 -12.074 1.534 -4.716 71 HB3 GLU 8 1HB GLU 8 -12.126 1.346 -2.971 72 HG2 GLU 8 2HG GLU 8 -9.724 1.566 -4.695 73 HG3 GLU 8 1HG GLU 8 -10.359 2.851 -3.654 74 H THR 9 H THR 9 -12.924 0.384 -5.974 75 HA THR 9 HA THR 9 -15.335 -0.881 -5.028 76 HB THR 9 HB THR 9 -16.418 0.518 -6.807 77 HG1 THR 9 1HG THR 9 -14.884 2.316 -7.406 78 HG21 THR 9 3HG2 THR 9 -14.687 1.963 -4.802 79 HG22 THR 9 1HG2 THR 9 -16.254 1.252 -4.448 80 HG23 THR 9 2HG2 THR 9 -16.139 2.613 -5.565 81 H GLY 10 H GLY 10 -12.906 -1.673 -7.206 82 HA2 GLY 10 2HA GLY 10 -14.837 -3.121 -8.849 83 HA3 GLY 10 1HA GLY 10 -13.187 -2.971 -9.358 84 H ASP 11 H ASP 11 -12.895 -5.207 -9.581 85 HA ASP 11 HA ASP 11 -12.269 -6.651 -7.240 86 HB2 ASP 11 2HB ASP 11 -14.768 -6.840 -7.186 87 HB3 ASP 11 1HB ASP 11 -14.679 -7.691 -8.729 88 H ASP 12 H ASP 12 -11.216 -8.606 -7.683 89 HA ASP 12 HA ASP 12 -9.810 -8.635 -10.163 90 HB2 ASP 12 2HB ASP 12 -8.647 -10.603 -9.285 91 HB3 ASP 12 1HB ASP 12 -8.715 -9.334 -8.074 92 H GLY 13 H GLY 13 -12.742 -10.152 -9.152 93 HA2 GLY 13 2HA GLY 13 -12.559 -12.336 -11.016 94 HA3 GLY 13 1HA GLY 13 -13.965 -11.856 -10.073 95 H ASN 14 H ASN 14 -12.985 -9.119 -11.418 96 HA ASN 14 HA ASN 14 -15.094 -9.176 -13.358 97 HB2 ASN 14 2HB ASN 14 -13.237 -7.003 -12.473 98 HB3 ASN 14 1HB ASN 14 -14.400 -6.771 -13.770 99 HD21 ASN 14 1HD2 ASN 14 -14.209 -5.449 -11.229 100 HD22 ASN 14 2HD2 ASN 14 -15.703 -5.748 -10.406 101 H ASP 15 H ASP 15 -14.550 -7.744 -15.384 102 HA ASP 15 HA ASP 15 -12.769 -9.383 -16.989 103 HB2 ASP 15 2HB ASP 15 -15.079 -8.949 -17.716 104 HB3 ASP 15 1HB ASP 15 -14.754 -7.225 -17.720 105 H GLY 16 H GLY 16 -12.707 -6.407 -15.384 106 HA2 GLY 16 2HA GLY 16 -11.002 -4.900 -15.203 107 HA3 GLY 16 1HA GLY 16 -10.174 -5.736 -16.510 108 H SER 17 H SER 17 -13.386 -4.574 -16.849 109 HA SER 17 HA SER 17 -12.586 -2.662 -18.890 110 HB2 SER 17 2HB SER 17 -14.608 -4.071 -19.228 111 HB3 SER 17 1HB SER 17 -15.321 -3.396 -17.768 112 HG SER 17 HG SER 17 -14.992 -2.289 -20.296 113 H GLU 18 H GLU 18 -13.820 -0.340 -18.623 114 HA GLU 18 HA GLU 18 -12.819 0.751 -16.269 115 HB2 GLU 18 2HB GLU 18 -13.131 2.048 -18.363 116 HB3 GLU 18 1HB GLU 18 -14.878 1.923 -18.165 117 HG2 GLU 18 2HG GLU 18 -14.665 3.106 -16.004 118 HG3 GLU 18 1HG GLU 18 -12.942 3.253 -16.364 119 H LEU 19 H LEU 19 -15.889 -0.497 -17.287 120 HA LEU 19 HA LEU 19 -17.380 0.453 -15.026 121 HB2 LEU 19 2HB LEU 19 -18.083 -1.499 -17.166 122 HB3 LEU 19 1HB LEU 19 -19.182 -0.934 -15.918 123 HG LEU 19 HG LEU 19 -17.913 0.717 -18.090 124 HD11 LEU 19 1HD1 LEU 19 -20.682 -0.033 -17.414 125 HD12 LEU 19 2HD1 LEU 19 -19.733 -0.688 -18.767 126 HD13 LEU 19 3HD1 LEU 19 -20.238 1.026 -18.762 127 HD21 LEU 19 3HD2 LEU 19 -18.028 2.053 -16.053 128 HD22 LEU 19 1HD2 LEU 19 -19.714 1.575 -15.821 129 HD23 LEU 19 2HD2 LEU 19 -19.260 2.570 -17.199 130 H LYS 20 H LYS 20 -15.425 -2.239 -15.725 131 HA LYS 20 HA LYS 20 -16.157 -3.536 -13.148 132 HB2 LYS 20 2HB LYS 20 -15.434 -5.109 -15.620 133 HB3 LYS 20 1HB LYS 20 -15.992 -5.691 -14.077 134 HG2 LYS 20 2HG LYS 20 -18.211 -4.825 -14.422 135 HG3 LYS 20 1HG LYS 20 -17.726 -4.126 -15.967 136 HD2 LYS 20 2HD LYS 20 -17.182 -6.398 -16.779 137 HD3 LYS 20 1HD LYS 20 -17.755 -7.051 -15.248 138 HE2 LYS 20 2HE LYS 20 -19.984 -6.191 -15.667 139 HE3 LYS 20 1HE LYS 20 -19.433 -5.424 -17.148 140 HZ1 LYS 20 3HZ LYS 20 -18.919 -7.638 -18.034 141 HZ2 LYS 20 1HZ LYS 20 -20.543 -7.467 -17.657 142 HZ3 LYS 20 2HZ LYS 20 -19.547 -8.349 -16.630 143 HA PRO 21 HA PRO 21 -11.735 -2.747 -13.774 144 HB2 PRO 21 2HB PRO 21 -11.296 -1.460 -11.416 145 HB3 PRO 21 1HB PRO 21 -11.775 -0.640 -12.902 146 HG2 PRO 21 2HG PRO 21 -13.406 -1.316 -10.514 147 HG3 PRO 21 1HG PRO 21 -13.539 0.052 -11.625 148 HD2 PRO 21 2HD PRO 21 -15.148 -2.210 -11.646 149 HD3 PRO 21 1HD PRO 21 -14.950 -1.070 -12.986 150 H LEU 22 H LEU 22 -10.050 -3.786 -12.817 151 HA LEU 22 HA LEU 22 -10.749 -6.061 -11.165 152 HB2 LEU 22 2HB LEU 22 -8.097 -5.137 -12.236 153 HB3 LEU 22 1HB LEU 22 -8.421 -6.695 -11.498 154 HG LEU 22 HG LEU 22 -9.621 -5.697 -14.063 155 HD11 LEU 22 1HD1 LEU 22 -8.257 -7.419 -15.088 156 HD12 LEU 22 2HD1 LEU 22 -7.491 -7.726 -13.531 157 HD13 LEU 22 3HD1 LEU 22 -7.305 -6.158 -14.301 158 HD21 LEU 22 3HD2 LEU 22 -9.858 -8.361 -12.680 159 HD22 LEU 22 1HD2 LEU 22 -10.445 -7.988 -14.298 160 HD23 LEU 22 2HD2 LEU 22 -11.144 -7.174 -12.903 161 H ARG 23 H ARG 23 -9.570 -6.507 -9.161 162 HA ARG 23 HA ARG 23 -9.247 -3.972 -7.782 163 HB2 ARG 23 2HB ARG 23 -9.660 -5.131 -5.703 164 HB3 ARG 23 1HB ARG 23 -10.863 -5.556 -6.871 165 HG2 ARG 23 2HG ARG 23 -9.676 -7.665 -7.298 166 HG3 ARG 23 1HG ARG 23 -8.528 -7.256 -6.025 167 HD2 ARG 23 2HD ARG 23 -11.504 -7.692 -5.725 168 HD3 ARG 23 1HD ARG 23 -10.210 -8.728 -5.151 169 HE ARG 23 HE ARG 23 -9.579 -6.646 -3.811 170 HH11 ARG 23 1HH1 ARG 23 -12.924 -7.708 -4.538 171 HH12 ARG 23 2HH1 ARG 23 -13.567 -7.079 -3.101 172 HH21 ARG 23 1HH2 ARG 23 -10.534 -5.792 -1.805 173 HH22 ARG 23 2HH2 ARG 23 -12.189 -5.964 -1.514 174 H THR 24 H THR 24 -7.299 -6.060 -9.312 175 HA THR 24 HA THR 24 -5.014 -5.242 -7.752 176 HB THR 24 HB THR 24 -4.013 -7.526 -8.123 177 HG1 THR 24 1HG THR 24 -5.785 -9.188 -8.259 178 HG21 THR 24 3HG2 THR 24 -5.155 -8.613 -6.205 179 HG22 THR 24 1HG2 THR 24 -6.450 -7.429 -6.326 180 HG23 THR 24 2HG2 THR 24 -4.825 -6.912 -5.886 181 H LEU 25 H LEU 25 -3.234 -4.893 -9.020 182 HA LEU 25 HA LEU 25 -3.569 -4.625 -11.841 183 HB2 LEU 25 2HB LEU 25 -2.170 -3.138 -10.491 184 HB3 LEU 25 1HB LEU 25 -1.133 -4.473 -10.069 185 HG LEU 25 HG LEU 25 -0.349 -4.626 -12.371 186 HD11 LEU 25 1HD1 LEU 25 -2.388 -3.895 -13.517 187 HD12 LEU 25 2HD1 LEU 25 -0.993 -2.950 -14.019 188 HD13 LEU 25 3HD1 LEU 25 -2.165 -2.265 -12.899 189 HD21 LEU 25 3HD2 LEU 25 0.825 -2.455 -12.421 190 HD22 LEU 25 1HD2 LEU 25 0.803 -3.192 -10.814 191 HD23 LEU 25 2HD2 LEU 25 -0.293 -1.869 -11.193 192 H TYR 26 H TYR 26 -2.501 -7.003 -9.699 193 HA TYR 26 HA TYR 26 -0.979 -8.774 -11.169 194 HB2 TYR 26 2HB TYR 26 -1.425 -8.857 -8.757 195 HB3 TYR 26 1HB TYR 26 -3.095 -9.273 -9.081 196 HD1 TYR 26 1HD TYR 26 0.373 -10.463 -9.657 197 HD2 TYR 26 2HD TYR 26 -3.697 -11.523 -9.096 198 HE1 TYR 26 1HE TYR 26 0.998 -12.798 -9.497 199 HE2 TYR 26 2HE TYR 26 -3.051 -13.886 -8.911 200 HH TYR 26 HH TYR 26 -1.117 -15.307 -9.683 201 H GLN 27 H GLN 27 -4.551 -8.644 -10.791 202 HA GLN 27 HA GLN 27 -5.038 -10.790 -12.551 203 HB2 GLN 27 2HB GLN 27 -6.710 -10.095 -10.917 204 HB3 GLN 27 1HB GLN 27 -6.876 -8.535 -11.700 205 HG2 GLN 27 2HG GLN 27 -8.760 -10.036 -12.208 206 HG3 GLN 27 1HG GLN 27 -7.905 -9.606 -13.660 207 HE21 GLN 27 1HE2 GLN 27 -8.647 -11.378 -14.742 208 HE22 GLN 27 2HE2 GLN 27 -8.114 -12.981 -14.430 209 H ALA 28 H ALA 28 -4.662 -7.329 -13.108 210 HA ALA 28 HA ALA 28 -5.542 -7.199 -15.719 211 HB1 ALA 28 1HB ALA 28 -5.016 -5.240 -14.309 212 HB2 ALA 28 2HB ALA 28 -4.194 -5.168 -15.858 213 HB3 ALA 28 3HB ALA 28 -3.304 -5.645 -14.410 214 H MET 29 H MET 29 -2.316 -7.994 -14.394 215 HA MET 29 HA MET 29 -1.288 -8.486 -16.949 216 HB2 MET 29 2HB MET 29 -0.282 -8.995 -14.205 217 HB3 MET 29 1HB MET 29 0.531 -9.697 -15.582 218 HG2 MET 29 2HG MET 29 0.758 -7.317 -16.501 219 HG3 MET 29 1HG MET 29 0.197 -6.749 -14.942 220 HE1 MET 29 3HE MET 29 3.980 -6.043 -15.052 221 HE2 MET 29 1HE MET 29 2.371 -5.348 -14.888 222 HE3 MET 29 2HE MET 29 2.875 -6.038 -16.437 223 H ILE 30 H ILE 30 -2.903 -10.517 -14.606 224 HA ILE 30 HA ILE 30 -2.233 -13.000 -15.730 225 HB ILE 30 HB ILE 30 -4.871 -12.239 -14.416 226 HG12 ILE 30 2HG1 ILE 30 -2.407 -13.571 -13.248 227 HG13 ILE 30 1HG1 ILE 30 -2.963 -11.936 -12.908 228 HG21 ILE 30 1HG2 ILE 30 -5.197 -14.646 -14.029 229 HG22 ILE 30 2HG2 ILE 30 -3.732 -14.985 -14.949 230 HG23 ILE 30 3HG2 ILE 30 -5.132 -14.265 -15.751 231 HD11 ILE 30 3HD1 ILE 30 -4.976 -12.865 -11.869 232 HD12 ILE 30 1HD1 ILE 30 -3.497 -13.452 -11.106 233 HD13 ILE 30 2HD1 ILE 30 -4.388 -14.493 -12.215 234 H ILE 31 H ILE 31 -4.855 -10.791 -16.496 235 HA ILE 31 HA ILE 31 -6.049 -12.402 -18.468 236 HB ILE 31 HB ILE 31 -6.247 -9.400 -18.159 237 HG12 ILE 31 2HG1 ILE 31 -7.923 -11.634 -16.991 238 HG13 ILE 31 1HG1 ILE 31 -6.864 -10.538 -16.107 239 HG21 ILE 31 1HG2 ILE 31 -7.007 -10.286 -20.317 240 HG22 ILE 31 2HG2 ILE 31 -8.362 -9.684 -19.328 241 HG23 ILE 31 3HG2 ILE 31 -8.043 -11.420 -19.418 242 HD11 ILE 31 3HD1 ILE 31 -8.271 -8.666 -16.740 243 HD12 ILE 31 1HD1 ILE 31 -9.192 -9.909 -15.873 244 HD13 ILE 31 2HD1 ILE 31 -9.315 -9.771 -17.634 245 H THR 32 H THR 32 -3.681 -9.729 -18.653 246 HA THR 32 HA THR 32 -3.835 -9.698 -21.517 247 HB THR 32 HB THR 32 -2.160 -7.866 -21.323 248 HG1 THR 32 1HG THR 32 -2.593 -7.823 -18.561 249 HG21 THR 32 3HG2 THR 32 -4.587 -7.570 -19.507 250 HG22 THR 32 1HG2 THR 32 -4.603 -7.394 -21.253 251 HG23 THR 32 2HG2 THR 32 -3.692 -6.261 -20.261 252 H LYS 33 H LYS 33 -1.418 -10.578 -19.045 253 HA LYS 33 HA LYS 33 0.549 -11.659 -19.078 254 HB2 LYS 33 2HB LYS 33 -0.421 -12.744 -21.718 255 HB3 LYS 33 1HB LYS 33 0.931 -13.389 -20.802 256 HG2 LYS 33 2HG LYS 33 -0.591 -13.956 -18.975 257 HG3 LYS 33 1HG LYS 33 -1.942 -13.333 -19.923 258 HD2 LYS 33 2HD LYS 33 -0.143 -15.626 -20.711 259 HD3 LYS 33 1HD LYS 33 -1.771 -15.764 -20.047 260 HE2 LYS 33 2HE LYS 33 -2.668 -14.580 -21.995 261 HE3 LYS 33 1HE LYS 33 -1.046 -14.419 -22.654 262 HZ1 LYS 33 3HZ LYS 33 -0.874 -16.793 -22.769 263 HZ2 LYS 33 1HZ LYS 33 -2.202 -16.266 -23.652 264 HZ3 LYS 33 2HZ LYS 33 -2.423 -16.994 -22.138 265 H SER 34 H SER 34 0.079 -9.094 -20.517 266 HA SER 34 HA SER 34 1.972 -9.140 -22.704 267 HB2 SER 34 2HB SER 34 0.381 -6.858 -21.554 268 HB3 SER 34 1HB SER 34 1.233 -6.870 -23.099 269 HG SER 34 HG SER 34 -0.202 -8.970 -23.224 270 H SER 35 H SER 35 2.111 -8.468 -19.361 271 HA SER 35 HA SER 35 3.792 -7.848 -17.943 272 HB2 SER 35 2HB SER 35 5.571 -7.810 -20.395 273 HB3 SER 35 1HB SER 35 6.112 -7.871 -18.714 274 HG SER 35 HG SER 35 4.569 -9.835 -20.062 275 H LYS 36 H LYS 36 2.964 -5.870 -20.610 276 HA LYS 36 HA LYS 36 3.406 -3.442 -19.283 277 HB2 LYS 36 2HB LYS 36 5.658 -3.882 -20.236 278 HB3 LYS 36 1HB LYS 36 4.926 -4.200 -21.797 279 HG2 LYS 36 2HG LYS 36 4.155 -1.870 -21.881 280 HG3 LYS 36 1HG LYS 36 4.964 -1.568 -20.339 281 HD2 LYS 36 2HD LYS 36 7.096 -2.174 -21.326 282 HD3 LYS 36 1HD LYS 36 6.310 -2.530 -22.859 283 HE2 LYS 36 2HE LYS 36 5.578 -0.168 -22.979 284 HE3 LYS 36 1HE LYS 36 6.473 0.154 -21.494 285 HZ1 LYS 36 3HZ LYS 36 7.735 0.728 -23.505 286 HZ2 LYS 36 1HZ LYS 36 7.654 -0.869 -24.008 287 HZ3 LYS 36 2HZ LYS 36 8.504 -0.485 -22.605 288 H GLY 37 H GLY 37 2.060 -2.004 -20.331 289 HA2 GLY 37 2HA GLY 37 1.005 -1.947 -22.817 290 HA3 GLY 37 1HA GLY 37 0.003 -3.140 -21.980 291 H ASP 38 H ASP 38 -1.809 -1.607 -22.197 292 HA ASP 38 HA ASP 38 -1.423 0.743 -20.544 293 HB2 ASP 38 2HB ASP 38 -3.765 -0.115 -22.245 294 HB3 ASP 38 1HB ASP 38 -3.751 1.332 -21.244 295 H PHE 39 H PHE 39 -1.581 0.419 -18.545 296 HA PHE 39 HA PHE 39 -3.855 -1.095 -17.521 297 HB2 PHE 39 2HB PHE 39 -1.087 -0.870 -16.296 298 HB3 PHE 39 1HB PHE 39 -2.458 -1.696 -15.571 299 HD1 PHE 39 1HD PHE 39 -3.481 -3.619 -16.950 300 HD2 PHE 39 2HD PHE 39 0.423 -2.081 -17.613 301 HE1 PHE 39 1HE PHE 39 -2.850 -5.706 -18.089 302 HE2 PHE 39 2HE PHE 39 1.054 -4.151 -18.757 303 HZ PHE 39 HZ PHE 39 -0.579 -5.972 -18.995 304 H LEU 40 H LEU 40 -5.197 0.276 -16.576 305 HA LEU 40 HA LEU 40 -3.993 2.747 -15.531 306 HB2 LEU 40 2HB LEU 40 -6.806 2.516 -16.644 307 HB3 LEU 40 1HB LEU 40 -5.971 3.912 -16.012 308 HG LEU 40 HG LEU 40 -5.189 2.481 -18.538 309 HD11 LEU 40 1HD1 LEU 40 -6.600 5.106 -18.119 310 HD12 LEU 40 2HD1 LEU 40 -7.297 3.635 -18.796 311 HD13 LEU 40 3HD1 LEU 40 -6.016 4.481 -19.664 312 HD21 LEU 40 3HD2 LEU 40 -3.290 3.492 -17.452 313 HD22 LEU 40 1HD2 LEU 40 -4.159 5.016 -17.272 314 HD23 LEU 40 2HD2 LEU 40 -3.726 4.428 -18.880 315 H ILE 41 H ILE 41 -4.221 3.074 -13.488 316 HA ILE 41 HA ILE 41 -6.178 1.413 -12.108 317 HB ILE 41 HB ILE 41 -3.608 2.567 -10.992 318 HG12 ILE 41 2HG1 ILE 41 -4.274 -0.168 -12.143 319 HG13 ILE 41 1HG1 ILE 41 -2.995 0.925 -12.549 320 HG21 ILE 41 1HG2 ILE 41 -5.587 0.617 -9.803 321 HG22 ILE 41 2HG2 ILE 41 -5.368 2.290 -9.321 322 HG23 ILE 41 3HG2 ILE 41 -4.068 1.119 -9.044 323 HD11 ILE 41 3HD1 ILE 41 -1.828 0.429 -10.497 324 HD12 ILE 41 1HD1 ILE 41 -2.289 -1.058 -11.378 325 HD13 ILE 41 2HD1 ILE 41 -3.204 -0.569 -9.979 326 H ARG 42 H ARG 42 -7.576 2.310 -10.781 327 HA ARG 42 HA ARG 42 -8.113 5.109 -11.052 328 HB2 ARG 42 2HB ARG 42 -9.801 3.206 -10.785 329 HB3 ARG 42 1HB ARG 42 -9.372 3.217 -9.087 330 HG2 ARG 42 2HG ARG 42 -11.396 4.507 -9.355 331 HG3 ARG 42 1HG ARG 42 -10.077 5.592 -8.988 332 HD2 ARG 42 2HD ARG 42 -10.101 6.592 -10.994 333 HD3 ARG 42 1HD ARG 42 -10.563 5.120 -11.880 334 HE ARG 42 HE ARG 42 -12.687 6.016 -10.305 335 HH11 ARG 42 1HH1 ARG 42 -10.860 7.065 -13.159 336 HH12 ARG 42 2HH1 ARG 42 -12.159 7.848 -13.901 337 HH21 ARG 42 1HH2 ARG 42 -14.519 7.044 -11.371 338 HH22 ARG 42 2HH2 ARG 42 -14.302 7.810 -12.879 339 H THR 43 H THR 43 -7.454 6.578 -9.788 340 HA THR 43 HA THR 43 -6.389 5.910 -7.160 341 HB THR 43 HB THR 43 -4.502 6.125 -8.779 342 HG1 THR 43 1HG THR 43 -3.313 7.148 -7.400 343 HG21 THR 43 3HG2 THR 43 -5.453 8.970 -9.102 344 HG22 THR 43 1HG2 THR 43 -5.465 7.715 -10.342 345 HG23 THR 43 2HG2 THR 43 -3.932 8.325 -9.718 346 H LYS 44 H LYS 44 -6.466 7.720 -5.707 347 HA LYS 44 HA LYS 44 -8.573 9.582 -6.498 348 HB2 LYS 44 2HB LYS 44 -9.023 7.955 -4.654 349 HB3 LYS 44 1HB LYS 44 -7.672 8.659 -3.776 350 HG2 LYS 44 2HG LYS 44 -10.175 10.184 -4.504 351 HG3 LYS 44 1HG LYS 44 -9.989 9.307 -2.993 352 HD2 LYS 44 2HD LYS 44 -7.991 10.721 -2.519 353 HD3 LYS 44 1HD LYS 44 -8.369 11.659 -3.968 354 HE2 LYS 44 2HE LYS 44 -9.260 12.783 -2.013 355 HE3 LYS 44 1HE LYS 44 -10.570 12.172 -3.022 356 HZ1 LYS 44 3HZ LYS 44 -10.842 10.305 -1.495 357 HZ2 LYS 44 1HZ LYS 44 -10.963 11.772 -0.664 358 HZ3 LYS 44 2HZ LYS 44 -9.553 10.842 -0.572 359 H LYS 45 H LYS 45 -7.778 11.313 -7.021 360 HA LYS 45 HA LYS 45 -5.437 12.514 -5.694 361 HB2 LYS 45 2HB LYS 45 -4.765 11.376 -7.934 362 HB3 LYS 45 1HB LYS 45 -5.908 12.459 -8.660 363 HG2 LYS 45 2HG LYS 45 -4.606 14.349 -8.090 364 HG3 LYS 45 1HG LYS 45 -3.486 13.349 -7.159 365 HD2 LYS 45 2HD LYS 45 -4.131 12.885 -9.992 366 HD3 LYS 45 1HD LYS 45 -2.727 13.910 -9.545 367 HE2 LYS 45 2HE LYS 45 -1.908 11.811 -8.331 368 HE3 LYS 45 1HE LYS 45 -3.242 10.941 -9.085 369 HZ1 LYS 45 3HZ LYS 45 -1.265 10.644 -10.413 370 HZ2 LYS 45 1HZ LYS 45 -1.005 12.300 -10.451 371 HZ3 LYS 45 2HZ LYS 45 -2.320 11.655 -11.267 372 H ASP 46 H ASP 46 -5.898 14.593 -5.151 373 HA ASP 46 HA ASP 46 -6.808 16.688 -5.060 374 HB2 ASP 46 2HB ASP 46 -5.924 16.722 -7.433 375 HB3 ASP 46 1HB ASP 46 -7.506 16.209 -7.984 376 H GLY 47 H GLY 47 -8.389 14.423 -4.394 377 HA2 GLY 47 2HA GLY 47 -10.552 14.099 -3.553 378 HA3 GLY 47 1HA GLY 47 -10.981 15.658 -4.224 379 H LYS 48 H LYS 48 -9.584 13.735 -6.593 380 HA LYS 48 HA LYS 48 -12.232 12.996 -7.654 381 HB2 LYS 48 2HB LYS 48 -9.734 13.791 -9.151 382 HB3 LYS 48 1HB LYS 48 -11.315 13.460 -9.838 383 HG2 LYS 48 2HG LYS 48 -12.240 15.416 -8.790 384 HG3 LYS 48 1HG LYS 48 -10.722 15.710 -7.942 385 HD2 LYS 48 2HD LYS 48 -9.586 16.009 -10.087 386 HD3 LYS 48 1HD LYS 48 -11.115 15.747 -10.931 387 HE2 LYS 48 2HE LYS 48 -12.061 17.709 -9.861 388 HE3 LYS 48 1HE LYS 48 -10.576 17.952 -8.945 389 HZ1 LYS 48 3HZ LYS 48 -10.788 18.049 -11.901 390 HZ2 LYS 48 1HZ LYS 48 -9.402 18.331 -11.000 391 HZ3 LYS 48 2HZ LYS 48 -10.699 19.394 -10.899 392 H GLN 49 H GLN 49 -12.285 10.972 -8.790 393 HA GLN 49 HA GLN 49 -10.003 9.264 -8.308 394 HB2 GLN 49 2HB GLN 49 -12.858 8.553 -9.111 395 HB3 GLN 49 1HB GLN 49 -11.554 7.429 -8.894 396 HG2 GLN 49 2HG GLN 49 -13.017 7.388 -6.974 397 HG3 GLN 49 1HG GLN 49 -11.410 7.942 -6.516 398 HE21 GLN 49 1HE2 GLN 49 -12.172 8.927 -4.649 399 HE22 GLN 49 2HE2 GLN 49 -13.127 10.372 -4.682 400 H VAL 50 H VAL 50 -8.757 8.843 -9.946 401 HA VAL 50 HA VAL 50 -9.785 9.282 -12.662 402 HB VAL 50 HB VAL 50 -7.648 10.375 -13.302 403 HG11 VAL 50 1HG1 VAL 50 -8.065 12.555 -12.241 404 HG12 VAL 50 2HG1 VAL 50 -9.107 11.769 -11.060 405 HG13 VAL 50 3HG1 VAL 50 -9.565 11.785 -12.766 406 HG21 VAL 50 3HG2 VAL 50 -6.133 11.224 -11.556 407 HG22 VAL 50 1HG2 VAL 50 -6.207 9.462 -11.543 408 HG23 VAL 50 2HG2 VAL 50 -7.084 10.384 -10.332 409 H TRP 51 H TRP 51 -8.412 8.276 -14.318 410 HA TRP 51 HA TRP 51 -7.260 5.796 -13.339 411 HB2 TRP 51 2HB TRP 51 -7.950 6.705 -16.147 412 HB3 TRP 51 1HB TRP 51 -7.303 5.148 -15.796 413 HD1 TRP 51 HD TRP 51 -10.315 6.775 -16.449 414 HE1 TRP 51 1HE TRP 51 -12.384 5.383 -15.744 415 HE3 TRP 51 3HE TRP 51 -7.967 3.432 -13.474 416 HZ2 TRP 51 2HZ TRP 51 -12.902 3.121 -14.100 417 HZ3 TRP 51 3HZ TRP 51 -9.291 1.664 -12.376 418 HH2 TRP 51 HH TRP 51 -11.707 1.523 -12.682 419 H GLU 52 H GLU 52 -5.174 5.787 -12.999 420 HA GLU 52 HA GLU 52 -3.449 7.545 -14.604 421 HB2 GLU 52 2HB GLU 52 -3.477 8.079 -12.178 422 HB3 GLU 52 1HB GLU 52 -3.024 6.423 -11.817 423 HG2 GLU 52 2HG GLU 52 -0.901 6.770 -13.027 424 HG3 GLU 52 1HG GLU 52 -1.354 8.451 -13.287 425 H ALA 53 H ALA 53 -1.631 6.576 -15.496 426 HA ALA 53 HA ALA 53 -1.828 3.853 -16.157 427 HB1 ALA 53 1HB ALA 53 0.563 5.680 -16.390 428 HB2 ALA 53 2HB ALA 53 -0.705 5.488 -17.603 429 HB3 ALA 53 3HB ALA 53 0.355 4.136 -17.214 430 H ALA 54 H ALA 54 -0.895 2.091 -15.360 431 HA ALA 54 HA ALA 54 -0.064 2.018 -12.714 432 HB1 ALA 54 1HB ALA 54 0.427 -0.011 -14.882 433 HB2 ALA 54 2HB ALA 54 -1.024 0.097 -13.882 434 HB3 ALA 54 3HB ALA 54 0.530 -0.301 -13.145 435 H SER 55 H SER 55 2.025 1.378 -11.902 436 HA SER 55 HA SER 55 4.080 2.935 -13.230 437 HB2 SER 55 2HB SER 55 3.476 3.419 -10.870 438 HB3 SER 55 1HB SER 55 3.910 1.771 -10.438 439 HG SER 55 HG SER 55 5.414 3.867 -10.532 440 H LYS 56 H LYS 56 6.029 1.966 -13.757 441 HA LYS 56 HA LYS 56 6.064 -0.695 -14.563 442 HB2 LYS 56 2HB LYS 56 7.617 1.108 -15.343 443 HB3 LYS 56 1HB LYS 56 8.448 0.990 -13.801 444 HG2 LYS 56 2HG LYS 56 8.988 -1.362 -14.307 445 HG3 LYS 56 1HG LYS 56 8.229 -1.167 -15.886 446 HD2 LYS 56 2HD LYS 56 9.799 0.656 -16.380 447 HD3 LYS 56 1HD LYS 56 10.597 0.365 -14.835 448 HE2 LYS 56 2HE LYS 56 11.047 -1.976 -15.592 449 HE3 LYS 56 1HE LYS 56 10.375 -1.538 -17.156 450 HZ1 LYS 56 3HZ LYS 56 12.750 -1.378 -17.204 451 HZ2 LYS 56 1HZ LYS 56 12.743 -0.338 -15.875 452 HZ3 LYS 56 2HZ LYS 56 12.092 0.167 -17.362 453 H THR 57 H THR 57 7.115 0.848 -11.599 454 HA THR 57 HA THR 57 8.395 -1.285 -10.382 455 HB THR 57 HB THR 57 6.838 0.970 -9.095 456 HG1 THR 57 1HG THR 57 8.988 1.966 -9.164 457 HG21 THR 57 3HG2 THR 57 9.216 -0.644 -8.130 458 HG22 THR 57 1HG2 THR 57 7.563 -0.797 -7.530 459 HG23 THR 57 2HG2 THR 57 8.463 0.697 -7.270 460 H ALA 58 H ALA 58 4.985 -0.210 -10.183 461 HA ALA 58 HA ALA 58 4.185 -2.309 -8.419 462 HB1 ALA 58 1HB ALA 58 2.486 -0.571 -10.222 463 HB2 ALA 58 2HB ALA 58 2.940 -0.189 -8.559 464 HB3 ALA 58 3HB ALA 58 1.894 -1.566 -8.895 465 H LEU 59 H LEU 59 4.154 -1.861 -11.903 466 HA LEU 59 HA LEU 59 2.746 -4.162 -12.566 467 HB2 LEU 59 2HB LEU 59 4.796 -2.512 -14.025 468 HB3 LEU 59 1HB LEU 59 3.958 -3.950 -14.743 469 HG LEU 59 HG LEU 59 2.565 -1.459 -13.746 470 HD11 LEU 59 1HD1 LEU 59 4.140 -0.863 -15.537 471 HD12 LEU 59 2HD1 LEU 59 2.472 -0.789 -16.101 472 HD13 LEU 59 3HD1 LEU 59 3.485 -2.164 -16.537 473 HD21 LEU 59 3HD2 LEU 59 0.761 -2.280 -15.115 474 HD22 LEU 59 1HD2 LEU 59 1.258 -3.565 -14.010 475 HD23 LEU 59 2HD2 LEU 59 1.768 -3.607 -15.691 476 H LYS 60 H LYS 60 6.232 -3.643 -12.013 477 HA LYS 60 HA LYS 60 6.940 -6.296 -12.668 478 HB2 LYS 60 2HB LYS 60 8.432 -4.290 -10.954 479 HB3 LYS 60 1HB LYS 60 9.083 -5.860 -11.409 480 HG2 LYS 60 2HG LYS 60 8.295 -3.669 -13.310 481 HG3 LYS 60 1HG LYS 60 9.940 -4.078 -12.819 482 HD2 LYS 60 2HD LYS 60 9.703 -6.294 -13.815 483 HD3 LYS 60 1HD LYS 60 8.036 -5.943 -14.251 484 HE2 LYS 60 2HE LYS 60 8.818 -4.098 -15.658 485 HE3 LYS 60 1HE LYS 60 10.480 -4.520 -15.238 486 HZ1 LYS 60 3HZ LYS 60 8.584 -6.354 -16.608 487 HZ2 LYS 60 1HZ LYS 60 10.217 -6.647 -16.327 488 HZ3 LYS 60 2HZ LYS 60 9.748 -5.444 -17.404 489 H LYS 61 H LYS 61 5.892 -4.898 -9.625 490 HA LYS 61 HA LYS 61 6.339 -7.299 -8.163 491 HB2 LYS 61 2HB LYS 61 4.725 -4.831 -7.621 492 HB3 LYS 61 1HB LYS 61 4.472 -6.248 -6.622 493 HG2 LYS 61 2HG LYS 61 6.030 -4.608 -5.625 494 HG3 LYS 61 1HG LYS 61 6.754 -6.191 -5.861 495 HD2 LYS 61 2HD LYS 61 7.887 -5.371 -7.862 496 HD3 LYS 61 1HD LYS 61 7.127 -3.791 -7.654 497 HE2 LYS 61 2HE LYS 61 8.263 -3.480 -5.551 498 HE3 LYS 61 1HE LYS 61 8.941 -5.102 -5.640 499 HZ1 LYS 61 3HZ LYS 61 10.509 -3.362 -6.301 500 HZ2 LYS 61 1HZ LYS 61 9.538 -2.935 -7.603 501 HZ3 LYS 61 2HZ LYS 61 10.237 -4.459 -7.532 502 H SER 62 H SER 62 3.663 -6.100 -10.057 503 HA SER 62 HA SER 62 1.827 -8.112 -9.306 504 HB2 SER 62 2HB SER 62 1.962 -6.381 -11.782 505 HB3 SER 62 1HB SER 62 0.558 -7.328 -11.268 506 HG SER 62 HG SER 62 1.781 -5.150 -9.922 507 H TRP 63 H TRP 63 4.235 -7.804 -11.925 508 HA TRP 63 HA TRP 63 3.466 -10.228 -13.142 509 HB2 TRP 63 2HB TRP 63 4.549 -8.434 -14.420 510 HB3 TRP 63 1HB TRP 63 6.004 -8.606 -13.444 511 HD1 TRP 63 HD TRP 63 7.642 -10.434 -14.077 512 HE1 TRP 63 1HE TRP 63 7.786 -12.205 -16.003 513 HE3 TRP 63 3HE TRP 63 2.943 -9.956 -15.952 514 HZ2 TRP 63 2HZ TRP 63 6.091 -13.221 -18.020 515 HZ3 TRP 63 3HZ TRP 63 2.269 -11.357 -17.866 516 HH2 TRP 63 HH TRP 63 3.814 -12.945 -18.873 517 H LYS 64 H LYS 64 5.862 -9.297 -10.724 518 HA LYS 64 HA LYS 64 7.212 -11.746 -10.804 519 HB2 LYS 64 2HB LYS 64 8.246 -9.778 -9.762 520 HB3 LYS 64 1HB LYS 64 7.034 -9.806 -8.487 521 HG2 LYS 64 2HG LYS 64 9.169 -10.758 -7.746 522 HG3 LYS 64 1HG LYS 64 7.868 -11.951 -7.701 523 HD2 LYS 64 2HD LYS 64 8.634 -12.828 -9.887 524 HD3 LYS 64 1HD LYS 64 9.968 -11.674 -9.859 525 HE2 LYS 64 2HE LYS 64 10.822 -12.713 -7.842 526 HE3 LYS 64 1HE LYS 64 9.458 -13.830 -7.821 527 HZ1 LYS 64 3HZ LYS 64 11.443 -14.858 -8.798 528 HZ2 LYS 64 1HZ LYS 64 11.516 -13.670 -9.964 529 HZ3 LYS 64 2HZ LYS 64 10.236 -14.746 -9.944 530 H ARG 65 H ARG 65 4.399 -10.704 -9.000 531 HA ARG 65 HA ARG 65 4.231 -13.069 -7.414 532 HB2 ARG 65 2HB ARG 65 3.022 -10.843 -6.976 533 HB3 ARG 65 1HB ARG 65 1.962 -11.277 -8.278 534 HG2 ARG 65 2HG ARG 65 1.198 -13.252 -7.089 535 HG3 ARG 65 1HG ARG 65 2.273 -12.874 -5.739 536 HD2 ARG 65 2HD ARG 65 -0.029 -11.189 -6.744 537 HD3 ARG 65 1HD ARG 65 0.002 -12.134 -5.257 538 HE ARG 65 HE ARG 65 2.109 -10.546 -4.936 539 HH11 ARG 65 1HH1 ARG 65 -1.267 -9.779 -5.822 540 HH12 ARG 65 2HH1 ARG 65 -1.216 -8.221 -5.174 541 HH21 ARG 65 1HH2 ARG 65 2.137 -8.362 -4.041 542 HH22 ARG 65 2HH2 ARG 65 0.744 -7.394 -4.139 543 H TYR 66 H TYR 66 3.274 -12.153 -10.607 544 HA TYR 66 HA TYR 66 1.513 -14.314 -11.232 545 HB2 TYR 66 2HB TYR 66 1.626 -12.089 -12.398 546 HB3 TYR 66 1HB TYR 66 3.173 -12.570 -13.068 547 HD1 TYR 66 2HD TYR 66 -0.350 -13.688 -12.876 548 HD2 TYR 66 1HD TYR 66 3.201 -13.525 -15.175 549 HE1 TYR 66 2HE TYR 66 -1.564 -14.625 -14.782 550 HE2 TYR 66 1HE TYR 66 2.019 -14.468 -17.102 551 HH TYR 66 HH TYR 66 -1.387 -14.704 -17.206 552 H GLU 67 H GLU 67 4.952 -13.674 -11.719 553 HA GLU 67 HA GLU 67 5.914 -16.071 -12.893 554 HB2 GLU 67 2HB GLU 67 7.118 -14.441 -10.657 555 HB3 GLU 67 1HB GLU 67 7.966 -15.620 -11.635 556 HG2 GLU 67 2HG GLU 67 6.609 -13.245 -12.697 557 HG3 GLU 67 1HG GLU 67 8.309 -13.200 -12.211 558 H GLN 68 H GLN 68 5.283 -15.210 -9.637 559 HA GLN 68 HA GLN 68 6.123 -17.569 -8.446 560 HB2 GLN 68 2HB GLN 68 3.948 -15.742 -7.420 561 HB3 GLN 68 1HB GLN 68 4.712 -17.019 -6.484 562 HG2 GLN 68 2HG GLN 68 6.897 -15.859 -6.820 563 HG3 GLN 68 1HG GLN 68 6.022 -14.552 -7.595 564 HE21 GLN 68 1HE2 GLN 68 6.692 -16.168 -4.644 565 HE22 GLN 68 2HE2 GLN 68 6.067 -14.960 -3.574 566 H GLU 69 H GLU 69 2.772 -16.838 -9.594 567 HA GLU 69 HA GLU 69 2.004 -19.475 -8.788 568 HB2 GLU 69 2HB GLU 69 -0.167 -19.146 -9.804 569 HB3 GLU 69 1HB GLU 69 0.262 -17.727 -8.879 570 HG2 GLU 69 2HG GLU 69 0.661 -16.465 -10.841 571 HG3 GLU 69 1HG GLU 69 0.622 -17.910 -11.853 572 H MET 70 H MET 70 3.107 -18.087 -11.860 573 HA MET 70 HA MET 70 2.385 -20.136 -13.525 574 HB2 MET 70 2HB MET 70 3.108 -17.937 -14.231 575 HB3 MET 70 1HB MET 70 4.706 -18.219 -13.558 576 HG2 MET 70 2HG MET 70 5.016 -20.037 -15.036 577 HG3 MET 70 1HG MET 70 3.408 -19.739 -15.729 578 HE1 MET 70 3HE MET 70 2.775 -17.542 -17.098 579 HE2 MET 70 1HE MET 70 3.882 -16.204 -17.395 580 HE3 MET 70 2HE MET 70 3.333 -16.538 -15.759 581 H LEU 71 H LEU 71 5.408 -19.510 -11.743 582 HA LEU 71 HA LEU 71 6.641 -21.907 -12.559 583 HB2 LEU 71 2HB LEU 71 7.932 -20.020 -12.023 584 HB3 LEU 71 1HB LEU 71 7.253 -19.841 -10.435 585 HG LEU 71 HG LEU 71 8.346 -22.029 -9.850 586 HD11 LEU 71 1HD1 LEU 71 10.170 -22.829 -11.299 587 HD12 LEU 71 2HD1 LEU 71 9.704 -21.647 -12.522 588 HD13 LEU 71 3HD1 LEU 71 8.597 -22.948 -12.085 589 HD21 LEU 71 3HD2 LEU 71 9.345 -19.916 -9.207 590 HD22 LEU 71 1HD2 LEU 71 10.157 -19.809 -10.768 591 HD23 LEU 71 2HD2 LEU 71 10.598 -21.084 -9.637 592 H LYS 72 H LYS 72 4.632 -20.944 -9.901 593 HA LYS 72 HA LYS 72 4.947 -22.957 -8.021 594 HB2 LYS 72 2HB LYS 72 3.572 -20.987 -7.701 595 HB3 LYS 72 1HB LYS 72 2.502 -21.503 -8.976 596 HG2 LYS 72 2HG LYS 72 1.736 -23.357 -7.560 597 HG3 LYS 72 1HG LYS 72 2.824 -22.794 -6.278 598 HD2 LYS 72 2HD LYS 72 1.711 -20.663 -6.179 599 HD3 LYS 72 1HD LYS 72 0.692 -21.075 -7.548 600 HE2 LYS 72 2HE LYS 72 -0.338 -22.851 -6.211 601 HE3 LYS 72 1HE LYS 72 0.684 -22.403 -4.849 602 HZ1 LYS 72 3HZ LYS 72 -1.288 -20.589 -6.146 603 HZ2 LYS 72 1HZ LYS 72 -0.355 -20.237 -4.799 604 HZ3 LYS 72 2HZ LYS 72 -1.533 -21.422 -4.700 605 H ASN 73 H ASN 73 2.681 -22.855 -10.756 606 HA ASN 73 HA ASN 73 1.592 -25.423 -10.356 607 HB2 ASN 73 2HB ASN 73 0.355 -23.773 -11.602 608 HB3 ASN 73 1HB ASN 73 1.622 -23.654 -12.811 609 HD21 ASN 73 1HD2 ASN 73 1.694 -25.166 -14.442 610 HD22 ASN 73 2HD2 ASN 73 0.476 -26.347 -14.685 611 H GLU 74 H GLU 74 4.417 -24.409 -12.139 612 HA GLU 74 HA GLU 74 4.618 -26.942 -13.536 613 HB2 GLU 74 2HB GLU 74 5.186 -24.827 -14.667 614 HB3 GLU 74 1HB GLU 74 6.476 -24.557 -13.511 615 HG2 GLU 74 2HG GLU 74 7.623 -26.561 -14.337 616 HG3 GLU 74 1HG GLU 74 6.317 -26.822 -15.492 617 H LYS 75 H LYS 75 6.102 -25.324 -10.804 618 HA LYS 75 HA LYS 75 8.186 -27.342 -10.634 619 HB2 LYS 75 2HB LYS 75 8.832 -25.009 -10.452 620 HB3 LYS 75 1HB LYS 75 7.757 -24.795 -9.086 621 HG2 LYS 75 2HG LYS 75 9.118 -26.360 -7.781 622 HG3 LYS 75 1HG LYS 75 10.202 -26.551 -9.160 623 HD2 LYS 75 2HD LYS 75 10.717 -24.157 -9.086 624 HD3 LYS 75 1HD LYS 75 9.632 -23.961 -7.713 625 HE2 LYS 75 2HE LYS 75 11.942 -24.082 -6.951 626 HE3 LYS 75 1HE LYS 75 11.039 -25.491 -6.401 627 HZ1 LYS 75 3HZ LYS 75 13.217 -26.098 -7.236 628 HZ2 LYS 75 1HZ LYS 75 12.861 -25.437 -8.744 629 HZ3 LYS 75 2HZ LYS 75 12.019 -26.785 -8.172 630 H VAL 76 H VAL 76 5.560 -26.076 -8.534 631 HA VAL 76 HA VAL 76 6.094 -28.384 -6.759 632 HB VAL 76 HB VAL 76 5.051 -25.674 -5.907 633 HG11 VAL 76 1HG1 VAL 76 4.196 -27.450 -4.502 634 HG12 VAL 76 2HG1 VAL 76 5.384 -26.493 -3.614 635 HG13 VAL 76 3HG1 VAL 76 5.828 -28.073 -4.258 636 HG21 VAL 76 3HG2 VAL 76 7.775 -26.906 -5.510 637 HG22 VAL 76 1HG2 VAL 76 7.226 -25.393 -4.781 638 HG23 VAL 76 2HG2 VAL 76 7.393 -25.521 -6.533 639 H ALA 77 H ALA 77 3.545 -26.048 -7.495 640 HA ALA 77 HA ALA 77 1.346 -26.068 -7.423 641 HB1 ALA 77 1HB ALA 77 1.569 -27.667 -9.292 642 HB2 ALA 77 2HB ALA 77 0.106 -27.915 -8.329 643 HB3 ALA 77 3HB ALA 77 1.486 -28.998 -8.126 644 H ALA 78 H ALA 78 1.267 -25.555 -5.360 645 HA ALA 78 HA ALA 78 -0.313 -27.163 -3.669 646 HB1 ALA 78 1HB ALA 78 2.557 -26.632 -2.811 647 HB2 ALA 78 2HB ALA 78 1.861 -28.218 -3.142 648 HB3 ALA 78 3HB ALA 78 1.279 -27.270 -1.774 649 H LYS 79 H LYS 79 -0.981 -25.807 -1.829 650 HA LYS 79 HA LYS 79 -0.578 -23.001 -2.551 651 HB2 LYS 79 2HB LYS 79 -2.860 -23.950 -2.828 652 HB3 LYS 79 1HB LYS 79 -2.904 -24.270 -1.109 653 HG2 LYS 79 2HG LYS 79 -2.835 -21.917 -0.627 654 HG3 LYS 79 1HG LYS 79 -2.622 -21.547 -2.340 655 HD2 LYS 79 2HD LYS 79 -4.780 -22.534 -2.833 656 HD3 LYS 79 1HD LYS 79 -4.993 -22.937 -1.130 657 HE2 LYS 79 2HE LYS 79 -4.902 -20.582 -0.564 658 HE3 LYS 79 1HE LYS 79 -4.714 -20.161 -2.269 659 HZ1 LYS 79 3HZ LYS 79 -7.032 -21.576 -1.090 660 HZ2 LYS 79 1HZ LYS 79 -6.889 -21.098 -2.703 661 HZ3 LYS 79 2HZ LYS 79 -7.009 -19.933 -1.473 662 H MET 80 H MET 80 -0.354 -21.447 -0.867 663 HA MET 80 HA MET 80 1.154 -22.465 1.387 664 HB2 MET 80 2HB MET 80 1.735 -20.131 1.845 665 HB3 MET 80 1HB MET 80 2.013 -20.529 0.159 666 HG2 MET 80 2HG MET 80 -0.113 -19.414 -0.420 667 HG3 MET 80 1HG MET 80 -0.310 -18.971 1.274 668 HE1 MET 80 3HE MET 80 -0.564 -16.367 0.584 669 HE2 MET 80 1HE MET 80 -0.414 -16.854 -1.109 670 HE3 MET 80 2HE MET 80 0.583 -15.547 -0.468 671 H LEU 81 H LEU 81 -2.006 -21.882 0.883 672 HA LEU 81 HA LEU 81 -3.825 -22.093 2.166 673 HB2 LEU 81 2HB LEU 81 -2.644 -23.604 3.627 674 HB3 LEU 81 1HB LEU 81 -1.905 -22.270 4.488 675 HG LEU 81 HG LEU 81 -4.131 -21.622 5.341 676 HD11 LEU 81 1HD1 LEU 81 -5.998 -23.168 5.100 677 HD12 LEU 81 2HD1 LEU 81 -5.051 -24.139 3.970 678 HD13 LEU 81 3HD1 LEU 81 -5.508 -22.485 3.552 679 HD21 LEU 81 3HD2 LEU 81 -4.372 -23.490 6.905 680 HD22 LEU 81 1HD2 LEU 81 -2.679 -23.064 6.658 681 HD23 LEU 81 2HD2 LEU 81 -3.354 -24.487 5.866 682 H GLU 82 H GLU 82 -5.202 -20.553 2.331 683 HA GLU 82 HA GLU 82 -4.412 -17.894 3.148 684 HB2 GLU 82 2HB GLU 82 -7.068 -18.994 2.244 685 HB3 GLU 82 1HB GLU 82 -6.729 -17.298 2.558 686 HG2 GLU 82 2HG GLU 82 -5.097 -17.287 0.766 687 HG3 GLU 82 1HG GLU 82 -5.393 -19.000 0.484 688 H LYS 83 H LYS 83 -4.336 -17.439 5.181 689 HA LYS 83 HA LYS 83 -6.538 -18.286 6.865 690 HB2 LYS 83 2HB LYS 83 -4.922 -18.763 8.718 691 HB3 LYS 83 1HB LYS 83 -4.871 -19.905 7.386 692 HG2 LYS 83 2HG LYS 83 -2.851 -18.771 6.532 693 HG3 LYS 83 1HG LYS 83 -2.906 -17.676 7.915 694 HD2 LYS 83 2HD LYS 83 -2.662 -19.573 9.435 695 HD3 LYS 83 1HD LYS 83 -2.644 -20.674 8.057 696 HE2 LYS 83 2HE LYS 83 -0.601 -19.608 7.232 697 HE3 LYS 83 1HE LYS 83 -0.622 -18.505 8.606 698 HZ1 LYS 83 3HZ LYS 83 -0.327 -20.394 10.085 699 HZ2 LYS 83 1HZ LYS 83 0.898 -20.368 8.943 700 HZ3 LYS 83 2HZ LYS 83 -0.354 -21.468 8.795 701 H ASP 84 H ASP 84 -7.470 -16.553 7.575 702 HA ASP 84 HA ASP 84 -5.805 -14.257 8.360 703 HB2 ASP 84 2HB ASP 84 -8.627 -14.208 7.235 704 HB3 ASP 84 1HB ASP 84 -7.783 -12.822 7.892 705 H ALA 85 H ALA 85 -6.193 -13.428 10.346 706 HA ALA 85 HA ALA 85 -7.815 -15.055 12.085 707 HB1 ALA 85 1HB ALA 85 -5.595 -14.360 12.821 708 HB2 ALA 85 2HB ALA 85 -6.840 -13.678 13.873 709 HB3 ALA 85 3HB ALA 85 -6.060 -12.666 12.660 710 H THR 86 H THR 86 -9.938 -14.631 12.050 711 HA THR 86 HA THR 86 -11.026 -12.134 11.354 712 HB THR 86 HB THR 86 -12.339 -14.430 12.841 713 HG1 THR 86 1HG THR 86 -11.509 -14.073 10.245 714 HG21 THR 86 3HG2 THR 86 -13.630 -12.332 12.915 715 HG22 THR 86 1HG2 THR 86 -14.427 -13.524 11.892 716 HG23 THR 86 2HG2 THR 86 -13.519 -12.200 11.160 717 H GLU 87 H GLU 87 -10.698 -10.414 12.565 718 HA GLU 87 HA GLU 87 -10.335 -10.576 15.425 719 HB2 GLU 87 2HB GLU 87 -10.409 -8.171 13.604 720 HB3 GLU 87 1HB GLU 87 -9.818 -8.204 15.255 721 HG2 GLU 87 2HG GLU 87 -7.996 -9.681 14.609 722 HG3 GLU 87 1HG GLU 87 -8.611 -9.726 12.962 723 H VAL 88 H VAL 88 -12.156 -10.804 16.563 724 HA VAL 88 HA VAL 88 -14.495 -9.296 15.682 725 HB VAL 88 HB VAL 88 -14.850 -11.733 15.718 726 HG11 VAL 88 1HG1 VAL 88 -13.312 -12.412 17.420 727 HG12 VAL 88 2HG1 VAL 88 -14.931 -12.988 17.823 728 HG13 VAL 88 3HG1 VAL 88 -14.259 -11.589 18.659 729 HG21 VAL 88 3HG2 VAL 88 -16.900 -11.789 17.094 730 HG22 VAL 88 1HG2 VAL 88 -16.773 -10.317 16.129 731 HG23 VAL 88 2HG2 VAL 88 -16.402 -10.280 17.853 732 H GLY 89 H GLY 89 -15.409 -7.844 16.921 733 HA2 GLY 89 2HA GLY 89 -14.248 -7.394 19.581 734 HA3 GLY 89 1HA GLY 89 -14.981 -6.150 18.563 735 H VAL 90 H VAL 90 -16.238 -5.732 20.533 736 HA VAL 90 HA VAL 90 -18.241 -7.710 21.147 737 HB VAL 90 HB VAL 90 -19.109 -6.136 22.827 738 HG11 VAL 90 1HG1 VAL 90 -16.112 -6.365 22.906 739 HG12 VAL 90 2HG1 VAL 90 -17.268 -7.573 23.461 740 HG13 VAL 90 3HG1 VAL 90 -17.146 -6.018 24.292 741 HG21 VAL 90 3HG2 VAL 90 -18.738 -4.027 21.633 742 HG22 VAL 90 1HG2 VAL 90 -16.996 -4.216 21.831 743 HG23 VAL 90 2HG2 VAL 90 -18.026 -3.972 23.242 744 H LYS 91 H LYS 91 -20.447 -7.470 20.791 745 HA LYS 91 HA LYS 91 -21.019 -6.227 18.286 746 HB2 LYS 91 2HB LYS 91 -21.961 -8.492 19.055 747 HB3 LYS 91 1HB LYS 91 -22.928 -7.568 20.194 748 HG2 LYS 91 2HG LYS 91 -23.167 -7.073 17.254 749 HG3 LYS 91 1HG LYS 91 -24.030 -8.392 18.029 750 HD2 LYS 91 2HD LYS 91 -24.146 -5.571 18.965 751 HD3 LYS 91 1HD LYS 91 -25.321 -6.204 17.780 752 HE2 LYS 91 2HE LYS 91 -24.848 -7.123 20.643 753 HE3 LYS 91 1HE LYS 91 -26.237 -6.224 20.045 754 HZ1 LYS 91 3HZ LYS 91 -26.824 -8.145 18.659 755 HZ2 LYS 91 1HZ LYS 91 -26.742 -8.571 20.287 756 HZ3 LYS 91 2HZ LYS 91 -25.506 -8.997 19.237 757 H ALA 92 H ALA 92 -21.476 -4.194 18.075 758 HA ALA 92 HA ALA 92 -22.325 -2.633 20.340 759 HB1 ALA 92 1HB ALA 92 -20.534 -1.809 18.908 760 HB2 ALA 92 2HB ALA 92 -21.917 -0.714 18.900 761 HB3 ALA 92 3HB ALA 92 -21.638 -1.792 17.532 762 H ALA 93 H ALA 93 -24.382 -2.319 20.751 763 HA ALA 93 HA ALA 93 -26.375 -2.792 18.717 764 HB1 ALA 93 1HB ALA 93 -26.725 -3.684 20.971 765 HB2 ALA 93 2HB ALA 93 -27.970 -2.503 20.562 766 HB3 ALA 93 3HB ALA 93 -26.642 -2.050 21.630 767 H LEU 94 H LEU 94 -27.780 -1.197 17.994 768 HA LEU 94 HA LEU 94 -26.596 1.393 17.939 769 HB2 LEU 94 2HB LEU 94 -28.467 2.033 16.438 770 HB3 LEU 94 1HB LEU 94 -27.577 0.639 15.896 771 HG LEU 94 HG LEU 94 -29.471 -0.794 16.784 772 HD11 LEU 94 1HD1 LEU 94 -30.509 0.774 18.319 773 HD12 LEU 94 2HD1 LEU 94 -31.658 0.238 17.099 774 HD13 LEU 94 3HD1 LEU 94 -30.925 1.835 16.975 775 HD21 LEU 94 3HD2 LEU 94 -30.099 1.187 14.616 776 HD22 LEU 94 1HD2 LEU 94 -30.903 -0.362 14.862 777 HD23 LEU 94 2HD2 LEU 94 -29.192 -0.312 14.433 778 H GLU 95 H GLU 95 -27.716 3.370 18.428 779 HA GLU 95 HA GLU 95 -29.138 3.064 20.941 780 HB2 GLU 95 2HB GLU 95 -28.664 5.482 21.241 781 HB3 GLU 95 1HB GLU 95 -27.214 4.503 21.062 782 HG2 GLU 95 2HG GLU 95 -26.951 5.216 18.797 783 HG3 GLU 95 1HG GLU 95 -28.483 6.083 18.840 784 H GLU 96 H GLU 96 -31.198 3.597 21.164 785 HA GLU 96 HA GLU 96 -32.520 4.587 18.791 786 HB2 GLU 96 2HB GLU 96 -34.643 3.730 19.937 787 HB3 GLU 96 1HB GLU 96 -33.510 2.553 19.311 788 HG2 GLU 96 2HG GLU 96 -34.359 1.808 21.421 789 HG3 GLU 96 1HG GLU 96 -32.663 2.197 21.598 790 H ALA 97 H ALA 97 -34.687 5.760 19.355 791 HA ALA 97 HA ALA 97 -34.375 7.699 21.467 792 HB1 ALA 97 1HB ALA 97 -34.560 9.588 19.896 793 HB2 ALA 97 2HB ALA 97 -34.431 8.467 18.541 794 HB3 ALA 97 3HB ALA 97 -33.068 8.684 19.639 795 H LYS 98 H LYS 98 -36.360 8.863 21.756 796 HA LYS 98 HA LYS 98 -38.639 7.303 20.916 797 HB2 LYS 98 2HB LYS 98 -39.944 8.788 22.382 798 HB3 LYS 98 1HB LYS 98 -38.580 8.072 23.224 799 HG2 LYS 98 2HG LYS 98 -37.349 10.159 23.044 800 HG3 LYS 98 1HG LYS 98 -38.663 10.868 22.104 801 HD2 LYS 98 2HD LYS 98 -40.175 10.603 24.000 802 HD3 LYS 98 1HD LYS 98 -38.872 9.868 24.941 803 HE2 LYS 98 2HE LYS 98 -37.610 11.928 24.852 804 HE3 LYS 98 1HE LYS 98 -38.825 12.652 23.802 805 HZ1 LYS 98 3HZ LYS 98 -39.090 13.363 26.078 806 HZ2 LYS 98 1HZ LYS 98 -39.312 11.767 26.602 807 HZ3 LYS 98 2HZ LYS 98 -40.423 12.486 25.560 808 H LYS 99 H LYS 99 -40.390 8.101 19.738 809 HA LYS 99 HA LYS 99 -39.703 10.373 18.038 810 HB2 LYS 99 2HB LYS 99 -39.916 8.215 16.884 811 HB3 LYS 99 1HB LYS 99 -41.520 8.004 17.555 812 HG2 LYS 99 2HG LYS 99 -41.671 8.681 15.262 813 HG3 LYS 99 1HG LYS 99 -42.280 9.971 16.299 814 HD2 LYS 99 2HD LYS 99 -40.161 11.158 16.064 815 HD3 LYS 99 1HD LYS 99 -39.529 9.853 15.059 816 HE2 LYS 99 2HE LYS 99 -41.904 11.603 14.420 817 HE3 LYS 99 1HE LYS 99 -40.304 11.727 13.694 818 HZ1 LYS 99 3HZ LYS 99 -42.152 9.397 13.447 819 HZ2 LYS 99 1HZ LYS 99 -40.602 9.487 12.792 820 HZ3 LYS 99 2HZ LYS 99 -41.806 10.517 12.258 821 H VAL 100 H VAL 100 -40.731 12.137 18.811 822 HA VAL 100 HA VAL 100 -43.282 11.765 20.088 823 HB VAL 100 HB VAL 100 -41.812 13.360 21.203 824 HG11 VAL 100 1HG1 VAL 100 -40.476 14.157 19.369 825 HG12 VAL 100 2HG1 VAL 100 -41.190 15.524 20.223 826 HG13 VAL 100 3HG1 VAL 100 -41.864 14.996 18.681 827 HG21 VAL 100 3HG2 VAL 100 -44.169 14.764 19.950 828 HG22 VAL 100 1HG2 VAL 100 -43.312 15.308 21.391 829 HG23 VAL 100 2HG2 VAL 100 -44.192 13.781 21.416 830 H GLN 101 H GLN 101 -44.611 11.097 18.621 831 HA GLN 101 HA GLN 101 -44.986 12.618 16.200 832 HB2 GLN 101 2HB GLN 101 -44.890 10.158 16.144 833 HB3 GLN 101 1HB GLN 101 -46.254 10.052 17.215 834 HG2 GLN 101 2HG GLN 101 -46.386 11.187 14.411 835 HG3 GLN 101 1HG GLN 101 -46.676 9.502 14.796 836 HE21 GLN 101 1HE2 GLN 101 -47.968 12.679 14.784 837 HE22 GLN 101 2HE2 GLN 101 -49.551 12.238 15.327 838 H ILE 102 H ILE 102 -45.947 14.433 16.608 839 HA ILE 102 HA ILE 102 -48.455 14.334 18.078 840 HB ILE 102 HB ILE 102 -46.897 15.667 19.349 841 HG12 ILE 102 2HG1 ILE 102 -48.818 17.494 17.891 842 HG13 ILE 102 1HG1 ILE 102 -49.231 16.457 19.250 843 HG21 ILE 102 1HG2 ILE 102 -45.275 16.219 17.661 844 HG22 ILE 102 2HG2 ILE 102 -45.829 17.694 18.462 845 HG23 ILE 102 3HG2 ILE 102 -46.429 17.286 16.857 846 HD11 ILE 102 3HD1 ILE 102 -47.298 18.765 19.307 847 HD12 ILE 102 1HD1 ILE 102 -47.714 17.733 20.673 848 HD13 ILE 102 2HD1 ILE 102 -48.944 18.764 19.941 849 H GLU 103 H GLU 103 -50.178 14.705 16.968 850 HA GLU 103 HA GLU 103 -49.997 16.280 14.510 851 HB2 GLU 103 2HB GLU 103 -49.940 13.809 14.037 852 HB3 GLU 103 1HB GLU 103 -51.482 13.658 14.852 853 HG2 GLU 103 2HG GLU 103 -52.513 15.073 13.135 854 HG3 GLU 103 1HG GLU 103 -50.953 15.208 12.327 855 H LEU 104 H LEU 104 -52.278 16.937 13.864 856 HA LEU 104 HA LEU 104 -53.631 18.048 16.114 857 HB2 LEU 104 2HB LEU 104 -54.586 17.812 13.262 858 HB3 LEU 104 1HB LEU 104 -55.249 18.868 14.485 859 HG LEU 104 HG LEU 104 -52.527 19.099 13.203 860 HD11 LEU 104 1HD1 LEU 104 -54.357 19.765 11.761 861 HD12 LEU 104 2HD1 LEU 104 -53.405 21.158 12.269 862 HD13 LEU 104 3HD1 LEU 104 -54.971 20.845 13.017 863 HD21 LEU 104 3HD2 LEU 104 -52.310 21.190 14.460 864 HD22 LEU 104 1HD2 LEU 104 -52.421 19.801 15.536 865 HD23 LEU 104 2HD2 LEU 104 -53.824 20.842 15.296 866 H ASP 105 H ASP 105 -55.084 17.055 17.350 867 HA ASP 105 HA ASP 105 -56.045 14.451 16.731 868 HB2 ASP 105 2HB ASP 105 -56.889 16.369 18.920 869 HB3 ASP 105 1HB ASP 105 -57.454 14.704 18.790 870 H THR 106 H THR 106 -57.193 17.613 16.258 871 HA THR 106 HA THR 106 -59.204 16.509 14.538 872 HB THR 106 HB THR 106 -60.473 17.095 16.520 873 HG1 THR 106 1HG THR 106 -60.974 19.175 14.619 874 HG21 THR 106 3HG2 THR 106 -59.274 19.864 16.339 875 HG22 THR 106 1HG2 THR 106 -58.985 18.673 17.603 876 HG23 THR 106 2HG2 THR 106 -60.581 19.407 17.433 877 H SER 107 H SER 107 -58.469 17.106 12.621 878 HA SER 107 HA SER 107 -56.621 19.250 12.317 879 HB2 SER 107 2HB SER 107 -56.513 17.178 10.964 880 HB3 SER 107 1HB SER 107 -58.030 17.618 10.184 881 HG SER 107 HG SER 107 -55.500 18.843 10.017 882 H LEU 108 H LEU 108 -60.042 18.865 11.809 883 HA LEU 108 HA LEU 108 -60.151 21.610 10.814 884 HB2 LEU 108 2HB LEU 108 -61.084 19.997 9.249 885 HB3 LEU 108 1HB LEU 108 -62.107 19.344 10.510 886 HG LEU 108 HG LEU 108 -63.365 21.419 10.609 887 HD11 LEU 108 1HD1 LEU 108 -61.634 22.995 9.965 888 HD12 LEU 108 2HD1 LEU 108 -63.040 23.159 8.918 889 HD13 LEU 108 3HD1 LEU 108 -61.598 22.321 8.337 890 HD21 LEU 108 3HD2 LEU 108 -64.460 21.248 8.418 891 HD22 LEU 108 1HD2 LEU 108 -64.134 19.666 9.124 892 HD23 LEU 108 2HD2 LEU 108 -63.109 20.284 7.828 893 H SER 109 H SER 109 -61.189 23.100 12.018 894 HA SER 109 HA SER 109 -62.289 22.281 14.511 895 HB2 SER 109 2HB SER 109 -62.516 24.773 14.814 896 HB3 SER 109 1HB SER 109 -60.870 24.239 14.477 897 HG SER 109 HG SER 109 -62.692 25.166 12.539 898 H TYR 110 H TYR 110 -64.356 21.684 14.595 899 HA TYR 110 HA TYR 110 -66.070 22.203 12.327 900 HB2 TYR 110 2HB TYR 110 -66.629 20.637 14.850 901 HB3 TYR 110 1HB TYR 110 -67.656 20.692 13.422 902 HD1 TYR 110 1HD TYR 110 -66.835 19.670 11.286 903 HD2 TYR 110 2HD TYR 110 -64.753 19.211 14.961 904 HE1 TYR 110 1HE TYR 110 -65.598 17.764 10.341 905 HE2 TYR 110 2HE TYR 110 -63.509 17.312 14.031 906 HH TYR 110 HH TYR 110 -63.459 16.604 10.736 907 H ILE 111 H ILE 111 -67.955 23.313 12.340 908 HA ILE 111 HA ILE 111 -69.471 24.846 12.831 909 HB ILE 111 HB ILE 111 -68.904 24.184 15.738 910 HG12 ILE 111 2HG1 ILE 111 -69.678 22.234 14.512 911 HG13 ILE 111 1HG1 ILE 111 -70.953 22.802 15.585 912 HG21 ILE 111 1HG2 ILE 111 -71.259 25.653 14.533 913 HG22 ILE 111 2HG2 ILE 111 -70.001 26.367 15.537 914 HG23 ILE 111 3HG2 ILE 111 -71.107 25.172 16.225 915 HD11 ILE 111 3HD1 ILE 111 -70.790 23.242 12.604 916 HD12 ILE 111 1HD1 ILE 111 -72.046 23.877 13.672 917 HD13 ILE 111 2HD1 ILE 111 -71.862 22.136 13.459 Start of MODEL 13 1 H1 GLY -1 1HT GLY -1 -2.246 -9.378 -25.119 2 H2 GLY -1 2HT GLY -1 -3.229 -10.578 -25.805 3 H3 GLY -1 3HT GLY -1 -3.842 -9.551 -24.625 4 HA2 GLY -1 1HA GLY -1 -3.003 -8.696 -27.314 5 HA3 GLY -1 2HA GLY -1 -4.661 -8.906 -26.753 6 H SER 0 H SER 0 -4.234 -6.483 -27.666 7 HA SER 0 HA SER 0 -3.214 -4.859 -25.520 8 HB2 SER 0 2HB SER 0 -2.552 -4.230 -27.800 9 HB3 SER 0 1HB SER 0 -4.245 -3.984 -28.222 10 HG SER 0 HG SER 0 -3.218 -2.021 -27.669 11 H MET 1 H MET 1 -4.741 -5.369 -24.029 12 HA MET 1 HA MET 1 -7.204 -3.861 -24.392 13 HB2 MET 1 2HB MET 1 -6.620 -6.117 -22.450 14 HB3 MET 1 1HB MET 1 -8.039 -5.098 -22.347 15 HG2 MET 1 2HG MET 1 -8.629 -7.191 -23.362 16 HG3 MET 1 1HG MET 1 -8.750 -5.917 -24.565 17 HE1 MET 1 3HE MET 1 -8.893 -7.767 -26.463 18 HE2 MET 1 1HE MET 1 -8.767 -9.028 -25.238 19 HE3 MET 1 2HE MET 1 -7.719 -9.067 -26.655 20 H THR 2 H THR 2 -7.418 -2.075 -23.256 21 HA THR 2 HA THR 2 -5.350 -1.292 -21.414 22 HB THR 2 HB THR 2 -7.992 0.029 -22.059 23 HG1 THR 2 1HG THR 2 -5.790 -0.334 -23.603 24 HG21 THR 2 3HG2 THR 2 -6.863 0.898 -20.063 25 HG22 THR 2 1HG2 THR 2 -6.835 2.092 -21.362 26 HG23 THR 2 2HG2 THR 2 -5.389 1.153 -20.997 27 H VAL 3 H VAL 3 -5.514 -1.936 -19.336 28 HA VAL 3 HA VAL 3 -8.154 -2.889 -18.483 29 HB VAL 3 HB VAL 3 -5.545 -3.528 -17.132 30 HG11 VAL 3 1HG1 VAL 3 -7.420 -3.938 -15.771 31 HG12 VAL 3 2HG1 VAL 3 -6.752 -5.464 -16.401 32 HG13 VAL 3 3HG1 VAL 3 -8.211 -4.811 -17.110 33 HG21 VAL 3 3HG2 VAL 3 -6.898 -5.192 -19.232 34 HG22 VAL 3 1HG2 VAL 3 -5.531 -5.654 -18.210 35 HG23 VAL 3 2HG2 VAL 3 -5.335 -4.366 -19.405 36 H TYR 4 H TYR 4 -9.114 -2.007 -16.740 37 HA TYR 4 HA TYR 4 -7.713 0.176 -15.442 38 HB2 TYR 4 2HB TYR 4 -10.673 -0.438 -15.630 39 HB3 TYR 4 1HB TYR 4 -9.954 1.008 -14.924 40 HD1 TYR 4 2HD TYR 4 -10.666 -0.767 -18.068 41 HD2 TYR 4 1HD TYR 4 -9.104 2.791 -16.344 42 HE1 TYR 4 2HE TYR 4 -10.719 0.303 -20.268 43 HE2 TYR 4 1HE TYR 4 -9.148 3.873 -18.548 44 HH TYR 4 HH TYR 4 -10.806 2.542 -21.207 45 H ILE 5 H ILE 5 -7.372 0.080 -13.303 46 HA ILE 5 HA ILE 5 -8.287 -2.335 -11.843 47 HB ILE 5 HB ILE 5 -5.833 -0.680 -11.241 48 HG12 ILE 5 2HG1 ILE 5 -4.420 -2.477 -11.832 49 HG13 ILE 5 1HG1 ILE 5 -5.680 -3.545 -12.328 50 HG21 ILE 5 1HG2 ILE 5 -6.772 -1.679 -9.282 51 HG22 ILE 5 2HG2 ILE 5 -5.227 -2.453 -9.653 52 HG23 ILE 5 3HG2 ILE 5 -6.748 -3.266 -10.030 53 HD11 ILE 5 3HD1 ILE 5 -4.690 -1.025 -13.701 54 HD12 ILE 5 1HD1 ILE 5 -6.131 -1.897 -14.214 55 HD13 ILE 5 2HD1 ILE 5 -4.552 -2.681 -14.280 56 H CYS 6 H CYS 6 -9.650 -1.831 -10.242 57 HA CYS 6 HA CYS 6 -9.068 0.580 -8.754 58 HB2 CYS 6 2HB CYS 6 -11.190 0.953 -9.944 59 HB3 CYS 6 1HB CYS 6 -11.815 -0.544 -9.251 60 HG CYS 6 HG CYS 6 -13.035 1.512 -7.938 61 HA PRO 7 HA PRO 7 -8.547 -2.923 -5.968 62 HB2 PRO 7 2HB PRO 7 -7.052 -1.570 -4.147 63 HB3 PRO 7 1HB PRO 7 -6.370 -2.250 -5.630 64 HG2 PRO 7 2HG PRO 7 -7.191 0.566 -5.036 65 HG3 PRO 7 1HG PRO 7 -5.746 -0.023 -5.876 66 HD2 PRO 7 2HD PRO 7 -7.896 0.949 -7.169 67 HD3 PRO 7 1HD PRO 7 -6.875 -0.334 -7.861 68 H GLU 8 H GLU 8 -10.244 -0.079 -5.750 69 HA GLU 8 HA GLU 8 -10.963 -0.332 -2.945 70 HB2 GLU 8 2HB GLU 8 -12.050 1.638 -4.947 71 HB3 GLU 8 1HB GLU 8 -12.128 1.740 -3.200 72 HG2 GLU 8 2HG GLU 8 -9.667 1.915 -3.187 73 HG3 GLU 8 1HG GLU 8 -9.757 1.980 -4.957 74 H THR 9 H THR 9 -12.883 0.315 -5.861 75 HA THR 9 HA THR 9 -15.085 -1.088 -4.613 76 HB THR 9 HB THR 9 -16.447 0.246 -6.201 77 HG1 THR 9 1HG THR 9 -15.475 1.568 -7.583 78 HG21 THR 9 3HG2 THR 9 -14.461 1.754 -4.519 79 HG22 THR 9 1HG2 THR 9 -15.963 1.052 -3.927 80 HG23 THR 9 2HG2 THR 9 -16.010 2.397 -5.070 81 H GLY 10 H GLY 10 -12.803 -1.588 -7.051 82 HA2 GLY 10 2HA GLY 10 -14.685 -3.152 -8.568 83 HA3 GLY 10 1HA GLY 10 -13.057 -2.914 -9.132 84 H ASP 11 H ASP 11 -12.942 -5.188 -9.410 85 HA ASP 11 HA ASP 11 -12.123 -6.782 -7.217 86 HB2 ASP 11 2HB ASP 11 -14.615 -6.798 -6.865 87 HB3 ASP 11 1HB ASP 11 -14.781 -7.487 -8.477 88 H ASP 12 H ASP 12 -11.115 -8.625 -8.021 89 HA ASP 12 HA ASP 12 -10.572 -8.335 -10.824 90 HB2 ASP 12 2HB ASP 12 -8.852 -10.049 -10.644 91 HB3 ASP 12 1HB ASP 12 -8.671 -8.845 -9.379 92 H GLY 13 H GLY 13 -12.987 -9.948 -9.290 93 HA2 GLY 13 2HA GLY 13 -13.184 -12.119 -11.163 94 HA3 GLY 13 1HA GLY 13 -14.384 -11.633 -9.968 95 H ASN 14 H ASN 14 -13.591 -8.887 -11.376 96 HA ASN 14 HA ASN 14 -15.936 -8.736 -13.021 97 HB2 ASN 14 2HB ASN 14 -13.748 -6.784 -12.387 98 HB3 ASN 14 1HB ASN 14 -15.002 -6.406 -13.552 99 HD21 ASN 14 1HD2 ASN 14 -14.388 -5.100 -11.039 100 HD22 ASN 14 2HD2 ASN 14 -15.800 -5.248 -10.055 101 H ASP 15 H ASP 15 -15.427 -7.295 -15.131 102 HA ASP 15 HA ASP 15 -14.136 -9.172 -16.920 103 HB2 ASP 15 2HB ASP 15 -16.323 -8.270 -17.514 104 HB3 ASP 15 1HB ASP 15 -15.695 -6.631 -17.435 105 H GLY 16 H GLY 16 -13.206 -6.353 -15.254 106 HA2 GLY 16 2HA GLY 16 -11.451 -5.022 -15.382 107 HA3 GLY 16 1HA GLY 16 -10.797 -6.078 -16.612 108 H SER 17 H SER 17 -13.408 -3.763 -16.241 109 HA SER 17 HA SER 17 -12.523 -2.470 -18.714 110 HB2 SER 17 2HB SER 17 -14.916 -1.918 -19.095 111 HB3 SER 17 1HB SER 17 -14.614 -3.658 -19.072 112 HG SER 17 HG SER 17 -16.282 -3.482 -17.792 113 H GLU 18 H GLU 18 -13.831 -0.103 -18.584 114 HA GLU 18 HA GLU 18 -12.589 1.127 -16.416 115 HB2 GLU 18 2HB GLU 18 -12.955 2.193 -18.631 116 HB3 GLU 18 1HB GLU 18 -14.681 2.234 -18.306 117 HG2 GLU 18 2HG GLU 18 -14.279 3.693 -16.397 118 HG3 GLU 18 1HG GLU 18 -12.551 3.585 -16.747 119 H LEU 19 H LEU 19 -15.810 -0.041 -17.083 120 HA LEU 19 HA LEU 19 -16.913 1.139 -14.692 121 HB2 LEU 19 2HB LEU 19 -18.121 -0.645 -16.738 122 HB3 LEU 19 1HB LEU 19 -18.975 -0.018 -15.335 123 HG LEU 19 HG LEU 19 -17.810 1.582 -17.596 124 HD11 LEU 19 1HD1 LEU 19 -20.544 1.106 -16.604 125 HD12 LEU 19 2HD1 LEU 19 -19.840 0.407 -18.078 126 HD13 LEU 19 3HD1 LEU 19 -20.133 2.167 -17.961 127 HD21 LEU 19 3HD2 LEU 19 -17.528 2.850 -15.531 128 HD22 LEU 19 1HD2 LEU 19 -19.211 2.527 -15.093 129 HD23 LEU 19 2HD2 LEU 19 -18.836 3.524 -16.491 130 H LYS 20 H LYS 20 -15.624 -1.943 -15.693 131 HA LYS 20 HA LYS 20 -16.106 -2.950 -12.924 132 HB2 LYS 20 2HB LYS 20 -15.845 -4.749 -15.326 133 HB3 LYS 20 1HB LYS 20 -16.353 -5.117 -13.699 134 HG2 LYS 20 2HG LYS 20 -18.439 -3.897 -13.975 135 HG3 LYS 20 1HG LYS 20 -17.995 -3.526 -15.643 136 HD2 LYS 20 2HD LYS 20 -17.910 -5.923 -16.149 137 HD3 LYS 20 1HD LYS 20 -18.365 -6.283 -14.486 138 HE2 LYS 20 2HE LYS 20 -20.462 -5.005 -14.844 139 HE3 LYS 20 1HE LYS 20 -20.002 -4.804 -16.531 140 HZ1 LYS 20 3HZ LYS 20 -19.996 -7.270 -16.730 141 HZ2 LYS 20 1HZ LYS 20 -21.513 -6.652 -16.298 142 HZ3 LYS 20 2HZ LYS 20 -20.542 -7.354 -15.139 143 HA PRO 21 HA PRO 21 -11.669 -2.840 -13.875 144 HB2 PRO 21 2HB PRO 21 -10.906 -1.438 -11.714 145 HB3 PRO 21 1HB PRO 21 -11.536 -0.636 -13.161 146 HG2 PRO 21 2HG PRO 21 -12.949 -1.310 -10.614 147 HG3 PRO 21 1HG PRO 21 -12.989 0.202 -11.549 148 HD2 PRO 21 2HD PRO 21 -14.914 -1.706 -11.668 149 HD3 PRO 21 1HD PRO 21 -14.510 -0.643 -13.024 150 H LEU 22 H LEU 22 -10.085 -4.179 -12.901 151 HA LEU 22 HA LEU 22 -11.104 -6.033 -10.995 152 HB2 LEU 22 2HB LEU 22 -8.289 -5.769 -11.989 153 HB3 LEU 22 1HB LEU 22 -9.007 -7.177 -11.246 154 HG LEU 22 HG LEU 22 -8.978 -7.781 -13.434 155 HD11 LEU 22 1HD1 LEU 22 -11.649 -6.603 -13.167 156 HD12 LEU 22 2HD1 LEU 22 -11.121 -8.225 -12.721 157 HD13 LEU 22 3HD1 LEU 22 -11.132 -7.735 -14.412 158 HD21 LEU 22 3HD2 LEU 22 -9.338 -6.391 -15.319 159 HD22 LEU 22 1HD2 LEU 22 -8.095 -5.733 -14.273 160 HD23 LEU 22 2HD2 LEU 22 -9.699 -5.006 -14.276 161 H ARG 23 H ARG 23 -9.624 -6.597 -9.132 162 HA ARG 23 HA ARG 23 -9.204 -4.084 -7.708 163 HB2 ARG 23 2HB ARG 23 -9.489 -5.381 -5.648 164 HB3 ARG 23 1HB ARG 23 -10.777 -5.649 -6.753 165 HG2 ARG 23 2HG ARG 23 -9.799 -7.775 -7.446 166 HG3 ARG 23 1HG ARG 23 -8.463 -7.506 -6.344 167 HD2 ARG 23 2HD ARG 23 -9.911 -7.602 -4.436 168 HD3 ARG 23 1HD ARG 23 -11.345 -7.670 -5.458 169 HE ARG 23 HE ARG 23 -9.654 -9.793 -6.153 170 HH11 ARG 23 1HH1 ARG 23 -11.697 -8.856 -3.377 171 HH12 ARG 23 2HH1 ARG 23 -12.035 -10.473 -2.976 172 HH21 ARG 23 1HH2 ARG 23 -10.152 -11.951 -5.545 173 HH22 ARG 23 2HH2 ARG 23 -11.168 -12.243 -4.200 174 H THR 24 H THR 24 -7.361 -6.238 -9.398 175 HA THR 24 HA THR 24 -5.008 -5.565 -7.857 176 HB THR 24 HB THR 24 -4.125 -7.876 -8.418 177 HG1 THR 24 1HG THR 24 -6.087 -9.389 -8.493 178 HG21 THR 24 3HG2 THR 24 -5.190 -8.961 -6.482 179 HG22 THR 24 1HG2 THR 24 -6.462 -7.739 -6.496 180 HG23 THR 24 2HG2 THR 24 -4.805 -7.278 -6.127 181 H LEU 25 H LEU 25 -3.196 -5.278 -9.076 182 HA LEU 25 HA LEU 25 -3.520 -4.747 -11.862 183 HB2 LEU 25 2HB LEU 25 -2.087 -3.411 -10.387 184 HB3 LEU 25 1HB LEU 25 -1.093 -4.808 -10.068 185 HG LEU 25 HG LEU 25 -0.262 -4.792 -12.350 186 HD11 LEU 25 1HD1 LEU 25 -2.274 -3.979 -13.485 187 HD12 LEU 25 2HD1 LEU 25 -0.878 -2.990 -13.898 188 HD13 LEU 25 3HD1 LEU 25 -2.066 -2.393 -12.749 189 HD21 LEU 25 3HD2 LEU 25 0.937 -2.642 -12.248 190 HD22 LEU 25 1HD2 LEU 25 0.867 -3.456 -10.686 191 HD23 LEU 25 2HD2 LEU 25 -0.211 -2.102 -11.021 192 H TYR 26 H TYR 26 -2.503 -7.338 -9.874 193 HA TYR 26 HA TYR 26 -1.090 -9.013 -11.547 194 HB2 TYR 26 2HB TYR 26 -1.488 -9.379 -9.147 195 HB3 TYR 26 1HB TYR 26 -3.181 -9.692 -9.475 196 HD1 TYR 26 1HD TYR 26 0.232 -10.942 -10.077 197 HD2 TYR 26 2HD TYR 26 -3.901 -11.895 -10.009 198 HE1 TYR 26 1HE TYR 26 0.783 -13.302 -10.261 199 HE2 TYR 26 2HE TYR 26 -3.358 -14.282 -10.199 200 HH TYR 26 HH TYR 26 -0.220 -15.462 -9.736 201 H GLN 27 H GLN 27 -4.677 -8.769 -11.152 202 HA GLN 27 HA GLN 27 -5.265 -10.773 -13.047 203 HB2 GLN 27 2HB GLN 27 -6.916 -10.078 -11.404 204 HB3 GLN 27 1HB GLN 27 -6.964 -8.465 -12.088 205 HG2 GLN 27 2HG GLN 27 -8.943 -9.748 -12.773 206 HG3 GLN 27 1HG GLN 27 -7.941 -9.340 -14.148 207 HE21 GLN 27 1HE2 GLN 27 -8.843 -10.942 -15.344 208 HE22 GLN 27 2HE2 GLN 27 -8.477 -12.601 -15.189 209 H ALA 28 H ALA 28 -4.804 -7.298 -13.372 210 HA ALA 28 HA ALA 28 -5.652 -6.943 -15.956 211 HB1 ALA 28 1HB ALA 28 -5.078 -5.159 -14.370 212 HB2 ALA 28 2HB ALA 28 -4.235 -4.945 -15.910 213 HB3 ALA 28 3HB ALA 28 -3.381 -5.591 -14.505 214 H MET 29 H MET 29 -2.515 -8.060 -14.713 215 HA MET 29 HA MET 29 -1.341 -8.245 -17.256 216 HB2 MET 29 2HB MET 29 -0.626 -9.299 -14.571 217 HB3 MET 29 1HB MET 29 0.259 -9.784 -16.000 218 HG2 MET 29 2HG MET 29 0.803 -7.369 -16.422 219 HG3 MET 29 1HG MET 29 -0.021 -6.963 -14.931 220 HE1 MET 29 3HE MET 29 3.772 -6.516 -14.394 221 HE2 MET 29 1HE MET 29 2.209 -5.708 -14.528 222 HE3 MET 29 2HE MET 29 2.957 -6.410 -15.955 223 H ILE 30 H ILE 30 -3.247 -10.448 -15.350 224 HA ILE 30 HA ILE 30 -2.633 -12.813 -16.822 225 HB ILE 30 HB ILE 30 -5.215 -12.141 -15.373 226 HG12 ILE 30 2HG1 ILE 30 -2.736 -13.550 -14.314 227 HG13 ILE 30 1HG1 ILE 30 -3.277 -11.936 -13.881 228 HG21 ILE 30 1HG2 ILE 30 -5.509 -14.574 -15.199 229 HG22 ILE 30 2HG2 ILE 30 -4.032 -14.810 -16.138 230 HG23 ILE 30 3HG2 ILE 30 -5.442 -14.052 -16.884 231 HD11 ILE 30 3HD1 ILE 30 -5.289 -12.879 -12.889 232 HD12 ILE 30 1HD1 ILE 30 -3.822 -13.551 -12.181 233 HD13 ILE 30 2HD1 ILE 30 -4.751 -14.492 -13.353 234 H ILE 31 H ILE 31 -5.140 -10.393 -17.110 235 HA ILE 31 HA ILE 31 -6.646 -11.583 -19.136 236 HB ILE 31 HB ILE 31 -6.372 -8.632 -18.523 237 HG12 ILE 31 2HG1 ILE 31 -8.318 -10.693 -17.487 238 HG13 ILE 31 1HG1 ILE 31 -7.011 -9.964 -16.560 239 HG21 ILE 31 1HG2 ILE 31 -7.420 -9.127 -20.684 240 HG22 ILE 31 2HG2 ILE 31 -8.593 -8.489 -19.499 241 HG23 ILE 31 3HG2 ILE 31 -8.520 -10.230 -19.834 242 HD11 ILE 31 3HD1 ILE 31 -8.069 -7.777 -16.851 243 HD12 ILE 31 1HD1 ILE 31 -9.125 -8.937 -16.021 244 HD13 ILE 31 2HD1 ILE 31 -9.379 -8.574 -17.732 245 H THR 32 H THR 32 -3.852 -9.451 -19.244 246 HA THR 32 HA THR 32 -4.107 -9.145 -22.141 247 HB THR 32 HB THR 32 -2.404 -7.358 -21.860 248 HG1 THR 32 1HG THR 32 -2.803 -7.423 -19.090 249 HG21 THR 32 3HG2 THR 32 -4.798 -7.070 -19.991 250 HG22 THR 32 1HG2 THR 32 -4.832 -6.843 -21.742 251 HG23 THR 32 2HG2 THR 32 -3.879 -5.775 -20.717 252 H LYS 33 H LYS 33 -1.770 -10.254 -19.659 253 HA LYS 33 HA LYS 33 0.111 -11.281 -19.618 254 HB2 LYS 33 2HB LYS 33 -1.241 -12.971 -20.941 255 HB3 LYS 33 1HB LYS 33 -0.493 -12.329 -22.396 256 HG2 LYS 33 2HG LYS 33 1.701 -12.837 -21.452 257 HG3 LYS 33 1HG LYS 33 0.904 -13.562 -20.063 258 HD2 LYS 33 2HD LYS 33 0.600 -14.494 -22.921 259 HD3 LYS 33 1HD LYS 33 1.619 -15.272 -21.709 260 HE2 LYS 33 2HE LYS 33 -0.383 -15.732 -20.346 261 HE3 LYS 33 1HE LYS 33 -1.383 -14.959 -21.572 262 HZ1 LYS 33 3HZ LYS 33 0.250 -17.416 -21.985 263 HZ2 LYS 33 1HZ LYS 33 -0.670 -16.635 -23.152 264 HZ3 LYS 33 2HZ LYS 33 -1.429 -17.342 -21.855 265 H SER 34 H SER 34 -0.240 -8.625 -21.010 266 HA SER 34 HA SER 34 1.991 -8.519 -22.856 267 HB2 SER 34 2HB SER 34 0.285 -6.286 -21.759 268 HB3 SER 34 1HB SER 34 1.344 -6.215 -23.165 269 HG SER 34 HG SER 34 -0.118 -8.133 -23.845 270 H SER 35 H SER 35 1.442 -8.053 -19.477 271 HA SER 35 HA SER 35 2.652 -7.402 -17.717 272 HB2 SER 35 2HB SER 35 5.026 -7.576 -19.597 273 HB3 SER 35 1HB SER 35 5.129 -7.469 -17.840 274 HG SER 35 HG SER 35 4.448 -9.612 -19.456 275 H LYS 36 H LYS 36 3.872 -5.629 -20.494 276 HA LYS 36 HA LYS 36 4.074 -3.171 -18.908 277 HB2 LYS 36 2HB LYS 36 5.605 -2.418 -20.719 278 HB3 LYS 36 1HB LYS 36 6.171 -3.844 -19.870 279 HG2 LYS 36 2HG LYS 36 5.371 -5.252 -21.724 280 HG3 LYS 36 1HG LYS 36 4.838 -3.799 -22.572 281 HD2 LYS 36 2HD LYS 36 7.128 -2.985 -22.654 282 HD3 LYS 36 1HD LYS 36 7.678 -4.390 -21.739 283 HE2 LYS 36 2HE LYS 36 6.933 -5.858 -23.548 284 HE3 LYS 36 1HE LYS 36 6.381 -4.458 -24.460 285 HZ1 LYS 36 3HZ LYS 36 8.649 -3.662 -24.554 286 HZ2 LYS 36 1HZ LYS 36 8.556 -5.231 -25.186 287 HZ3 LYS 36 2HZ LYS 36 9.186 -4.983 -23.649 288 H GLY 37 H GLY 37 1.688 -4.391 -20.312 289 HA2 GLY 37 2HA GLY 37 1.008 -2.688 -22.512 290 HA3 GLY 37 1HA GLY 37 -0.114 -3.708 -21.618 291 H ASP 38 H ASP 38 -1.392 -1.554 -22.113 292 HA ASP 38 HA ASP 38 -0.655 0.526 -20.230 293 HB2 ASP 38 2HB ASP 38 -1.426 1.139 -22.530 294 HB3 ASP 38 1HB ASP 38 -3.004 0.460 -22.138 295 H PHE 39 H PHE 39 -1.216 0.349 -18.267 296 HA PHE 39 HA PHE 39 -3.783 -0.869 -17.561 297 HB2 PHE 39 2HB PHE 39 -1.192 -1.025 -15.990 298 HB3 PHE 39 1HB PHE 39 -2.728 -1.747 -15.537 299 HD1 PHE 39 1HD PHE 39 -3.698 -3.398 -17.343 300 HD2 PHE 39 2HD PHE 39 0.399 -2.373 -17.000 301 HE1 PHE 39 1HE PHE 39 -3.079 -5.475 -18.506 302 HE2 PHE 39 2HE PHE 39 1.019 -4.429 -18.159 303 HZ PHE 39 HZ PHE 39 -0.715 -5.987 -18.917 304 H LEU 40 H LEU 40 -5.027 0.462 -16.431 305 HA LEU 40 HA LEU 40 -3.754 2.860 -15.298 306 HB2 LEU 40 2HB LEU 40 -6.529 2.686 -16.480 307 HB3 LEU 40 1HB LEU 40 -5.686 4.076 -15.810 308 HG LEU 40 HG LEU 40 -4.840 2.639 -18.315 309 HD11 LEU 40 1HD1 LEU 40 -6.316 5.233 -17.943 310 HD12 LEU 40 2HD1 LEU 40 -6.958 3.746 -18.644 311 HD13 LEU 40 3HD1 LEU 40 -5.673 4.627 -19.473 312 HD21 LEU 40 3HD2 LEU 40 -2.989 3.719 -17.169 313 HD22 LEU 40 1HD2 LEU 40 -3.905 5.226 -17.068 314 HD23 LEU 40 2HD2 LEU 40 -3.406 4.598 -18.640 315 H ILE 41 H ILE 41 -4.047 3.105 -13.206 316 HA ILE 41 HA ILE 41 -6.121 1.482 -11.919 317 HB ILE 41 HB ILE 41 -3.521 2.474 -10.728 318 HG12 ILE 41 2HG1 ILE 41 -4.277 -0.187 -11.981 319 HG13 ILE 41 1HG1 ILE 41 -2.985 0.895 -12.364 320 HG21 ILE 41 1HG2 ILE 41 -5.632 0.594 -9.665 321 HG22 ILE 41 2HG2 ILE 41 -5.282 2.214 -9.088 322 HG23 ILE 41 3HG2 ILE 41 -4.079 0.936 -8.872 323 HD11 ILE 41 3HD1 ILE 41 -1.792 0.305 -10.354 324 HD12 ILE 41 1HD1 ILE 41 -2.304 -1.157 -11.260 325 HD13 ILE 41 2HD1 ILE 41 -3.179 -0.677 -9.838 326 H ARG 42 H ARG 42 -7.638 2.504 -10.677 327 HA ARG 42 HA ARG 42 -7.926 5.245 -10.964 328 HB2 ARG 42 2HB ARG 42 -9.643 3.434 -10.724 329 HB3 ARG 42 1HB ARG 42 -9.345 3.559 -8.989 330 HG2 ARG 42 2HG ARG 42 -9.876 5.886 -9.026 331 HG3 ARG 42 1HG ARG 42 -10.114 5.828 -10.776 332 HD2 ARG 42 2HD ARG 42 -12.189 5.661 -10.003 333 HD3 ARG 42 1HD ARG 42 -11.649 4.007 -10.309 334 HE ARG 42 HE ARG 42 -11.073 4.238 -7.701 335 HH11 ARG 42 1HH1 ARG 42 -14.103 4.892 -9.423 336 HH12 ARG 42 2HH1 ARG 42 -15.100 4.633 -8.090 337 HH21 ARG 42 1HH2 ARG 42 -12.413 3.916 -5.844 338 HH22 ARG 42 2HH2 ARG 42 -14.117 4.039 -5.975 339 H THR 43 H THR 43 -7.467 6.816 -9.669 340 HA THR 43 HA THR 43 -6.632 6.311 -6.945 341 HB THR 43 HB THR 43 -4.633 6.609 -8.382 342 HG1 THR 43 1HG THR 43 -4.844 7.557 -6.156 343 HG21 THR 43 3HG2 THR 43 -5.766 9.333 -8.969 344 HG22 THR 43 1HG2 THR 43 -5.554 8.011 -10.115 345 HG23 THR 43 2HG2 THR 43 -4.142 8.791 -9.404 346 H LYS 44 H LYS 44 -7.062 8.251 -5.570 347 HA LYS 44 HA LYS 44 -9.143 9.923 -6.823 348 HB2 LYS 44 2HB LYS 44 -8.536 9.613 -3.870 349 HB3 LYS 44 1HB LYS 44 -9.912 10.439 -4.572 350 HG2 LYS 44 2HG LYS 44 -10.707 8.223 -5.402 351 HG3 LYS 44 1HG LYS 44 -9.388 7.473 -4.498 352 HD2 LYS 44 2HD LYS 44 -10.242 8.618 -2.449 353 HD3 LYS 44 1HD LYS 44 -11.637 9.147 -3.379 354 HE2 LYS 44 2HE LYS 44 -10.836 6.313 -2.729 355 HE3 LYS 44 1HE LYS 44 -12.217 7.204 -2.100 356 HZ1 LYS 44 3HZ LYS 44 -13.193 7.187 -4.328 357 HZ2 LYS 44 1HZ LYS 44 -12.811 5.642 -3.785 358 HZ3 LYS 44 2HZ LYS 44 -11.805 6.362 -4.903 359 H LYS 45 H LYS 45 -8.343 11.764 -7.475 360 HA LYS 45 HA LYS 45 -6.113 12.960 -5.995 361 HB2 LYS 45 2HB LYS 45 -5.380 11.683 -8.113 362 HB3 LYS 45 1HB LYS 45 -6.401 12.786 -8.975 363 HG2 LYS 45 2HG LYS 45 -5.023 14.624 -8.424 364 HG3 LYS 45 1HG LYS 45 -4.044 13.619 -7.347 365 HD2 LYS 45 2HD LYS 45 -4.498 12.994 -10.196 366 HD3 LYS 45 1HD LYS 45 -3.068 13.955 -9.697 367 HE2 LYS 45 2HE LYS 45 -2.436 11.945 -8.310 368 HE3 LYS 45 1HE LYS 45 -3.814 11.086 -8.982 369 HZ1 LYS 45 3HZ LYS 45 -1.823 10.505 -10.162 370 HZ2 LYS 45 1HZ LYS 45 -1.488 12.112 -10.514 371 HZ3 LYS 45 2HZ LYS 45 -2.834 11.371 -11.189 372 H ASP 46 H ASP 46 -6.598 14.951 -5.467 373 HA ASP 46 HA ASP 46 -7.596 16.958 -5.251 374 HB2 ASP 46 2HB ASP 46 -7.656 16.749 -8.264 375 HB3 ASP 46 1HB ASP 46 -8.186 18.192 -7.414 376 H GLY 47 H GLY 47 -9.248 14.637 -5.040 377 HA2 GLY 47 2HA GLY 47 -11.421 14.532 -4.256 378 HA3 GLY 47 1HA GLY 47 -11.768 16.059 -5.046 379 H LYS 48 H LYS 48 -10.266 14.005 -7.235 380 HA LYS 48 HA LYS 48 -12.861 12.963 -8.155 381 HB2 LYS 48 2HB LYS 48 -10.669 14.139 -9.878 382 HB3 LYS 48 1HB LYS 48 -12.133 13.379 -10.471 383 HG2 LYS 48 2HG LYS 48 -13.469 15.149 -9.430 384 HG3 LYS 48 1HG LYS 48 -11.986 15.902 -8.840 385 HD2 LYS 48 2HD LYS 48 -11.213 16.184 -11.150 386 HD3 LYS 48 1HD LYS 48 -12.694 15.433 -11.735 387 HE2 LYS 48 2HE LYS 48 -12.512 18.006 -10.159 388 HE3 LYS 48 1HE LYS 48 -12.796 17.874 -11.888 389 HZ1 LYS 48 3HZ LYS 48 -14.854 16.659 -11.384 390 HZ2 LYS 48 1HZ LYS 48 -14.869 18.218 -10.755 391 HZ3 LYS 48 2HZ LYS 48 -14.617 16.882 -9.749 392 H GLN 49 H GLN 49 -12.801 10.893 -9.037 393 HA GLN 49 HA GLN 49 -10.400 9.387 -8.528 394 HB2 GLN 49 2HB GLN 49 -13.078 8.563 -9.671 395 HB3 GLN 49 1HB GLN 49 -11.728 7.482 -9.401 396 HG2 GLN 49 2HG GLN 49 -13.364 7.189 -7.664 397 HG3 GLN 49 1HG GLN 49 -11.910 7.893 -6.982 398 HE21 GLN 49 1HE2 GLN 49 -15.188 8.427 -7.880 399 HE22 GLN 49 2HE2 GLN 49 -15.458 9.843 -6.937 400 H VAL 50 H VAL 50 -8.894 9.173 -10.011 401 HA VAL 50 HA VAL 50 -9.709 9.388 -12.807 402 HB VAL 50 HB VAL 50 -7.545 10.506 -13.327 403 HG11 VAL 50 1HG1 VAL 50 -8.117 12.734 -12.455 404 HG12 VAL 50 2HG1 VAL 50 -9.249 11.991 -11.329 405 HG13 VAL 50 3HG1 VAL 50 -9.536 11.883 -13.065 406 HG21 VAL 50 3HG2 VAL 50 -6.220 11.513 -11.513 407 HG22 VAL 50 1HG2 VAL 50 -6.254 9.749 -11.380 408 HG23 VAL 50 2HG2 VAL 50 -7.260 10.728 -10.328 409 H TRP 51 H TRP 51 -8.226 8.316 -14.270 410 HA TRP 51 HA TRP 51 -7.191 5.906 -13.061 411 HB2 TRP 51 2HB TRP 51 -7.666 6.732 -15.925 412 HB3 TRP 51 1HB TRP 51 -7.087 5.158 -15.497 413 HD1 TRP 51 HD TRP 51 -10.005 6.914 -16.304 414 HE1 TRP 51 1HE TRP 51 -12.173 5.590 -15.688 415 HE3 TRP 51 3HE TRP 51 -7.934 3.476 -13.248 416 HZ2 TRP 51 2HZ TRP 51 -12.843 3.348 -14.091 417 HZ3 TRP 51 3HZ TRP 51 -9.367 1.758 -12.217 418 HH2 TRP 51 HH TRP 51 -11.770 1.703 -12.630 419 H GLU 52 H GLU 52 -5.094 5.776 -12.641 420 HA GLU 52 HA GLU 52 -3.243 7.614 -14.001 421 HB2 GLU 52 2HB GLU 52 -3.525 8.023 -11.578 422 HB3 GLU 52 1HB GLU 52 -3.103 6.353 -11.250 423 HG2 GLU 52 2HG GLU 52 -0.874 6.771 -12.205 424 HG3 GLU 52 1HG GLU 52 -1.302 8.467 -12.414 425 H ALA 53 H ALA 53 -1.362 6.707 -14.791 426 HA ALA 53 HA ALA 53 -1.566 4.018 -15.624 427 HB1 ALA 53 1HB ALA 53 0.770 5.905 -15.816 428 HB2 ALA 53 2HB ALA 53 -0.525 5.740 -17.005 429 HB3 ALA 53 3HB ALA 53 0.575 4.393 -16.695 430 H ALA 54 H ALA 54 -0.586 2.259 -14.973 431 HA ALA 54 HA ALA 54 0.572 2.065 -12.383 432 HB1 ALA 54 1HB ALA 54 0.551 0.058 -14.640 433 HB2 ALA 54 2HB ALA 54 -0.688 0.217 -13.399 434 HB3 ALA 54 3HB ALA 54 0.945 -0.290 -12.959 435 H SER 55 H SER 55 2.769 1.210 -11.964 436 HA SER 55 HA SER 55 4.697 2.453 -13.775 437 HB2 SER 55 2HB SER 55 4.611 3.428 -11.510 438 HB3 SER 55 1HB SER 55 4.839 1.826 -10.815 439 HG SER 55 HG SER 55 6.651 3.516 -11.430 440 H LYS 56 H LYS 56 6.625 1.249 -14.162 441 HA LYS 56 HA LYS 56 6.179 -1.491 -14.512 442 HB2 LYS 56 2HB LYS 56 7.743 -0.159 -15.918 443 HB3 LYS 56 1HB LYS 56 8.838 -0.040 -14.548 444 HG2 LYS 56 2HG LYS 56 9.172 -2.436 -14.559 445 HG3 LYS 56 1HG LYS 56 7.993 -2.620 -15.853 446 HD2 LYS 56 2HD LYS 56 9.434 -1.290 -17.336 447 HD3 LYS 56 1HD LYS 56 10.612 -1.123 -16.036 448 HE2 LYS 56 2HE LYS 56 10.910 -3.549 -15.981 449 HE3 LYS 56 1HE LYS 56 9.705 -3.735 -17.251 450 HZ1 LYS 56 3HZ LYS 56 11.942 -3.846 -18.132 451 HZ2 LYS 56 1HZ LYS 56 12.300 -2.322 -17.509 452 HZ3 LYS 56 2HZ LYS 56 11.155 -2.496 -18.737 453 H THR 57 H THR 57 7.443 0.337 -11.874 454 HA THR 57 HA THR 57 8.758 -1.663 -10.439 455 HB THR 57 HB THR 57 7.144 0.667 -9.359 456 HG1 THR 57 1HG THR 57 9.887 0.532 -10.117 457 HG21 THR 57 3HG2 THR 57 9.527 -0.824 -8.238 458 HG22 THR 57 1HG2 THR 57 7.871 -0.950 -7.646 459 HG23 THR 57 2HG2 THR 57 8.751 0.572 -7.493 460 H ALA 58 H ALA 58 5.349 -0.517 -10.211 461 HA ALA 58 HA ALA 58 4.559 -2.561 -8.389 462 HB1 ALA 58 1HB ALA 58 2.855 -0.769 -10.128 463 HB2 ALA 58 2HB ALA 58 3.366 -0.442 -8.471 464 HB3 ALA 58 3HB ALA 58 2.276 -1.779 -8.799 465 H LEU 59 H LEU 59 4.407 -2.167 -11.896 466 HA LEU 59 HA LEU 59 2.863 -4.395 -12.471 467 HB2 LEU 59 2HB LEU 59 5.055 -3.005 -14.007 468 HB3 LEU 59 1HB LEU 59 4.057 -4.357 -14.659 469 HG LEU 59 HG LEU 59 2.962 -1.684 -13.770 470 HD11 LEU 59 1HD1 LEU 59 4.534 -1.358 -15.651 471 HD12 LEU 59 2HD1 LEU 59 2.864 -1.145 -16.163 472 HD13 LEU 59 3HD1 LEU 59 3.720 -2.638 -16.547 473 HD21 LEU 59 3HD2 LEU 59 1.059 -2.346 -15.010 474 HD22 LEU 59 1HD2 LEU 59 1.430 -3.641 -13.876 475 HD23 LEU 59 2HD2 LEU 59 1.865 -3.799 -15.595 476 H LYS 60 H LYS 60 6.392 -4.080 -12.031 477 HA LYS 60 HA LYS 60 6.976 -6.733 -12.669 478 HB2 LYS 60 2HB LYS 60 8.684 -4.960 -12.579 479 HB3 LYS 60 1HB LYS 60 8.515 -4.884 -10.829 480 HG2 LYS 60 2HG LYS 60 10.492 -6.118 -11.472 481 HG3 LYS 60 1HG LYS 60 9.329 -7.176 -10.667 482 HD2 LYS 60 2HD LYS 60 8.584 -8.031 -12.833 483 HD3 LYS 60 1HD LYS 60 9.706 -6.945 -13.659 484 HE2 LYS 60 2HE LYS 60 11.568 -8.058 -12.576 485 HE3 LYS 60 1HE LYS 60 10.445 -9.114 -11.724 486 HZ1 LYS 60 3HZ LYS 60 9.760 -10.060 -13.836 487 HZ2 LYS 60 1HZ LYS 60 11.418 -10.178 -13.674 488 HZ3 LYS 60 2HZ LYS 60 10.761 -8.998 -14.675 489 H LYS 61 H LYS 61 6.051 -5.241 -9.624 490 HA LYS 61 HA LYS 61 6.485 -7.532 -8.004 491 HB2 LYS 61 2HB LYS 61 4.548 -5.242 -7.573 492 HB3 LYS 61 1HB LYS 61 5.006 -6.424 -6.355 493 HG2 LYS 61 2HG LYS 61 7.345 -5.638 -6.533 494 HG3 LYS 61 1HG LYS 61 6.812 -4.413 -7.676 495 HD2 LYS 61 2HD LYS 61 5.354 -3.440 -5.973 496 HD3 LYS 61 1HD LYS 61 5.854 -4.683 -4.826 497 HE2 LYS 61 2HE LYS 61 8.188 -3.890 -5.039 498 HE3 LYS 61 1HE LYS 61 7.627 -2.606 -6.103 499 HZ1 LYS 61 3HZ LYS 61 7.907 -1.815 -3.859 500 HZ2 LYS 61 1HZ LYS 61 6.866 -2.993 -3.266 501 HZ3 LYS 61 2HZ LYS 61 6.257 -1.772 -4.234 502 H SER 62 H SER 62 3.749 -6.398 -9.858 503 HA SER 62 HA SER 62 1.844 -8.329 -9.040 504 HB2 SER 62 2HB SER 62 2.055 -6.790 -11.634 505 HB3 SER 62 1HB SER 62 0.604 -7.567 -10.985 506 HG SER 62 HG SER 62 1.953 -5.265 -10.107 507 H TRP 63 H TRP 63 4.178 -8.180 -11.762 508 HA TRP 63 HA TRP 63 3.322 -10.621 -12.874 509 HB2 TRP 63 2HB TRP 63 4.329 -8.812 -14.199 510 HB3 TRP 63 1HB TRP 63 5.852 -9.046 -13.347 511 HD1 TRP 63 HD TRP 63 7.404 -10.791 -14.219 512 HE1 TRP 63 1HE TRP 63 7.343 -12.536 -16.203 513 HE3 TRP 63 3HE TRP 63 2.501 -10.391 -15.470 514 HZ2 TRP 63 2HZ TRP 63 5.402 -13.561 -17.990 515 HZ3 TRP 63 3HZ TRP 63 1.585 -11.788 -17.292 516 HH2 TRP 63 HH TRP 63 3.020 -13.325 -18.528 517 H LYS 64 H LYS 64 5.706 -9.716 -10.504 518 HA LYS 64 HA LYS 64 7.270 -12.028 -10.472 519 HB2 LYS 64 2HB LYS 64 7.772 -10.006 -9.220 520 HB3 LYS 64 1HB LYS 64 6.412 -10.324 -8.150 521 HG2 LYS 64 2HG LYS 64 7.460 -12.405 -7.433 522 HG3 LYS 64 1HG LYS 64 8.830 -12.077 -8.491 523 HD2 LYS 64 2HD LYS 64 7.868 -10.311 -6.319 524 HD3 LYS 64 1HD LYS 64 9.194 -11.482 -6.129 525 HE2 LYS 64 2HE LYS 64 9.134 -9.081 -8.004 526 HE3 LYS 64 1HE LYS 64 10.065 -9.203 -6.517 527 HZ1 LYS 64 3HZ LYS 64 11.319 -11.017 -7.481 528 HZ2 LYS 64 1HZ LYS 64 11.442 -9.650 -8.422 529 HZ3 LYS 64 2HZ LYS 64 10.453 -10.913 -8.922 530 H ARG 65 H ARG 65 4.137 -11.332 -9.097 531 HA ARG 65 HA ARG 65 3.864 -13.744 -7.583 532 HB2 ARG 65 2HB ARG 65 2.605 -11.546 -7.253 533 HB3 ARG 65 1HB ARG 65 1.671 -11.973 -8.660 534 HG2 ARG 65 2HG ARG 65 0.905 -14.020 -7.501 535 HG3 ARG 65 1HG ARG 65 1.767 -13.480 -6.059 536 HD2 ARG 65 2HD ARG 65 -0.522 -12.095 -7.448 537 HD3 ARG 65 1HD ARG 65 -0.541 -12.855 -5.859 538 HE ARG 65 HE ARG 65 1.426 -10.846 -5.910 539 HH11 ARG 65 1HH1 ARG 65 -2.091 -11.181 -5.826 540 HH12 ARG 65 2HH1 ARG 65 -2.371 -9.658 -5.123 541 HH21 ARG 65 1HH2 ARG 65 1.062 -8.758 -4.998 542 HH22 ARG 65 2HH2 ARG 65 -0.508 -8.219 -4.623 543 H TYR 66 H TYR 66 3.261 -12.746 -10.848 544 HA TYR 66 HA TYR 66 1.602 -14.919 -11.748 545 HB2 TYR 66 2HB TYR 66 2.024 -12.582 -12.774 546 HB3 TYR 66 1HB TYR 66 3.534 -13.252 -13.356 547 HD1 TYR 66 1HD TYR 66 3.303 -15.412 -14.781 548 HD2 TYR 66 2HD TYR 66 0.145 -12.699 -14.043 549 HE1 TYR 66 1HE TYR 66 2.154 -16.249 -16.750 550 HE2 TYR 66 2HE TYR 66 -1.029 -13.483 -16.003 551 HH TYR 66 HH TYR 66 -0.099 -16.371 -17.619 552 H GLU 67 H GLU 67 5.046 -14.135 -11.826 553 HA GLU 67 HA GLU 67 6.185 -16.474 -12.998 554 HB2 GLU 67 2HB GLU 67 7.275 -14.638 -10.885 555 HB3 GLU 67 1HB GLU 67 8.209 -15.792 -11.829 556 HG2 GLU 67 2HG GLU 67 6.577 -13.671 -12.965 557 HG3 GLU 67 1HG GLU 67 8.263 -13.366 -12.521 558 H GLN 68 H GLN 68 5.738 -15.587 -9.651 559 HA GLN 68 HA GLN 68 7.009 -17.771 -8.577 560 HB2 GLN 68 2HB GLN 68 6.075 -17.170 -6.470 561 HB3 GLN 68 1HB GLN 68 6.268 -15.695 -7.372 562 HG2 GLN 68 2HG GLN 68 3.914 -15.669 -7.892 563 HG3 GLN 68 1HG GLN 68 3.716 -17.204 -7.077 564 HE21 GLN 68 1HE2 GLN 68 2.287 -16.475 -5.637 565 HE22 GLN 68 2HE2 GLN 68 2.681 -15.391 -4.342 566 H GLU 69 H GLU 69 3.569 -17.481 -9.415 567 HA GLU 69 HA GLU 69 2.832 -19.957 -8.285 568 HB2 GLU 69 2HB GLU 69 1.463 -18.354 -10.440 569 HB3 GLU 69 1HB GLU 69 0.751 -19.710 -9.582 570 HG2 GLU 69 2HG GLU 69 1.624 -17.100 -8.359 571 HG3 GLU 69 1HG GLU 69 -0.033 -17.584 -8.698 572 H MET 70 H MET 70 3.831 -19.029 -11.526 573 HA MET 70 HA MET 70 3.357 -21.641 -12.608 574 HB2 MET 70 2HB MET 70 5.060 -19.405 -13.668 575 HB3 MET 70 1HB MET 70 4.658 -20.866 -14.558 576 HG2 MET 70 2HG MET 70 2.289 -20.224 -14.476 577 HG3 MET 70 1HG MET 70 2.743 -18.746 -13.626 578 HE1 MET 70 3HE MET 70 4.985 -16.944 -16.304 579 HE2 MET 70 1HE MET 70 5.564 -18.191 -15.206 580 HE3 MET 70 2HE MET 70 4.441 -16.980 -14.616 581 H LEU 71 H LEU 71 6.096 -19.927 -11.243 582 HA LEU 71 HA LEU 71 8.094 -21.774 -11.895 583 HB2 LEU 71 2HB LEU 71 8.682 -19.598 -11.389 584 HB3 LEU 71 1HB LEU 71 7.868 -19.547 -9.861 585 HG LEU 71 HG LEU 71 9.572 -21.223 -9.050 586 HD11 LEU 71 1HD1 LEU 71 11.656 -21.433 -10.349 587 HD12 LEU 71 2HD1 LEU 71 10.891 -20.541 -11.669 588 HD13 LEU 71 3HD1 LEU 71 10.270 -22.120 -11.193 589 HD21 LEU 71 3HD2 LEU 71 9.768 -18.866 -8.512 590 HD22 LEU 71 1HD2 LEU 71 10.606 -18.571 -10.033 591 HD23 LEU 71 2HD2 LEU 71 11.363 -19.565 -8.791 592 H LYS 72 H LYS 72 5.840 -21.587 -9.210 593 HA LYS 72 HA LYS 72 6.981 -23.555 -7.579 594 HB2 LYS 72 2HB LYS 72 4.079 -22.777 -7.946 595 HB3 LYS 72 1HB LYS 72 4.642 -23.869 -6.679 596 HG2 LYS 72 2HG LYS 72 5.956 -22.140 -5.676 597 HG3 LYS 72 1HG LYS 72 5.647 -21.053 -7.028 598 HD2 LYS 72 2HD LYS 72 3.256 -21.041 -6.430 599 HD3 LYS 72 1HD LYS 72 3.619 -22.082 -5.046 600 HE2 LYS 72 2HE LYS 72 5.037 -20.382 -4.085 601 HE3 LYS 72 1HE LYS 72 4.833 -19.358 -5.504 602 HZ1 LYS 72 3HZ LYS 72 2.514 -19.052 -4.945 603 HZ2 LYS 72 1HZ LYS 72 3.473 -18.689 -3.609 604 HZ3 LYS 72 2HZ LYS 72 2.637 -20.136 -3.644 605 H ASN 73 H ASN 73 5.210 -23.802 -10.534 606 HA ASN 73 HA ASN 73 5.148 -26.697 -10.359 607 HB2 ASN 73 2HB ASN 73 3.240 -25.590 -11.482 608 HB3 ASN 73 1HB ASN 73 4.347 -24.848 -12.633 609 HD21 ASN 73 1HD2 ASN 73 3.324 -25.813 -14.372 610 HD22 ASN 73 2HD2 ASN 73 3.458 -27.498 -14.728 611 H GLU 74 H GLU 74 6.349 -24.403 -12.824 612 HA GLU 74 HA GLU 74 9.066 -25.029 -12.686 613 HB2 GLU 74 2HB GLU 74 9.476 -26.535 -14.520 614 HB3 GLU 74 1HB GLU 74 8.397 -27.311 -13.376 615 HG2 GLU 74 2HG GLU 74 6.516 -26.930 -14.816 616 HG3 GLU 74 1HG GLU 74 7.506 -25.968 -15.915 617 H LYS 75 H LYS 75 6.357 -23.723 -14.376 618 HA LYS 75 HA LYS 75 6.022 -22.379 -16.088 619 HB2 LYS 75 2HB LYS 75 8.991 -21.671 -15.877 620 HB3 LYS 75 1HB LYS 75 7.844 -20.837 -16.910 621 HG2 LYS 75 2HG LYS 75 6.607 -20.099 -14.940 622 HG3 LYS 75 1HG LYS 75 7.742 -20.955 -13.899 623 HD2 LYS 75 2HD LYS 75 8.247 -18.553 -13.983 624 HD3 LYS 75 1HD LYS 75 9.558 -19.495 -14.694 625 HE2 LYS 75 2HE LYS 75 8.772 -18.957 -16.931 626 HE3 LYS 75 1HE LYS 75 7.373 -18.115 -16.269 627 HZ1 LYS 75 3HZ LYS 75 8.811 -16.458 -15.343 628 HZ2 LYS 75 1HZ LYS 75 9.161 -16.637 -16.974 629 HZ3 LYS 75 2HZ LYS 75 10.196 -17.304 -15.803 630 H VAL 76 H VAL 76 9.201 -22.782 -17.368 631 HA VAL 76 HA VAL 76 8.688 -25.254 -18.708 632 HB VAL 76 HB VAL 76 9.262 -22.809 -20.402 633 HG11 VAL 76 1HG1 VAL 76 10.387 -24.766 -21.257 634 HG12 VAL 76 2HG1 VAL 76 9.070 -24.350 -22.356 635 HG13 VAL 76 3HG1 VAL 76 8.885 -25.688 -21.221 636 HG21 VAL 76 3HG2 VAL 76 6.867 -22.825 -19.864 637 HG22 VAL 76 1HG2 VAL 76 6.739 -24.483 -20.439 638 HG23 VAL 76 2HG2 VAL 76 7.102 -23.186 -21.574 639 H ALA 77 H ALA 77 10.348 -25.670 -17.349 640 HA ALA 77 HA ALA 77 12.985 -25.583 -18.422 641 HB1 ALA 77 1HB ALA 77 12.872 -23.223 -17.739 642 HB2 ALA 77 2HB ALA 77 14.141 -24.106 -16.892 643 HB3 ALA 77 3HB ALA 77 12.624 -23.731 -16.066 644 H ALA 78 H ALA 78 10.791 -26.981 -16.425 645 HA ALA 78 HA ALA 78 10.745 -28.475 -14.811 646 HB1 ALA 78 1HB ALA 78 12.537 -29.654 -16.053 647 HB2 ALA 78 2HB ALA 78 12.733 -29.865 -14.313 648 HB3 ALA 78 3HB ALA 78 13.744 -28.713 -15.184 649 H LYS 79 H LYS 79 13.790 -26.782 -14.137 650 HA LYS 79 HA LYS 79 12.558 -25.626 -11.755 651 HB2 LYS 79 2HB LYS 79 15.282 -26.982 -11.775 652 HB3 LYS 79 1HB LYS 79 14.662 -26.002 -10.463 653 HG2 LYS 79 2HG LYS 79 13.446 -28.589 -11.425 654 HG3 LYS 79 1HG LYS 79 14.484 -28.413 -10.010 655 HD2 LYS 79 2HD LYS 79 12.824 -26.927 -8.979 656 HD3 LYS 79 1HD LYS 79 11.805 -27.065 -10.415 657 HE2 LYS 79 2HE LYS 79 11.623 -29.484 -10.024 658 HE3 LYS 79 1HE LYS 79 12.604 -29.312 -8.575 659 HZ1 LYS 79 3HZ LYS 79 9.954 -28.031 -9.014 660 HZ2 LYS 79 1HZ LYS 79 10.898 -27.906 -7.614 661 HZ3 LYS 79 2HZ LYS 79 10.244 -29.391 -8.064 662 H MET 80 H MET 80 13.194 -23.560 -11.360 663 HA MET 80 HA MET 80 15.318 -22.498 -13.031 664 HB2 MET 80 2HB MET 80 13.158 -21.927 -14.072 665 HB3 MET 80 1HB MET 80 12.614 -21.208 -12.578 666 HG2 MET 80 2HG MET 80 13.183 -19.492 -14.220 667 HG3 MET 80 1HG MET 80 14.255 -19.404 -12.836 668 HE1 MET 80 3HE MET 80 16.689 -21.185 -13.133 669 HE2 MET 80 1HE MET 80 16.877 -19.438 -13.045 670 HE3 MET 80 2HE MET 80 17.733 -20.360 -14.281 671 H LEU 81 H LEU 81 15.816 -23.290 -10.617 672 HA LEU 81 HA LEU 81 15.946 -20.867 -8.961 673 HB2 LEU 81 2HB LEU 81 16.167 -23.769 -8.083 674 HB3 LEU 81 1HB LEU 81 16.390 -22.393 -7.035 675 HG LEU 81 HG LEU 81 14.280 -23.315 -6.548 676 HD11 LEU 81 1HD1 LEU 81 12.710 -21.525 -7.015 677 HD12 LEU 81 2HD1 LEU 81 13.834 -20.867 -8.205 678 HD13 LEU 81 3HD1 LEU 81 14.293 -20.935 -6.500 679 HD21 LEU 81 3HD2 LEU 81 12.472 -23.623 -8.221 680 HD22 LEU 81 1HD2 LEU 81 13.878 -24.644 -8.541 681 HD23 LEU 81 2HD2 LEU 81 13.617 -23.185 -9.489 682 H GLU 82 H GLU 82 17.772 -19.965 -9.575 683 HA GLU 82 HA GLU 82 19.976 -21.016 -10.785 684 HB2 GLU 82 2HB GLU 82 20.160 -18.772 -8.746 685 HB3 GLU 82 1HB GLU 82 21.268 -19.090 -10.055 686 HG2 GLU 82 2HG GLU 82 19.981 -17.220 -10.697 687 HG3 GLU 82 1HG GLU 82 19.368 -18.579 -11.635 688 H LYS 83 H LYS 83 19.935 -20.227 -7.334 689 HA LYS 83 HA LYS 83 21.288 -22.730 -6.735 690 HB2 LYS 83 2HB LYS 83 23.093 -21.052 -7.259 691 HB3 LYS 83 1HB LYS 83 22.484 -20.040 -5.968 692 HG2 LYS 83 2HG LYS 83 24.494 -21.256 -5.283 693 HG3 LYS 83 1HG LYS 83 23.098 -21.753 -4.330 694 HD2 LYS 83 2HD LYS 83 22.852 -23.752 -5.679 695 HD3 LYS 83 1HD LYS 83 24.182 -23.247 -6.716 696 HE2 LYS 83 2HE LYS 83 24.383 -23.868 -3.766 697 HE3 LYS 83 1HE LYS 83 24.864 -24.949 -5.069 698 HZ1 LYS 83 3HZ LYS 83 26.523 -23.292 -5.748 699 HZ2 LYS 83 1HZ LYS 83 26.759 -23.807 -4.161 700 HZ3 LYS 83 2HZ LYS 83 26.093 -22.308 -4.439 701 H ASP 84 H ASP 84 18.795 -20.932 -6.255 702 HA ASP 84 HA ASP 84 17.209 -20.585 -4.706 703 HB2 ASP 84 2HB ASP 84 18.738 -22.690 -3.155 704 HB3 ASP 84 1HB ASP 84 17.247 -21.978 -2.579 705 H ALA 85 H ALA 85 19.651 -21.246 -2.348 706 HA ALA 85 HA ALA 85 20.408 -18.641 -1.682 707 HB1 ALA 85 1HB ALA 85 18.282 -19.949 0.044 708 HB2 ALA 85 2HB ALA 85 18.102 -18.442 -0.852 709 HB3 ALA 85 3HB ALA 85 19.221 -18.532 0.508 710 H THR 86 H THR 86 21.487 -18.880 0.583 711 HA THR 86 HA THR 86 22.190 -21.646 1.022 712 HB THR 86 HB THR 86 24.127 -20.731 -0.078 713 HG1 THR 86 1HG THR 86 25.681 -21.097 1.433 714 HG21 THR 86 3HG2 THR 86 24.127 -18.518 1.986 715 HG22 THR 86 1HG2 THR 86 23.755 -18.338 0.272 716 HG23 THR 86 2HG2 THR 86 25.386 -18.781 0.778 717 H GLU 87 H GLU 87 20.839 -21.948 2.641 718 HA GLU 87 HA GLU 87 21.426 -20.727 5.180 719 HB2 GLU 87 2HB GLU 87 19.933 -19.098 4.120 720 HB3 GLU 87 1HB GLU 87 18.784 -20.369 3.772 721 HG2 GLU 87 2HG GLU 87 18.500 -20.692 6.212 722 HG3 GLU 87 1HG GLU 87 19.548 -19.299 6.468 723 H VAL 88 H VAL 88 21.274 -22.396 6.557 724 HA VAL 88 HA VAL 88 19.372 -24.494 5.893 725 HB VAL 88 HB VAL 88 21.651 -25.342 5.678 726 HG11 VAL 88 1HG1 VAL 88 22.069 -24.510 8.540 727 HG12 VAL 88 2HG1 VAL 88 22.870 -23.860 7.107 728 HG13 VAL 88 3HG1 VAL 88 23.169 -25.523 7.607 729 HG21 VAL 88 3HG2 VAL 88 20.241 -26.430 8.117 730 HG22 VAL 88 1HG2 VAL 88 21.521 -27.266 7.236 731 HG23 VAL 88 2HG2 VAL 88 19.990 -26.914 6.442 732 H GLY 89 H GLY 89 17.857 -24.942 7.276 733 HA2 GLY 89 2HA GLY 89 17.527 -23.236 9.552 734 HA3 GLY 89 1HA GLY 89 16.376 -24.414 8.936 735 H VAL 90 H VAL 90 19.637 -24.595 10.227 736 HA VAL 90 HA VAL 90 18.562 -26.374 12.258 737 HB VAL 90 HB VAL 90 19.964 -27.722 10.762 738 HG11 VAL 90 1HG1 VAL 90 22.375 -27.354 10.517 739 HG12 VAL 90 2HG1 VAL 90 22.222 -25.843 11.414 740 HG13 VAL 90 3HG1 VAL 90 21.428 -26.022 9.853 741 HG21 VAL 90 3HG2 VAL 90 19.963 -28.347 13.104 742 HG22 VAL 90 1HG2 VAL 90 21.304 -27.248 13.422 743 HG23 VAL 90 2HG2 VAL 90 21.550 -28.663 12.401 744 H LYS 91 H LYS 91 18.330 -25.153 13.925 745 HA LYS 91 HA LYS 91 20.678 -23.705 14.849 746 HB2 LYS 91 2HB LYS 91 17.798 -22.841 15.037 747 HB3 LYS 91 1HB LYS 91 19.049 -22.167 16.067 748 HG2 LYS 91 2HG LYS 91 19.047 -22.058 13.051 749 HG3 LYS 91 1HG LYS 91 18.548 -20.742 14.120 750 HD2 LYS 91 2HD LYS 91 20.818 -20.727 15.115 751 HD3 LYS 91 1HD LYS 91 21.300 -21.999 14.000 752 HE2 LYS 91 2HE LYS 91 20.869 -20.521 12.111 753 HE3 LYS 91 1HE LYS 91 20.342 -19.252 13.211 754 HZ1 LYS 91 3HZ LYS 91 23.086 -20.411 13.110 755 HZ2 LYS 91 1HZ LYS 91 22.573 -19.204 14.160 756 HZ3 LYS 91 2HZ LYS 91 22.639 -18.910 12.517 757 H ALA 92 H ALA 92 21.488 -25.117 16.125 758 HA ALA 92 HA ALA 92 19.889 -25.838 18.457 759 HB1 ALA 92 1HB ALA 92 22.035 -27.493 17.108 760 HB2 ALA 92 2HB ALA 92 20.303 -27.824 17.078 761 HB3 ALA 92 3HB ALA 92 21.193 -27.924 18.598 762 H ALA 93 H ALA 93 20.595 -24.327 19.821 763 HA ALA 93 HA ALA 93 23.466 -23.777 19.980 764 HB1 ALA 93 1HB ALA 93 21.985 -21.837 19.768 765 HB2 ALA 93 2HB ALA 93 22.833 -21.821 21.315 766 HB3 ALA 93 3HB ALA 93 21.142 -22.316 21.242 767 H LEU 94 H LEU 94 20.745 -25.035 21.766 768 HA LEU 94 HA LEU 94 20.498 -26.112 23.705 769 HB2 LEU 94 2HB LEU 94 23.409 -26.750 23.247 770 HB3 LEU 94 1HB LEU 94 22.502 -27.408 24.588 771 HG LEU 94 HG LEU 94 21.005 -28.519 22.899 772 HD11 LEU 94 1HD1 LEU 94 23.118 -27.667 20.941 773 HD12 LEU 94 2HD1 LEU 94 21.441 -27.124 20.971 774 HD13 LEU 94 3HD1 LEU 94 21.815 -28.813 20.626 775 HD21 LEU 94 3HD2 LEU 94 23.926 -29.232 22.828 776 HD22 LEU 94 1HD2 LEU 94 22.594 -30.297 22.389 777 HD23 LEU 94 2HD2 LEU 94 22.761 -29.727 24.051 778 H GLU 95 H GLU 95 21.215 -23.273 23.750 779 HA GLU 95 HA GLU 95 22.850 -22.826 26.041 780 HB2 GLU 95 2HB GLU 95 22.445 -21.061 24.327 781 HB3 GLU 95 1HB GLU 95 20.747 -21.026 24.791 782 HG2 GLU 95 2HG GLU 95 21.978 -19.159 25.761 783 HG3 GLU 95 1HG GLU 95 21.346 -20.236 27.006 784 H GLU 96 H GLU 96 22.269 -23.676 27.884 785 HA GLU 96 HA GLU 96 19.427 -23.840 28.505 786 HB2 GLU 96 2HB GLU 96 20.016 -25.936 29.686 787 HB3 GLU 96 1HB GLU 96 20.246 -25.990 27.940 788 HG2 GLU 96 2HG GLU 96 22.647 -25.591 28.275 789 HG3 GLU 96 1HG GLU 96 22.392 -25.634 30.016 790 H ALA 97 H ALA 97 18.802 -23.597 30.566 791 HA ALA 97 HA ALA 97 20.781 -22.588 32.446 792 HB1 ALA 97 1HB ALA 97 18.957 -21.179 33.358 793 HB2 ALA 97 2HB ALA 97 17.911 -21.748 32.059 794 HB3 ALA 97 3HB ALA 97 19.333 -20.784 31.680 795 H LYS 98 H LYS 98 19.630 -22.767 34.718 796 HA LYS 98 HA LYS 98 18.795 -24.017 36.392 797 HB2 LYS 98 2HB LYS 98 16.659 -23.944 35.106 798 HB3 LYS 98 1HB LYS 98 17.140 -25.385 34.232 799 HG2 LYS 98 2HG LYS 98 17.033 -26.676 36.312 800 HG3 LYS 98 1HG LYS 98 16.578 -25.221 37.196 801 HD2 LYS 98 2HD LYS 98 14.548 -25.034 35.848 802 HD3 LYS 98 1HD LYS 98 15.013 -26.477 34.945 803 HE2 LYS 98 2HE LYS 98 14.892 -27.809 36.983 804 HE3 LYS 98 1HE LYS 98 14.484 -26.370 37.914 805 HZ1 LYS 98 3HZ LYS 98 12.818 -27.521 35.722 806 HZ2 LYS 98 1HZ LYS 98 12.431 -26.181 36.666 807 HZ3 LYS 98 2HZ LYS 98 12.524 -27.700 37.364 808 H LYS 99 H LYS 99 21.005 -24.907 34.471 809 HA LYS 99 HA LYS 99 21.522 -27.373 35.910 810 HB2 LYS 99 2HB LYS 99 20.564 -28.082 33.716 811 HB3 LYS 99 1HB LYS 99 21.880 -27.224 32.915 812 HG2 LYS 99 2HG LYS 99 23.508 -28.620 34.054 813 HG3 LYS 99 1HG LYS 99 22.209 -29.442 34.899 814 HD2 LYS 99 2HD LYS 99 21.357 -30.266 32.759 815 HD3 LYS 99 1HD LYS 99 22.708 -29.467 31.935 816 HE2 LYS 99 2HE LYS 99 24.276 -30.760 33.257 817 HE3 LYS 99 1HE LYS 99 22.937 -31.535 34.086 818 HZ1 LYS 99 3HZ LYS 99 23.819 -32.956 32.326 819 HZ2 LYS 99 1HZ LYS 99 23.548 -31.739 31.197 820 HZ3 LYS 99 2HZ LYS 99 22.236 -32.487 31.939 821 H VAL 100 H VAL 100 22.988 -26.418 37.083 822 HA VAL 100 HA VAL 100 25.542 -26.221 35.988 823 HB VAL 100 HB VAL 100 24.816 -23.952 35.344 824 HG11 VAL 100 1HG1 VAL 100 23.051 -23.549 36.925 825 HG12 VAL 100 2HG1 VAL 100 24.232 -22.238 37.005 826 HG13 VAL 100 3HG1 VAL 100 24.209 -23.486 38.252 827 HG21 VAL 100 3HG2 VAL 100 27.144 -24.209 35.956 828 HG22 VAL 100 1HG2 VAL 100 26.762 -23.917 37.652 829 HG23 VAL 100 2HG2 VAL 100 26.570 -22.624 36.470 830 H GLN 101 H GLN 101 26.826 -27.022 37.506 831 HA GLN 101 HA GLN 101 25.612 -27.238 40.101 832 HB2 GLN 101 2HB GLN 101 27.947 -28.749 38.960 833 HB3 GLN 101 1HB GLN 101 27.294 -28.997 40.578 834 HG2 GLN 101 2HG GLN 101 25.121 -29.583 39.593 835 HG3 GLN 101 1HG GLN 101 25.814 -29.378 37.988 836 HE21 GLN 101 1HE2 GLN 101 25.331 -31.493 37.464 837 HE22 GLN 101 2HE2 GLN 101 26.236 -32.820 38.076 838 H ILE 102 H ILE 102 25.872 -25.253 40.777 839 HA ILE 102 HA ILE 102 28.501 -24.722 41.879 840 HB ILE 102 HB ILE 102 28.307 -23.176 40.020 841 HG12 ILE 102 2HG1 ILE 102 28.409 -20.963 41.171 842 HG13 ILE 102 1HG1 ILE 102 27.802 -21.736 42.630 843 HG21 ILE 102 1HG2 ILE 102 26.514 -21.522 39.787 844 HG22 ILE 102 2HG2 ILE 102 25.661 -22.289 41.127 845 HG23 ILE 102 3HG2 ILE 102 25.941 -23.185 39.637 846 HD11 ILE 102 3HD1 ILE 102 30.398 -22.370 41.239 847 HD12 ILE 102 1HD1 ILE 102 29.790 -23.147 42.699 848 HD13 ILE 102 2HD1 ILE 102 30.207 -21.435 42.721 849 H GLU 103 H GLU 103 28.072 -25.338 43.853 850 HA GLU 103 HA GLU 103 25.637 -24.371 45.170 851 HB2 GLU 103 2HB GLU 103 26.112 -26.794 45.158 852 HB3 GLU 103 1HB GLU 103 27.626 -26.483 45.986 853 HG2 GLU 103 2HG GLU 103 26.400 -25.621 47.895 854 HG3 GLU 103 1HG GLU 103 24.877 -25.957 47.070 855 H LEU 104 H LEU 104 29.069 -24.215 45.128 856 HA LEU 104 HA LEU 104 30.645 -23.167 46.226 857 HB2 LEU 104 2HB LEU 104 29.393 -21.141 45.557 858 HB3 LEU 104 1HB LEU 104 28.465 -21.236 47.037 859 HG LEU 104 HG LEU 104 30.513 -20.812 48.341 860 HD11 LEU 104 1HD1 LEU 104 31.810 -20.454 45.645 861 HD12 LEU 104 2HD1 LEU 104 32.169 -21.719 46.821 862 HD13 LEU 104 3HD1 LEU 104 32.537 -20.039 47.197 863 HD21 LEU 104 3HD2 LEU 104 30.748 -18.450 47.726 864 HD22 LEU 104 1HD2 LEU 104 29.060 -18.953 47.718 865 HD23 LEU 104 2HD2 LEU 104 29.931 -18.771 46.197 866 H ASP 105 H ASP 105 30.702 -25.082 47.465 867 HA ASP 105 HA ASP 105 29.730 -24.841 50.206 868 HB2 ASP 105 2HB ASP 105 30.431 -27.201 50.465 869 HB3 ASP 105 1HB ASP 105 29.311 -26.995 49.126 870 H THR 106 H THR 106 32.466 -24.292 48.369 871 HA THR 106 HA THR 106 34.370 -24.662 50.490 872 HB THR 106 HB THR 106 35.897 -23.597 48.871 873 HG1 THR 106 1HG THR 106 34.465 -22.398 47.659 874 HG21 THR 106 3HG2 THR 106 34.338 -25.991 47.872 875 HG22 THR 106 1HG2 THR 106 35.731 -26.025 48.949 876 HG23 THR 106 2HG2 THR 106 35.927 -25.513 47.272 877 H SER 107 H SER 107 34.763 -23.208 51.992 878 HA SER 107 HA SER 107 33.489 -20.661 51.985 879 HB2 SER 107 2HB SER 107 33.973 -21.988 54.058 880 HB3 SER 107 1HB SER 107 35.688 -21.693 53.806 881 HG SER 107 HG SER 107 35.334 -19.982 54.948 882 H LEU 108 H LEU 108 36.603 -21.931 51.184 883 HA LEU 108 HA LEU 108 37.302 -19.446 49.929 884 HB2 LEU 108 2HB LEU 108 39.665 -19.633 50.878 885 HB3 LEU 108 1HB LEU 108 38.417 -19.097 51.972 886 HG LEU 108 HG LEU 108 38.362 -21.348 52.967 887 HD11 LEU 108 1HD1 LEU 108 39.235 -22.699 51.153 888 HD12 LEU 108 2HD1 LEU 108 40.228 -22.905 52.598 889 HD13 LEU 108 3HD1 LEU 108 40.797 -21.890 51.273 890 HD21 LEU 108 3HD2 LEU 108 39.611 -19.578 54.005 891 HD22 LEU 108 1HD2 LEU 108 41.021 -19.947 53.010 892 HD23 LEU 108 2HD2 LEU 108 40.457 -21.112 54.208 893 H SER 109 H SER 109 39.765 -20.106 48.892 894 HA SER 109 HA SER 109 38.960 -22.110 47.030 895 HB2 SER 109 2HB SER 109 40.242 -20.091 46.295 896 HB3 SER 109 1HB SER 109 41.610 -20.634 47.254 897 HG SER 109 HG SER 109 40.561 -22.423 45.370 898 H TYR 110 H TYR 110 38.803 -23.965 48.077 899 HA TYR 110 HA TYR 110 40.920 -25.024 49.722 900 HB2 TYR 110 2HB TYR 110 38.549 -25.435 50.284 901 HB3 TYR 110 1HB TYR 110 38.311 -26.225 48.735 902 HD1 TYR 110 1HD TYR 110 39.732 -26.547 52.106 903 HD2 TYR 110 2HD TYR 110 39.100 -28.489 48.380 904 HE1 TYR 110 1HE TYR 110 40.284 -28.706 53.144 905 HE2 TYR 110 2HE TYR 110 39.649 -30.648 49.397 906 HH TYR 110 HH TYR 110 39.817 -31.105 52.733 907 H ILE 111 H ILE 111 42.673 -25.631 48.648 908 HA ILE 111 HA ILE 111 44.066 -26.677 47.259 909 HB ILE 111 HB ILE 111 41.645 -28.196 46.203 910 HG12 ILE 111 2HG1 ILE 111 42.008 -28.654 48.582 911 HG13 ILE 111 1HG1 ILE 111 42.441 -30.060 47.622 912 HG21 ILE 111 1HG2 ILE 111 43.268 -29.802 45.306 913 HG22 ILE 111 2HG2 ILE 111 44.589 -28.767 45.852 914 HG23 ILE 111 3HG2 ILE 111 43.483 -28.197 44.606 915 HD11 ILE 111 3HD1 ILE 111 44.802 -29.495 47.860 916 HD12 ILE 111 1HD1 ILE 111 44.013 -29.684 49.424 917 HD13 ILE 111 2HD1 ILE 111 44.369 -28.070 48.809 Start of MODEL 14 1 H1 GLY -1 1HT GLY -1 -0.306 -8.577 -26.577 2 H2 GLY -1 2HT GLY -1 -1.096 -7.951 -27.933 3 H3 GLY -1 3HT GLY -1 -1.981 -8.681 -26.708 4 HA2 GLY -1 1HA GLY -1 -1.373 -6.940 -25.167 5 HA3 GLY -1 2HA GLY -1 -0.436 -6.180 -26.450 6 H SER 0 H SER 0 -1.609 -4.282 -26.600 7 HA SER 0 HA SER 0 -3.158 -2.864 -27.411 8 HB2 SER 0 2HB SER 0 -4.332 -5.339 -28.706 9 HB3 SER 0 1HB SER 0 -4.711 -3.671 -29.142 10 HG SER 0 HG SER 0 -2.662 -3.389 -29.869 11 H MET 1 H MET 1 -3.607 -4.579 -24.950 12 HA MET 1 HA MET 1 -6.511 -4.244 -24.685 13 HB2 MET 1 2HB MET 1 -5.706 -6.553 -24.493 14 HB3 MET 1 1HB MET 1 -4.624 -6.071 -23.199 15 HG2 MET 1 2HG MET 1 -6.537 -5.495 -21.803 16 HG3 MET 1 1HG MET 1 -7.628 -5.954 -23.111 17 HE1 MET 1 3HE MET 1 -6.140 -8.573 -24.282 18 HE2 MET 1 1HE MET 1 -7.879 -8.435 -24.034 19 HE3 MET 1 2HE MET 1 -6.994 -9.816 -23.380 20 H THR 2 H THR 2 -7.214 -2.820 -23.193 21 HA THR 2 HA THR 2 -5.237 -1.664 -21.377 22 HB THR 2 HB THR 2 -7.810 -0.492 -22.463 23 HG1 THR 2 1HG THR 2 -6.430 -0.527 -24.101 24 HG21 THR 2 3HG2 THR 2 -7.171 0.405 -20.266 25 HG22 THR 2 1HG2 THR 2 -6.965 1.625 -21.526 26 HG23 THR 2 2HG2 THR 2 -5.558 0.773 -20.883 27 H VAL 3 H VAL 3 -5.540 -2.245 -19.320 28 HA VAL 3 HA VAL 3 -8.199 -3.248 -18.517 29 HB VAL 3 HB VAL 3 -5.568 -3.853 -17.167 30 HG11 VAL 3 1HG1 VAL 3 -7.433 -4.154 -15.726 31 HG12 VAL 3 2HG1 VAL 3 -6.737 -5.716 -16.264 32 HG13 VAL 3 3HG1 VAL 3 -8.235 -5.142 -16.974 33 HG21 VAL 3 3HG2 VAL 3 -7.014 -5.589 -19.155 34 HG22 VAL 3 1HG2 VAL 3 -5.682 -6.058 -18.093 35 HG23 VAL 3 2HG2 VAL 3 -5.407 -4.844 -19.354 36 H TYR 4 H TYR 4 -9.200 -2.315 -16.790 37 HA TYR 4 HA TYR 4 -7.828 -0.110 -15.461 38 HB2 TYR 4 2HB TYR 4 -10.762 -0.745 -15.775 39 HB3 TYR 4 1HB TYR 4 -10.132 0.630 -14.868 40 HD1 TYR 4 2HD TYR 4 -10.364 -0.852 -18.259 41 HD2 TYR 4 1HD TYR 4 -9.447 2.597 -15.965 42 HE1 TYR 4 2HE TYR 4 -10.278 0.470 -20.307 43 HE2 TYR 4 1HE TYR 4 -9.355 3.940 -17.999 44 HH TYR 4 HH TYR 4 -8.963 3.621 -20.386 45 H ILE 5 H ILE 5 -7.516 -0.086 -13.327 46 HA ILE 5 HA ILE 5 -8.390 -2.437 -11.730 47 HB ILE 5 HB ILE 5 -5.927 -0.755 -11.207 48 HG12 ILE 5 2HG1 ILE 5 -4.519 -2.541 -11.770 49 HG13 ILE 5 1HG1 ILE 5 -5.769 -3.626 -12.257 50 HG21 ILE 5 1HG2 ILE 5 -6.846 -1.742 -9.236 51 HG22 ILE 5 2HG2 ILE 5 -5.300 -2.502 -9.616 52 HG23 ILE 5 3HG2 ILE 5 -6.815 -3.335 -9.976 53 HD11 ILE 5 3HD1 ILE 5 -4.768 -1.127 -13.662 54 HD12 ILE 5 1HD1 ILE 5 -6.224 -1.985 -14.162 55 HD13 ILE 5 2HD1 ILE 5 -4.663 -2.794 -14.226 56 H CYS 6 H CYS 6 -9.859 -1.756 -10.267 57 HA CYS 6 HA CYS 6 -9.169 0.633 -8.760 58 HB2 CYS 6 2HB CYS 6 -11.191 1.161 -10.110 59 HB3 CYS 6 1HB CYS 6 -11.999 -0.233 -9.411 60 HG CYS 6 HG CYS 6 -13.211 1.577 -7.921 61 HA PRO 7 HA PRO 7 -9.040 -2.986 -5.979 62 HB2 PRO 7 2HB PRO 7 -7.533 -1.055 -4.319 63 HB3 PRO 7 1HB PRO 7 -7.085 -2.684 -4.827 64 HG2 PRO 7 2HG PRO 7 -5.893 -0.571 -5.915 65 HG3 PRO 7 1HG PRO 7 -6.326 -1.975 -6.906 66 HD2 PRO 7 2HD PRO 7 -7.747 0.659 -6.655 67 HD3 PRO 7 1HD PRO 7 -7.367 -0.297 -8.112 68 H GLU 8 H GLU 8 -10.379 0.060 -5.709 69 HA GLU 8 HA GLU 8 -11.309 -0.112 -2.976 70 HB2 GLU 8 2HB GLU 8 -12.152 1.786 -5.158 71 HB3 GLU 8 1HB GLU 8 -12.444 1.959 -3.437 72 HG2 GLU 8 2HG GLU 8 -9.818 1.945 -4.807 73 HG3 GLU 8 1HG GLU 8 -10.664 3.395 -4.237 74 H THR 9 H THR 9 -13.051 0.416 -6.021 75 HA THR 9 HA THR 9 -15.388 -0.831 -4.848 76 HB THR 9 HB THR 9 -16.553 0.331 -6.743 77 HG1 THR 9 1HG THR 9 -15.399 1.297 -8.181 78 HG21 THR 9 3HG2 THR 9 -14.891 2.065 -4.895 79 HG22 THR 9 1HG2 THR 9 -16.438 1.321 -4.482 80 HG23 THR 9 2HG2 THR 9 -16.359 2.570 -5.727 81 H GLY 10 H GLY 10 -12.953 -1.522 -7.155 82 HA2 GLY 10 2HA GLY 10 -14.811 -3.196 -8.647 83 HA3 GLY 10 1HA GLY 10 -13.215 -2.884 -9.241 84 H ASP 11 H ASP 11 -13.231 -5.237 -9.512 85 HA ASP 11 HA ASP 11 -12.366 -6.650 -7.152 86 HB2 ASP 11 2HB ASP 11 -14.828 -6.919 -7.147 87 HB3 ASP 11 1HB ASP 11 -14.724 -7.621 -8.762 88 H ASP 12 H ASP 12 -11.151 -8.483 -7.675 89 HA ASP 12 HA ASP 12 -9.825 -8.334 -10.200 90 HB2 ASP 12 2HB ASP 12 -8.449 -10.169 -9.388 91 HB3 ASP 12 1HB ASP 12 -8.613 -8.917 -8.162 92 H GLY 13 H GLY 13 -12.647 -10.032 -9.278 93 HA2 GLY 13 2HA GLY 13 -12.166 -12.183 -11.195 94 HA3 GLY 13 1HA GLY 13 -13.546 -12.018 -10.120 95 H ASN 14 H ASN 14 -12.711 -9.197 -11.740 96 HA ASN 14 HA ASN 14 -15.102 -9.421 -13.391 97 HB2 ASN 14 2HB ASN 14 -13.376 -7.034 -12.742 98 HB3 ASN 14 1HB ASN 14 -14.797 -7.005 -13.773 99 HD21 ASN 14 1HD2 ASN 14 -14.296 -5.552 -11.346 100 HD22 ASN 14 2HD2 ASN 14 -15.554 -6.035 -10.243 101 H ASP 15 H ASP 15 -14.794 -7.936 -15.452 102 HA ASP 15 HA ASP 15 -13.012 -9.352 -17.179 103 HB2 ASP 15 2HB ASP 15 -15.220 -8.673 -17.962 104 HB3 ASP 15 1HB ASP 15 -14.817 -6.981 -17.693 105 H GLY 16 H GLY 16 -12.884 -6.401 -15.423 106 HA2 GLY 16 2HA GLY 16 -11.089 -5.079 -15.037 107 HA3 GLY 16 1HA GLY 16 -10.201 -5.954 -16.283 108 H SER 17 H SER 17 -13.237 -4.622 -17.098 109 HA SER 17 HA SER 17 -11.915 -2.615 -18.722 110 HB2 SER 17 2HB SER 17 -14.804 -3.432 -18.506 111 HB3 SER 17 1HB SER 17 -14.206 -2.223 -19.635 112 HG SER 17 HG SER 17 -13.745 -5.029 -19.644 113 H GLU 18 H GLU 18 -13.449 -0.379 -18.743 114 HA GLU 18 HA GLU 18 -12.674 0.814 -16.384 115 HB2 GLU 18 2HB GLU 18 -12.944 1.994 -18.561 116 HB3 GLU 18 1HB GLU 18 -14.682 1.822 -18.396 117 HG2 GLU 18 2HG GLU 18 -14.636 3.190 -16.381 118 HG3 GLU 18 1HG GLU 18 -12.885 3.328 -16.596 119 H LEU 19 H LEU 19 -15.812 -0.488 -17.388 120 HA LEU 19 HA LEU 19 -17.186 0.563 -15.084 121 HB2 LEU 19 2HB LEU 19 -18.104 -1.367 -17.155 122 HB3 LEU 19 1HB LEU 19 -19.091 -0.698 -15.879 123 HG LEU 19 HG LEU 19 -17.834 0.813 -18.153 124 HD11 LEU 19 1HD1 LEU 19 -20.595 0.230 -17.309 125 HD12 LEU 19 2HD1 LEU 19 -19.760 -0.526 -18.677 126 HD13 LEU 19 3HD1 LEU 19 -20.169 1.210 -18.730 127 HD21 LEU 19 3HD2 LEU 19 -17.790 2.193 -16.125 128 HD22 LEU 19 1HD2 LEU 19 -19.490 1.833 -15.838 129 HD23 LEU 19 2HD2 LEU 19 -19.017 2.771 -17.251 130 H LYS 20 H LYS 20 -15.297 -2.172 -15.681 131 HA LYS 20 HA LYS 20 -16.110 -3.371 -13.102 132 HB2 LYS 20 2HB LYS 20 -15.429 -5.099 -15.491 133 HB3 LYS 20 1HB LYS 20 -15.957 -5.547 -13.897 134 HG2 LYS 20 2HG LYS 20 -18.163 -4.709 -14.245 135 HG3 LYS 20 1HG LYS 20 -17.733 -4.155 -15.871 136 HD2 LYS 20 2HD LYS 20 -17.256 -6.468 -16.515 137 HD3 LYS 20 1HD LYS 20 -17.663 -6.999 -14.883 138 HE2 LYS 20 2HE LYS 20 -19.531 -5.657 -16.834 139 HE3 LYS 20 1HE LYS 20 -19.512 -7.370 -16.435 140 HZ1 LYS 20 3HZ LYS 20 -21.225 -6.215 -15.231 141 HZ2 LYS 20 1HZ LYS 20 -20.127 -5.162 -14.529 142 HZ3 LYS 20 2HZ LYS 20 -20.093 -6.809 -14.145 143 HA PRO 21 HA PRO 21 -11.714 -2.723 -13.686 144 HB2 PRO 21 2HB PRO 21 -11.275 -1.395 -11.366 145 HB3 PRO 21 1HB PRO 21 -11.774 -0.594 -12.856 146 HG2 PRO 21 2HG PRO 21 -13.397 -1.280 -10.454 147 HG3 PRO 21 1HG PRO 21 -13.531 0.105 -11.544 148 HD2 PRO 21 2HD PRO 21 -15.141 -2.141 -11.598 149 HD3 PRO 21 1HD PRO 21 -14.920 -1.005 -12.937 150 H LEU 22 H LEU 22 -10.069 -3.790 -12.722 151 HA LEU 22 HA LEU 22 -10.805 -6.051 -11.074 152 HB2 LEU 22 2HB LEU 22 -8.138 -5.146 -12.118 153 HB3 LEU 22 1HB LEU 22 -8.477 -6.700 -11.381 154 HG LEU 22 HG LEU 22 -9.654 -5.696 -13.955 155 HD11 LEU 22 1HD1 LEU 22 -8.295 -7.412 -14.986 156 HD12 LEU 22 2HD1 LEU 22 -7.544 -7.741 -13.421 157 HD13 LEU 22 3HD1 LEU 22 -7.337 -6.170 -14.190 158 HD21 LEU 22 3HD2 LEU 22 -9.916 -8.349 -12.562 159 HD22 LEU 22 1HD2 LEU 22 -10.495 -7.990 -14.191 160 HD23 LEU 22 2HD2 LEU 22 -11.191 -7.160 -12.801 161 H ARG 23 H ARG 23 -9.543 -6.533 -9.089 162 HA ARG 23 HA ARG 23 -9.153 -3.975 -7.754 163 HB2 ARG 23 2HB ARG 23 -9.878 -4.895 -5.724 164 HB3 ARG 23 1HB ARG 23 -10.882 -5.606 -6.925 165 HG2 ARG 23 2HG ARG 23 -9.561 -7.683 -6.822 166 HG3 ARG 23 1HG ARG 23 -8.569 -6.959 -5.548 167 HD2 ARG 23 2HD ARG 23 -10.784 -6.556 -4.313 168 HD3 ARG 23 1HD ARG 23 -11.482 -7.684 -5.473 169 HE ARG 23 HE ARG 23 -9.166 -8.484 -3.901 170 HH11 ARG 23 1HH1 ARG 23 -12.618 -9.109 -4.723 171 HH12 ARG 23 2HH1 ARG 23 -12.750 -10.378 -3.617 172 HH21 ARG 23 1HH2 ARG 23 -9.458 -10.263 -2.371 173 HH22 ARG 23 2HH2 ARG 23 -10.960 -11.064 -2.283 174 H THR 24 H THR 24 -7.412 -6.282 -9.174 175 HA THR 24 HA THR 24 -5.032 -5.567 -7.662 176 HB THR 24 HB THR 24 -4.167 -7.911 -8.059 177 HG1 THR 24 1HG THR 24 -5.923 -9.496 -8.267 178 HG21 THR 24 3HG2 THR 24 -5.341 -8.927 -6.141 179 HG22 THR 24 1HG2 THR 24 -6.594 -7.691 -6.266 180 HG23 THR 24 2HG2 THR 24 -4.942 -7.240 -5.828 181 H LEU 25 H LEU 25 -3.191 -5.359 -8.924 182 HA LEU 25 HA LEU 25 -3.594 -4.937 -11.734 183 HB2 LEU 25 2HB LEU 25 -2.155 -3.489 -10.336 184 HB3 LEU 25 1HB LEU 25 -1.105 -4.855 -10.037 185 HG LEU 25 HG LEU 25 -0.395 -4.866 -12.365 186 HD11 LEU 25 1HD1 LEU 25 -2.476 -4.093 -13.408 187 HD12 LEU 25 2HD1 LEU 25 -1.109 -3.101 -13.904 188 HD13 LEU 25 3HD1 LEU 25 -2.244 -2.497 -12.699 189 HD21 LEU 25 3HD2 LEU 25 0.761 -2.688 -12.365 190 HD22 LEU 25 1HD2 LEU 25 0.796 -3.473 -10.779 191 HD23 LEU 25 2HD2 LEU 25 -0.329 -2.154 -11.090 192 H TYR 26 H TYR 26 -2.503 -7.412 -9.684 193 HA TYR 26 HA TYR 26 -1.045 -9.143 -11.241 194 HB2 TYR 26 2HB TYR 26 -1.460 -9.449 -8.861 195 HB3 TYR 26 1HB TYR 26 -3.174 -9.648 -9.148 196 HD1 TYR 26 1HD TYR 26 0.152 -11.260 -9.433 197 HD2 TYR 26 2HD TYR 26 -4.063 -11.787 -9.798 198 HE1 TYR 26 1HE TYR 26 0.480 -13.584 -9.532 199 HE2 TYR 26 2HE TYR 26 -3.738 -14.217 -9.865 200 HH TYR 26 HH TYR 26 -1.984 -15.817 -10.452 201 H GLN 27 H GLN 27 -4.647 -8.968 -10.939 202 HA GLN 27 HA GLN 27 -5.120 -11.013 -12.837 203 HB2 GLN 27 2HB GLN 27 -6.840 -10.444 -11.234 204 HB3 GLN 27 1HB GLN 27 -6.956 -8.811 -11.847 205 HG2 GLN 27 2HG GLN 27 -8.870 -10.122 -12.604 206 HG3 GLN 27 1HG GLN 27 -7.903 -9.687 -13.976 207 HE21 GLN 27 1HE2 GLN 27 -8.744 -11.339 -15.181 208 HE22 GLN 27 2HE2 GLN 27 -8.338 -12.994 -14.984 209 H ALA 28 H ALA 28 -4.788 -7.507 -13.180 210 HA ALA 28 HA ALA 28 -5.606 -7.218 -15.782 211 HB1 ALA 28 1HB ALA 28 -5.143 -5.364 -14.203 212 HB2 ALA 28 2HB ALA 28 -4.311 -5.124 -15.723 213 HB3 ALA 28 3HB ALA 28 -3.426 -5.715 -14.314 214 H MET 29 H MET 29 -2.412 -8.109 -14.475 215 HA MET 29 HA MET 29 -1.309 -8.346 -17.032 216 HB2 MET 29 2HB MET 29 -0.386 -9.060 -14.320 217 HB3 MET 29 1HB MET 29 0.457 -9.707 -15.712 218 HG2 MET 29 2HG MET 29 0.778 -7.342 -16.524 219 HG3 MET 29 1HG MET 29 0.078 -6.783 -15.020 220 HE1 MET 29 3HE MET 29 3.869 -6.088 -14.955 221 HE2 MET 29 1HE MET 29 2.253 -5.365 -14.997 222 HE3 MET 29 2HE MET 29 2.886 -6.211 -16.410 223 H ILE 30 H ILE 30 -2.992 -10.614 -14.995 224 HA ILE 30 HA ILE 30 -2.235 -12.976 -16.355 225 HB ILE 30 HB ILE 30 -4.948 -12.388 -15.129 226 HG12 ILE 30 2HG1 ILE 30 -2.517 -13.689 -13.861 227 HG13 ILE 30 1HG1 ILE 30 -3.161 -12.095 -13.480 228 HG21 ILE 30 1HG2 ILE 30 -5.165 -14.829 -14.931 229 HG22 ILE 30 2HG2 ILE 30 -3.620 -15.019 -15.762 230 HG23 ILE 30 3HG2 ILE 30 -4.997 -14.321 -16.611 231 HD11 ILE 30 3HD1 ILE 30 -5.212 -13.141 -12.680 232 HD12 ILE 30 1HD1 ILE 30 -3.780 -13.728 -11.832 233 HD13 ILE 30 2HD1 ILE 30 -4.540 -14.721 -13.076 234 H ILE 31 H ILE 31 -4.892 -10.752 -16.878 235 HA ILE 31 HA ILE 31 -6.058 -12.141 -18.992 236 HB ILE 31 HB ILE 31 -6.237 -9.171 -18.445 237 HG12 ILE 31 2HG1 ILE 31 -7.931 -11.464 -17.443 238 HG13 ILE 31 1HG1 ILE 31 -6.809 -10.517 -16.474 239 HG21 ILE 31 1HG2 ILE 31 -7.048 -9.915 -20.644 240 HG22 ILE 31 2HG2 ILE 31 -8.374 -9.379 -19.588 241 HG23 ILE 31 3HG2 ILE 31 -8.068 -11.108 -19.813 242 HD11 ILE 31 3HD1 ILE 31 -8.143 -8.531 -16.874 243 HD12 ILE 31 1HD1 ILE 31 -9.100 -9.820 -16.120 244 HD13 ILE 31 2HD1 ILE 31 -9.249 -9.494 -17.856 245 H THR 32 H THR 32 -3.507 -9.632 -18.913 246 HA THR 32 HA THR 32 -3.661 -9.283 -21.737 247 HB THR 32 HB THR 32 -1.808 -7.647 -21.302 248 HG1 THR 32 1HG THR 32 -2.344 -7.752 -18.599 249 HG21 THR 32 3HG2 THR 32 -4.252 -7.284 -19.520 250 HG22 THR 32 1HG2 THR 32 -4.217 -6.957 -21.253 251 HG23 THR 32 2HG2 THR 32 -3.230 -6.015 -20.141 252 H LYS 33 H LYS 33 -1.309 -10.599 -19.340 253 HA LYS 33 HA LYS 33 0.528 -11.838 -19.513 254 HB2 LYS 33 2HB LYS 33 -0.922 -12.797 -21.966 255 HB3 LYS 33 1HB LYS 33 0.603 -13.502 -21.445 256 HG2 LYS 33 2HG LYS 33 -0.358 -14.211 -19.364 257 HG3 LYS 33 1HG LYS 33 -1.853 -13.351 -19.710 258 HD2 LYS 33 2HD LYS 33 -0.791 -15.557 -21.442 259 HD3 LYS 33 1HD LYS 33 -1.880 -15.863 -20.084 260 HE2 LYS 33 2HE LYS 33 -2.486 -14.044 -22.427 261 HE3 LYS 33 1HE LYS 33 -3.066 -15.698 -22.255 262 HZ1 LYS 33 3HZ LYS 33 -4.279 -15.114 -20.344 263 HZ2 LYS 33 1HZ LYS 33 -4.715 -14.004 -21.513 264 HZ3 LYS 33 2HZ LYS 33 -3.664 -13.583 -20.237 265 H SER 34 H SER 34 0.278 -9.217 -20.960 266 HA SER 34 HA SER 34 2.371 -9.436 -22.987 267 HB2 SER 34 2HB SER 34 0.811 -7.014 -22.059 268 HB3 SER 34 1HB SER 34 1.842 -7.101 -23.484 269 HG SER 34 HG SER 34 0.437 -8.866 -24.157 270 H SER 35 H SER 35 2.271 -8.969 -19.678 271 HA SER 35 HA SER 35 3.798 -8.465 -18.065 272 HB2 SER 35 2HB SER 35 5.786 -7.999 -20.299 273 HB3 SER 35 1HB SER 35 6.156 -8.227 -18.591 274 HG SER 35 HG SER 35 5.134 -10.054 -20.449 275 H LYS 36 H LYS 36 2.952 -6.228 -20.484 276 HA LYS 36 HA LYS 36 3.255 -4.005 -18.795 277 HB2 LYS 36 2HB LYS 36 4.517 -4.173 -21.559 278 HB3 LYS 36 1HB LYS 36 4.296 -2.695 -20.645 279 HG2 LYS 36 2HG LYS 36 5.846 -3.522 -18.946 280 HG3 LYS 36 1HG LYS 36 6.071 -5.004 -19.882 281 HD2 LYS 36 2HD LYS 36 6.939 -3.702 -21.738 282 HD3 LYS 36 1HD LYS 36 6.692 -2.212 -20.826 283 HE2 LYS 36 2HE LYS 36 8.254 -3.026 -19.118 284 HE3 LYS 36 1HE LYS 36 8.518 -4.489 -20.065 285 HZ1 LYS 36 3HZ LYS 36 9.143 -1.719 -20.905 286 HZ2 LYS 36 1HZ LYS 36 9.364 -3.085 -21.862 287 HZ3 LYS 36 2HZ LYS 36 10.265 -2.890 -20.450 288 H GLY 37 H GLY 37 2.443 -2.244 -20.571 289 HA2 GLY 37 2HA GLY 37 0.830 -2.292 -22.520 290 HA3 GLY 37 1HA GLY 37 -0.108 -3.362 -21.470 291 H ASP 38 H ASP 38 -1.497 -1.264 -22.083 292 HA ASP 38 HA ASP 38 -0.901 0.832 -20.182 293 HB2 ASP 38 2HB ASP 38 -1.778 1.366 -22.474 294 HB3 ASP 38 1HB ASP 38 -3.285 0.576 -22.022 295 H PHE 39 H PHE 39 -1.435 0.538 -18.190 296 HA PHE 39 HA PHE 39 -3.923 -0.855 -17.539 297 HB2 PHE 39 2HB PHE 39 -1.315 -0.829 -15.993 298 HB3 PHE 39 1HB PHE 39 -2.814 -1.554 -15.436 299 HD1 PHE 39 1HD PHE 39 -3.767 -3.429 -16.804 300 HD2 PHE 39 2HD PHE 39 0.208 -2.066 -17.277 301 HE1 PHE 39 1HE PHE 39 -3.167 -5.562 -17.887 302 HE2 PHE 39 2HE PHE 39 0.819 -4.174 -18.353 303 HZ PHE 39 HZ PHE 39 -0.862 -5.932 -18.659 304 H LEU 40 H LEU 40 -5.260 0.350 -16.417 305 HA LEU 40 HA LEU 40 -4.132 2.834 -15.317 306 HB2 LEU 40 2HB LEU 40 -6.927 2.646 -16.495 307 HB3 LEU 40 1HB LEU 40 -6.100 3.998 -15.778 308 HG LEU 40 HG LEU 40 -5.221 2.702 -18.344 309 HD11 LEU 40 1HD1 LEU 40 -6.728 5.263 -17.860 310 HD12 LEU 40 2HD1 LEU 40 -7.340 3.806 -18.651 311 HD13 LEU 40 3HD1 LEU 40 -6.055 4.743 -19.404 312 HD21 LEU 40 3HD2 LEU 40 -3.385 3.723 -17.153 313 HD22 LEU 40 1HD2 LEU 40 -4.312 5.216 -16.946 314 HD23 LEU 40 2HD2 LEU 40 -3.820 4.692 -18.559 315 H ILE 41 H ILE 41 -4.382 3.127 -13.306 316 HA ILE 41 HA ILE 41 -6.347 1.467 -11.937 317 HB ILE 41 HB ILE 41 -3.756 2.588 -10.829 318 HG12 ILE 41 2HG1 ILE 41 -4.457 -0.105 -12.037 319 HG13 ILE 41 1HG1 ILE 41 -3.152 0.972 -12.399 320 HG21 ILE 41 1HG2 ILE 41 -5.759 0.654 -9.663 321 HG22 ILE 41 2HG2 ILE 41 -5.491 2.313 -9.150 322 HG23 ILE 41 3HG2 ILE 41 -4.219 1.106 -8.903 323 HD11 ILE 41 3HD1 ILE 41 -2.029 0.409 -10.313 324 HD12 ILE 41 1HD1 ILE 41 -2.412 -1.017 -11.298 325 HD13 ILE 41 2HD1 ILE 41 -3.411 -0.662 -9.916 326 H ARG 42 H ARG 42 -7.825 2.395 -10.688 327 HA ARG 42 HA ARG 42 -8.346 5.147 -10.930 328 HB2 ARG 42 2HB ARG 42 -10.062 3.326 -10.525 329 HB3 ARG 42 1HB ARG 42 -9.498 3.267 -8.855 330 HG2 ARG 42 2HG ARG 42 -11.352 4.699 -8.774 331 HG3 ARG 42 1HG ARG 42 -9.959 5.771 -8.810 332 HD2 ARG 42 2HD ARG 42 -11.084 6.790 -10.512 333 HD3 ARG 42 1HD ARG 42 -10.393 5.489 -11.436 334 HE ARG 42 HE ARG 42 -12.695 4.402 -10.510 335 HH11 ARG 42 1HH1 ARG 42 -11.909 7.246 -12.506 336 HH12 ARG 42 2HH1 ARG 42 -13.332 7.137 -13.414 337 HH21 ARG 42 1HH2 ARG 42 -14.659 4.308 -11.803 338 HH22 ARG 42 2HH2 ARG 42 -14.901 5.466 -13.023 339 H THR 43 H THR 43 -7.591 6.729 -9.757 340 HA THR 43 HA THR 43 -6.578 6.189 -7.092 341 HB THR 43 HB THR 43 -4.688 6.294 -8.665 342 HG1 THR 43 1HG THR 43 -4.285 7.102 -6.599 343 HG21 THR 43 3HG2 THR 43 -5.647 9.080 -9.263 344 HG22 THR 43 1HG2 THR 43 -5.615 7.712 -10.374 345 HG23 THR 43 2HG2 THR 43 -4.104 8.408 -9.784 346 H LYS 44 H LYS 44 -6.665 8.078 -5.730 347 HA LYS 44 HA LYS 44 -8.804 9.864 -6.574 348 HB2 LYS 44 2HB LYS 44 -7.976 8.923 -3.844 349 HB3 LYS 44 1HB LYS 44 -9.204 10.148 -4.139 350 HG2 LYS 44 2HG LYS 44 -10.571 8.560 -5.335 351 HG3 LYS 44 1HG LYS 44 -9.319 7.331 -5.195 352 HD2 LYS 44 2HD LYS 44 -11.056 6.955 -3.583 353 HD3 LYS 44 1HD LYS 44 -9.530 7.403 -2.793 354 HE2 LYS 44 2HE LYS 44 -10.378 9.711 -2.535 355 HE3 LYS 44 1HE LYS 44 -11.900 9.215 -3.273 356 HZ1 LYS 44 3HZ LYS 44 -12.270 7.712 -1.433 357 HZ2 LYS 44 1HZ LYS 44 -11.996 9.277 -0.834 358 HZ3 LYS 44 2HZ LYS 44 -10.782 8.117 -0.763 359 H LYS 45 H LYS 45 -8.110 11.840 -7.011 360 HA LYS 45 HA LYS 45 -5.740 12.871 -5.610 361 HB2 LYS 45 2HB LYS 45 -6.364 13.130 -8.536 362 HB3 LYS 45 1HB LYS 45 -4.973 13.866 -7.826 363 HG2 LYS 45 2HG LYS 45 -4.289 11.467 -7.176 364 HG3 LYS 45 1HG LYS 45 -5.544 10.982 -8.317 365 HD2 LYS 45 2HD LYS 45 -3.542 11.054 -9.604 366 HD3 LYS 45 1HD LYS 45 -4.463 12.534 -9.935 367 HE2 LYS 45 2HE LYS 45 -2.071 12.993 -9.647 368 HE3 LYS 45 1HE LYS 45 -3.063 13.829 -8.458 369 HZ1 LYS 45 3HZ LYS 45 -2.484 12.087 -6.840 370 HZ2 LYS 45 1HZ LYS 45 -1.103 12.841 -7.434 371 HZ3 LYS 45 2HZ LYS 45 -1.532 11.315 -7.998 372 H ASP 46 H ASP 46 -6.513 14.450 -4.407 373 HA ASP 46 HA ASP 46 -7.429 16.429 -3.732 374 HB2 ASP 46 2HB ASP 46 -5.905 17.253 -5.544 375 HB3 ASP 46 1HB ASP 46 -7.234 17.147 -6.686 376 H GLY 47 H GLY 47 -9.248 14.333 -4.310 377 HA2 GLY 47 2HA GLY 47 -11.571 14.243 -3.972 378 HA3 GLY 47 1HA GLY 47 -11.682 15.919 -4.473 379 H LYS 48 H LYS 48 -9.878 13.951 -6.556 380 HA LYS 48 HA LYS 48 -12.202 13.537 -8.325 381 HB2 LYS 48 2HB LYS 48 -9.352 14.202 -9.059 382 HB3 LYS 48 1HB LYS 48 -10.584 13.707 -10.199 383 HG2 LYS 48 2HG LYS 48 -11.864 15.706 -9.733 384 HG3 LYS 48 1HG LYS 48 -10.699 16.180 -8.496 385 HD2 LYS 48 2HD LYS 48 -10.331 17.376 -10.619 386 HD3 LYS 48 1HD LYS 48 -8.952 16.386 -10.163 387 HE2 LYS 48 2HE LYS 48 -9.401 16.196 -12.554 388 HE3 LYS 48 1HE LYS 48 -9.662 14.653 -11.762 389 HZ1 LYS 48 3HZ LYS 48 -12.072 15.096 -11.834 390 HZ2 LYS 48 1HZ LYS 48 -11.373 15.149 -13.359 391 HZ3 LYS 48 2HZ LYS 48 -11.775 16.575 -12.605 392 H GLN 49 H GLN 49 -12.484 11.471 -9.011 393 HA GLN 49 HA GLN 49 -10.412 9.534 -8.367 394 HB2 GLN 49 2HB GLN 49 -13.158 9.092 -9.600 395 HB3 GLN 49 1HB GLN 49 -12.060 7.833 -9.097 396 HG2 GLN 49 2HG GLN 49 -13.781 7.937 -7.495 397 HG3 GLN 49 1HG GLN 49 -12.363 8.650 -6.737 398 HE21 GLN 49 1HE2 GLN 49 -12.428 10.839 -6.198 399 HE22 GLN 49 2HE2 GLN 49 -13.880 11.754 -6.270 400 H VAL 50 H VAL 50 -8.963 9.050 -9.928 401 HA VAL 50 HA VAL 50 -9.812 9.498 -12.696 402 HB VAL 50 HB VAL 50 -7.656 10.545 -13.280 403 HG11 VAL 50 1HG1 VAL 50 -7.970 12.729 -12.219 404 HG12 VAL 50 2HG1 VAL 50 -9.069 11.993 -11.060 405 HG13 VAL 50 3HG1 VAL 50 -9.499 12.034 -12.771 406 HG21 VAL 50 3HG2 VAL 50 -6.122 11.348 -11.542 407 HG22 VAL 50 1HG2 VAL 50 -6.250 9.589 -11.534 408 HG23 VAL 50 2HG2 VAL 50 -7.099 10.541 -10.318 409 H TRP 51 H TRP 51 -8.404 8.446 -14.253 410 HA TRP 51 HA TRP 51 -7.385 5.941 -13.208 411 HB2 TRP 51 2HB TRP 51 -7.969 6.884 -16.015 412 HB3 TRP 51 1HB TRP 51 -7.315 5.330 -15.694 413 HD1 TRP 51 HD TRP 51 -10.343 6.920 -16.374 414 HE1 TRP 51 1HE TRP 51 -12.400 5.447 -15.727 415 HE3 TRP 51 3HE TRP 51 -7.982 3.592 -13.370 416 HZ2 TRP 51 2HZ TRP 51 -12.886 3.192 -14.128 417 HZ3 TRP 51 3HZ TRP 51 -9.289 1.798 -12.317 418 HH2 TRP 51 HH TRP 51 -11.688 1.599 -12.681 419 H GLU 52 H GLU 52 -5.301 5.807 -12.806 420 HA GLU 52 HA GLU 52 -3.457 7.525 -14.311 421 HB2 GLU 52 2HB GLU 52 -3.552 8.087 -11.937 422 HB3 GLU 52 1HB GLU 52 -3.226 6.418 -11.506 423 HG2 GLU 52 2HG GLU 52 -1.014 6.587 -12.506 424 HG3 GLU 52 1HG GLU 52 -1.343 8.253 -12.973 425 H ALA 53 H ALA 53 -1.659 6.558 -15.178 426 HA ALA 53 HA ALA 53 -1.883 3.803 -15.807 427 HB1 ALA 53 1HB ALA 53 0.440 5.677 -16.242 428 HB2 ALA 53 2HB ALA 53 -0.902 5.438 -17.357 429 HB3 ALA 53 3HB ALA 53 0.209 4.111 -17.019 430 H ALA 54 H ALA 54 -0.755 2.094 -15.128 431 HA ALA 54 HA ALA 54 0.214 2.033 -12.500 432 HB1 ALA 54 1HB ALA 54 0.631 0.054 -14.731 433 HB2 ALA 54 2HB ALA 54 -0.740 0.082 -13.624 434 HB3 ALA 54 3HB ALA 54 0.879 -0.268 -13.017 435 H SER 55 H SER 55 2.464 1.126 -11.989 436 HA SER 55 HA SER 55 4.356 2.798 -13.460 437 HB2 SER 55 2HB SER 55 3.905 3.491 -11.113 438 HB3 SER 55 1HB SER 55 4.472 1.914 -10.567 439 HG SER 55 HG SER 55 5.870 4.021 -11.761 440 H LYS 56 H LYS 56 6.451 1.959 -13.831 441 HA LYS 56 HA LYS 56 6.471 -0.582 -14.872 442 HB2 LYS 56 2HB LYS 56 8.811 1.100 -14.047 443 HB3 LYS 56 1HB LYS 56 8.915 -0.365 -15.017 444 HG2 LYS 56 2HG LYS 56 7.544 0.633 -16.742 445 HG3 LYS 56 1HG LYS 56 7.340 2.088 -15.771 446 HD2 LYS 56 2HD LYS 56 8.995 2.460 -17.450 447 HD3 LYS 56 1HD LYS 56 9.736 2.440 -15.839 448 HE2 LYS 56 2HE LYS 56 10.499 0.125 -16.235 449 HE3 LYS 56 1HE LYS 56 9.755 0.162 -17.828 450 HZ1 LYS 56 3HZ LYS 56 12.132 0.584 -17.979 451 HZ2 LYS 56 1HZ LYS 56 12.014 1.882 -16.929 452 HZ3 LYS 56 2HZ LYS 56 11.280 1.954 -18.441 453 H THR 57 H THR 57 7.813 0.468 -11.755 454 HA THR 57 HA THR 57 8.810 -2.092 -11.108 455 HB THR 57 HB THR 57 8.247 0.271 -9.286 456 HG1 THR 57 1HG THR 57 9.793 0.989 -10.574 457 HG21 THR 57 3HG2 THR 57 10.029 -2.150 -8.878 458 HG22 THR 57 1HG2 THR 57 8.516 -1.843 -8.029 459 HG23 THR 57 2HG2 THR 57 9.899 -0.776 -7.781 460 H ALA 58 H ALA 58 5.772 -0.421 -10.377 461 HA ALA 58 HA ALA 58 4.741 -2.365 -8.606 462 HB1 ALA 58 1HB ALA 58 3.270 -0.400 -10.354 463 HB2 ALA 58 2HB ALA 58 3.840 -0.094 -8.710 464 HB3 ALA 58 3HB ALA 58 2.577 -1.289 -9.001 465 H LEU 59 H LEU 59 4.485 -1.916 -12.110 466 HA LEU 59 HA LEU 59 2.808 -4.065 -12.670 467 HB2 LEU 59 2HB LEU 59 5.021 -2.758 -14.258 468 HB3 LEU 59 1HB LEU 59 3.962 -4.066 -14.875 469 HG LEU 59 HG LEU 59 2.931 -1.390 -13.939 470 HD11 LEU 59 1HD1 LEU 59 4.517 -1.069 -15.812 471 HD12 LEU 59 2HD1 LEU 59 2.846 -0.800 -16.320 472 HD13 LEU 59 3HD1 LEU 59 3.659 -2.308 -16.730 473 HD21 LEU 59 3HD2 LEU 59 0.999 -2.043 -15.207 474 HD22 LEU 59 1HD2 LEU 59 1.379 -3.337 -14.072 475 HD23 LEU 59 2HD2 LEU 59 1.811 -3.492 -15.777 476 H LYS 60 H LYS 60 6.364 -3.877 -12.588 477 HA LYS 60 HA LYS 60 6.766 -6.609 -13.003 478 HB2 LYS 60 2HB LYS 60 8.558 -4.598 -11.660 479 HB3 LYS 60 1HB LYS 60 9.046 -6.251 -12.000 480 HG2 LYS 60 2HG LYS 60 8.629 -5.852 -14.397 481 HG3 LYS 60 1HG LYS 60 8.243 -4.171 -14.019 482 HD2 LYS 60 2HD LYS 60 10.486 -3.849 -13.128 483 HD3 LYS 60 1HD LYS 60 10.861 -5.542 -13.448 484 HE2 LYS 60 2HE LYS 60 10.496 -5.160 -15.848 485 HE3 LYS 60 1HE LYS 60 10.150 -3.465 -15.518 486 HZ1 LYS 60 3HZ LYS 60 12.446 -3.793 -16.252 487 HZ2 LYS 60 1HZ LYS 60 12.727 -4.819 -14.940 488 HZ3 LYS 60 2HZ LYS 60 12.387 -3.203 -14.678 489 H LYS 61 H LYS 61 6.011 -4.885 -10.112 490 HA LYS 61 HA LYS 61 6.545 -6.953 -8.284 491 HB2 LYS 61 2HB LYS 61 6.378 -4.722 -7.445 492 HB3 LYS 61 1HB LYS 61 4.854 -4.457 -8.248 493 HG2 LYS 61 2HG LYS 61 5.080 -6.383 -5.953 494 HG3 LYS 61 1HG LYS 61 4.920 -4.650 -5.684 495 HD2 LYS 61 2HD LYS 61 2.857 -4.655 -7.026 496 HD3 LYS 61 1HD LYS 61 3.004 -6.397 -7.228 497 HE2 LYS 61 2HE LYS 61 2.806 -6.687 -4.789 498 HE3 LYS 61 1HE LYS 61 2.701 -4.940 -4.601 499 HZ1 LYS 61 3HZ LYS 61 0.655 -4.942 -5.852 500 HZ2 LYS 61 1HZ LYS 61 0.527 -6.000 -4.551 501 HZ3 LYS 61 2HZ LYS 61 0.749 -6.613 -6.087 502 H SER 62 H SER 62 3.673 -6.088 -10.115 503 HA SER 62 HA SER 62 1.950 -8.113 -9.053 504 HB2 SER 62 2HB SER 62 1.820 -6.614 -11.673 505 HB3 SER 62 1HB SER 62 0.491 -7.451 -10.856 506 HG SER 62 HG SER 62 1.834 -5.084 -10.113 507 H TRP 63 H TRP 63 4.082 -7.860 -11.884 508 HA TRP 63 HA TRP 63 3.400 -10.347 -13.024 509 HB2 TRP 63 2HB TRP 63 4.330 -8.481 -14.312 510 HB3 TRP 63 1HB TRP 63 5.813 -8.558 -13.375 511 HD1 TRP 63 HD TRP 63 7.609 -10.117 -14.191 512 HE1 TRP 63 1HE TRP 63 7.857 -11.773 -16.172 513 HE3 TRP 63 3HE TRP 63 2.770 -10.201 -15.784 514 HZ2 TRP 63 2HZ TRP 63 6.212 -12.942 -18.117 515 HZ3 TRP 63 3HZ TRP 63 2.192 -11.651 -17.726 516 HH2 TRP 63 HH TRP 63 3.875 -12.958 -18.847 517 H LYS 64 H LYS 64 5.663 -9.296 -10.613 518 HA LYS 64 HA LYS 64 7.392 -11.498 -10.548 519 HB2 LYS 64 2HB LYS 64 7.713 -9.289 -9.404 520 HB3 LYS 64 1HB LYS 64 6.484 -9.759 -8.257 521 HG2 LYS 64 2HG LYS 64 7.886 -11.544 -7.426 522 HG3 LYS 64 1HG LYS 64 9.105 -11.186 -8.651 523 HD2 LYS 64 2HD LYS 64 9.350 -8.920 -7.738 524 HD3 LYS 64 1HD LYS 64 8.162 -9.296 -6.498 525 HE2 LYS 64 2HE LYS 64 10.825 -10.663 -6.872 526 HE3 LYS 64 1HE LYS 64 10.457 -9.456 -5.646 527 HZ1 LYS 64 3HZ LYS 64 8.772 -11.004 -4.759 528 HZ2 LYS 64 1HZ LYS 64 10.322 -11.661 -4.720 529 HZ3 LYS 64 2HZ LYS 64 9.238 -12.143 -5.893 530 H ARG 65 H ARG 65 4.340 -10.812 -8.940 531 HA ARG 65 HA ARG 65 4.104 -13.198 -7.422 532 HB2 ARG 65 2HB ARG 65 2.633 -11.220 -7.051 533 HB3 ARG 65 1HB ARG 65 1.930 -11.476 -8.629 534 HG2 ARG 65 2HG ARG 65 0.398 -12.335 -7.043 535 HG3 ARG 65 1HG ARG 65 1.175 -13.716 -7.803 536 HD2 ARG 65 2HD ARG 65 2.756 -13.704 -5.914 537 HD3 ARG 65 1HD ARG 65 1.640 -12.520 -5.182 538 HE ARG 65 HE ARG 65 0.369 -14.921 -6.107 539 HH11 ARG 65 1HH1 ARG 65 1.742 -13.337 -3.267 540 HH12 ARG 65 2HH1 ARG 65 1.174 -14.500 -2.161 541 HH21 ARG 65 1HH2 ARG 65 -0.387 -16.553 -4.597 542 HH22 ARG 65 2HH2 ARG 65 -0.047 -16.376 -2.929 543 H TYR 66 H TYR 66 3.034 -12.202 -10.617 544 HA TYR 66 HA TYR 66 1.505 -14.371 -11.450 545 HB2 TYR 66 2HB TYR 66 1.791 -12.152 -12.590 546 HB3 TYR 66 1HB TYR 66 3.367 -12.702 -13.141 547 HD1 TYR 66 2HD TYR 66 -0.248 -13.409 -13.315 548 HD2 TYR 66 1HD TYR 66 3.544 -13.976 -15.127 549 HE1 TYR 66 2HE TYR 66 -1.341 -14.328 -15.295 550 HE2 TYR 66 1HE TYR 66 2.458 -14.889 -17.122 551 HH TYR 66 HH TYR 66 0.329 -16.003 -17.716 552 H GLU 67 H GLU 67 4.971 -13.809 -12.045 553 HA GLU 67 HA GLU 67 5.597 -16.302 -13.213 554 HB2 GLU 67 2HB GLU 67 7.346 -14.547 -11.497 555 HB3 GLU 67 1HB GLU 67 7.901 -15.840 -12.553 556 HG2 GLU 67 2HG GLU 67 6.375 -13.475 -13.349 557 HG3 GLU 67 1HG GLU 67 8.138 -13.571 -13.512 558 H GLN 68 H GLN 68 5.812 -15.281 -9.940 559 HA GLN 68 HA GLN 68 6.763 -17.685 -8.857 560 HB2 GLN 68 2HB GLN 68 5.066 -15.574 -7.562 561 HB3 GLN 68 1HB GLN 68 5.669 -16.969 -6.679 562 HG2 GLN 68 2HG GLN 68 7.369 -14.937 -8.102 563 HG3 GLN 68 1HG GLN 68 7.073 -15.002 -6.363 564 HE21 GLN 68 1HE2 GLN 68 7.988 -16.622 -5.173 565 HE22 GLN 68 2HE2 GLN 68 9.288 -17.601 -5.735 566 H GLU 69 H GLU 69 3.397 -16.743 -9.312 567 HA GLU 69 HA GLU 69 2.365 -19.162 -8.220 568 HB2 GLU 69 2HB GLU 69 1.085 -17.097 -9.999 569 HB3 GLU 69 1HB GLU 69 0.223 -18.401 -9.195 570 HG2 GLU 69 2HG GLU 69 1.798 -16.267 -7.787 571 HG3 GLU 69 1HG GLU 69 0.058 -16.235 -8.028 572 H MET 70 H MET 70 2.950 -18.014 -11.511 573 HA MET 70 HA MET 70 1.843 -20.262 -12.818 574 HB2 MET 70 2HB MET 70 3.988 -18.369 -13.800 575 HB3 MET 70 1HB MET 70 3.137 -19.519 -14.814 576 HG2 MET 70 2HG MET 70 1.912 -17.183 -13.355 577 HG3 MET 70 1HG MET 70 2.261 -17.257 -15.077 578 HE1 MET 70 3HE MET 70 -0.301 -19.915 -16.332 579 HE2 MET 70 1HE MET 70 1.372 -20.202 -15.845 580 HE3 MET 70 2HE MET 70 0.959 -18.759 -16.774 581 H LEU 71 H LEU 71 5.080 -19.578 -11.614 582 HA LEU 71 HA LEU 71 6.188 -21.992 -12.653 583 HB2 LEU 71 2HB LEU 71 7.583 -20.102 -12.389 584 HB3 LEU 71 1HB LEU 71 7.168 -19.900 -10.711 585 HG LEU 71 HG LEU 71 8.363 -22.000 -10.214 586 HD11 LEU 71 1HD1 LEU 71 9.867 -22.960 -11.933 587 HD12 LEU 71 2HD1 LEU 71 9.155 -21.868 -13.123 588 HD13 LEU 71 3HD1 LEU 71 8.161 -23.113 -12.369 589 HD21 LEU 71 3HD2 LEU 71 9.499 -19.878 -9.961 590 HD22 LEU 71 1HD2 LEU 71 9.978 -19.905 -11.657 591 HD23 LEU 71 2HD2 LEU 71 10.633 -21.099 -10.539 592 H LYS 72 H LYS 72 4.517 -21.085 -9.775 593 HA LYS 72 HA LYS 72 5.358 -23.276 -8.149 594 HB2 LYS 72 2HB LYS 72 4.472 -21.221 -7.163 595 HB3 LYS 72 1HB LYS 72 2.939 -21.471 -7.969 596 HG2 LYS 72 2HG LYS 72 2.522 -23.441 -6.611 597 HG3 LYS 72 1HG LYS 72 4.098 -23.257 -5.837 598 HD2 LYS 72 2HD LYS 72 3.416 -21.083 -4.951 599 HD3 LYS 72 1HD LYS 72 1.853 -21.240 -5.746 600 HE2 LYS 72 2HE LYS 72 2.914 -23.115 -3.630 601 HE3 LYS 72 1HE LYS 72 1.783 -21.803 -3.327 602 HZ1 LYS 72 3HZ LYS 72 0.164 -22.889 -4.720 603 HZ2 LYS 72 1HZ LYS 72 0.701 -23.952 -3.552 604 HZ3 LYS 72 2HZ LYS 72 1.249 -24.132 -5.118 605 H ASN 73 H ASN 73 2.726 -22.668 -10.333 606 HA ASN 73 HA ASN 73 1.526 -25.271 -9.755 607 HB2 ASN 73 2HB ASN 73 0.575 -23.009 -11.525 608 HB3 ASN 73 1HB ASN 73 -0.326 -24.488 -11.203 609 HD21 ASN 73 1HD2 ASN 73 -0.946 -21.662 -10.610 610 HD22 ASN 73 2HD2 ASN 73 -1.222 -21.585 -8.914 611 H GLU 74 H GLU 74 3.154 -23.544 -12.323 612 HA GLU 74 HA GLU 74 4.175 -24.094 -14.143 613 HB2 GLU 74 2HB GLU 74 4.019 -26.927 -13.139 614 HB3 GLU 74 1HB GLU 74 4.914 -26.439 -14.572 615 HG2 GLU 74 2HG GLU 74 6.318 -25.000 -13.226 616 HG3 GLU 74 1HG GLU 74 5.398 -25.431 -11.787 617 H LYS 75 H LYS 75 2.300 -27.084 -14.301 618 HA LYS 75 HA LYS 75 1.421 -26.044 -16.856 619 HB2 LYS 75 2HB LYS 75 2.504 -28.329 -16.706 620 HB3 LYS 75 1HB LYS 75 1.078 -28.878 -15.845 621 HG2 LYS 75 2HG LYS 75 1.008 -27.742 -18.643 622 HG3 LYS 75 1HG LYS 75 1.159 -29.455 -18.303 623 HD2 LYS 75 2HD LYS 75 -1.029 -29.438 -17.211 624 HD3 LYS 75 1HD LYS 75 -1.151 -27.694 -17.447 625 HE2 LYS 75 2HE LYS 75 -2.458 -28.958 -19.106 626 HE3 LYS 75 1HE LYS 75 -1.190 -28.001 -19.863 627 HZ1 LYS 75 3HZ LYS 75 -1.335 -30.214 -20.793 628 HZ2 LYS 75 1HZ LYS 75 -1.047 -30.912 -19.291 629 HZ3 LYS 75 2HZ LYS 75 0.146 -29.998 -20.060 630 H VAL 76 H VAL 76 -0.186 -24.838 -16.653 631 HA VAL 76 HA VAL 76 -2.736 -25.966 -15.762 632 HB VAL 76 HB VAL 76 -1.916 -23.081 -15.195 633 HG11 VAL 76 1HG1 VAL 76 -4.410 -24.598 -14.441 634 HG12 VAL 76 2HG1 VAL 76 -4.281 -23.304 -15.632 635 HG13 VAL 76 3HG1 VAL 76 -4.019 -22.960 -13.921 636 HG21 VAL 76 3HG2 VAL 76 -1.982 -23.656 -12.797 637 HG22 VAL 76 1HG2 VAL 76 -0.733 -24.556 -13.663 638 HG23 VAL 76 2HG2 VAL 76 -2.250 -25.346 -13.233 639 H ALA 77 H ALA 77 -1.366 -22.972 -17.011 640 HA ALA 77 HA ALA 77 -1.997 -23.421 -19.691 641 HB1 ALA 77 1HB ALA 77 -3.727 -21.401 -18.260 642 HB2 ALA 77 2HB ALA 77 -4.283 -22.923 -18.971 643 HB3 ALA 77 3HB ALA 77 -3.633 -21.643 -20.007 644 H ALA 78 H ALA 78 0.101 -22.883 -19.856 645 HA ALA 78 HA ALA 78 0.886 -20.208 -18.983 646 HB1 ALA 78 1HB ALA 78 2.622 -22.479 -19.962 647 HB2 ALA 78 2HB ALA 78 2.350 -22.051 -18.272 648 HB3 ALA 78 3HB ALA 78 3.193 -20.929 -19.341 649 H LYS 79 H LYS 79 0.440 -18.767 -20.437 650 HA LYS 79 HA LYS 79 0.999 -19.413 -23.229 651 HB2 LYS 79 2HB LYS 79 -0.977 -17.441 -22.091 652 HB3 LYS 79 1HB LYS 79 -0.628 -17.627 -23.810 653 HG2 LYS 79 2HG LYS 79 -1.446 -19.938 -23.704 654 HG3 LYS 79 1HG LYS 79 -1.788 -19.728 -21.987 655 HD2 LYS 79 2HD LYS 79 -3.342 -17.937 -22.512 656 HD3 LYS 79 1HD LYS 79 -2.982 -18.139 -24.229 657 HE2 LYS 79 2HE LYS 79 -4.194 -20.272 -22.455 658 HE3 LYS 79 1HE LYS 79 -5.112 -19.231 -23.537 659 HZ1 LYS 79 3HZ LYS 79 -4.672 -21.388 -24.520 660 HZ2 LYS 79 1HZ LYS 79 -3.013 -21.168 -24.386 661 HZ3 LYS 79 2HZ LYS 79 -3.909 -20.185 -25.411 662 H MET 80 H MET 80 2.985 -18.700 -23.569 663 HA MET 80 HA MET 80 3.559 -15.903 -23.142 664 HB2 MET 80 2HB MET 80 4.235 -17.000 -21.025 665 HB3 MET 80 1HB MET 80 5.215 -18.135 -21.918 666 HG2 MET 80 2HG MET 80 5.739 -15.161 -21.841 667 HG3 MET 80 1HG MET 80 6.447 -16.307 -20.714 668 HE1 MET 80 3HE MET 80 9.495 -15.310 -22.955 669 HE2 MET 80 1HE MET 80 8.872 -15.429 -21.310 670 HE3 MET 80 2HE MET 80 8.176 -14.260 -22.436 671 H LEU 81 H LEU 81 4.187 -15.302 -25.084 672 HA LEU 81 HA LEU 81 5.498 -17.166 -26.865 673 HB2 LEU 81 2HB LEU 81 4.701 -14.274 -27.267 674 HB3 LEU 81 1HB LEU 81 5.520 -15.221 -28.478 675 HG LEU 81 HG LEU 81 3.530 -16.763 -28.515 676 HD11 LEU 81 1HD1 LEU 81 2.223 -14.623 -26.851 677 HD12 LEU 81 2HD1 LEU 81 2.577 -16.274 -26.346 678 HD13 LEU 81 3HD1 LEU 81 1.405 -15.976 -27.632 679 HD21 LEU 81 3HD2 LEU 81 2.136 -15.253 -29.842 680 HD22 LEU 81 1HD2 LEU 81 3.848 -15.071 -30.219 681 HD23 LEU 81 2HD2 LEU 81 3.032 -13.874 -29.212 682 H GLU 82 H GLU 82 7.604 -17.192 -27.355 683 HA GLU 82 HA GLU 82 9.283 -16.054 -25.410 684 HB2 GLU 82 2HB GLU 82 10.009 -17.608 -27.878 685 HB3 GLU 82 1HB GLU 82 11.133 -17.157 -26.604 686 HG2 GLU 82 2HG GLU 82 9.739 -18.424 -24.999 687 HG3 GLU 82 1HG GLU 82 8.737 -18.950 -26.343 688 H LYS 83 H LYS 83 9.527 -14.025 -25.393 689 HA LYS 83 HA LYS 83 11.111 -12.868 -27.545 690 HB2 LYS 83 2HB LYS 83 8.913 -11.420 -26.033 691 HB3 LYS 83 1HB LYS 83 10.090 -10.627 -27.063 692 HG2 LYS 83 2HG LYS 83 8.065 -12.667 -27.963 693 HG3 LYS 83 1HG LYS 83 7.935 -10.918 -28.168 694 HD2 LYS 83 2HD LYS 83 9.949 -10.925 -29.553 695 HD3 LYS 83 1HD LYS 83 10.104 -12.666 -29.329 696 HE2 LYS 83 2HE LYS 83 7.801 -11.259 -30.663 697 HE3 LYS 83 1HE LYS 83 9.093 -12.127 -31.483 698 HZ1 LYS 83 3HZ LYS 83 7.150 -13.498 -31.298 699 HZ2 LYS 83 1HZ LYS 83 7.092 -13.297 -29.631 700 HZ3 LYS 83 2HZ LYS 83 8.358 -14.161 -30.338 701 H ASP 84 H ASP 84 12.890 -13.428 -26.392 702 HA ASP 84 HA ASP 84 13.222 -12.084 -23.802 703 HB2 ASP 84 2HB ASP 84 13.530 -14.554 -23.772 704 HB3 ASP 84 1HB ASP 84 14.803 -14.390 -24.974 705 H ALA 85 H ALA 85 14.914 -10.741 -23.514 706 HA ALA 85 HA ALA 85 16.647 -10.234 -25.806 707 HB1 ALA 85 1HB ALA 85 15.245 -8.175 -24.090 708 HB2 ALA 85 2HB ALA 85 14.926 -8.504 -25.792 709 HB3 ALA 85 3HB ALA 85 16.470 -7.812 -25.300 710 H THR 86 H THR 86 18.764 -10.069 -25.218 711 HA THR 86 HA THR 86 19.427 -10.633 -22.494 712 HB THR 86 HB THR 86 21.792 -10.465 -23.288 713 HG1 THR 86 1HG THR 86 21.227 -10.346 -25.938 714 HG21 THR 86 3HG2 THR 86 21.712 -12.390 -24.828 715 HG22 THR 86 1HG2 THR 86 19.990 -12.111 -25.081 716 HG23 THR 86 2HG2 THR 86 20.578 -12.603 -23.497 717 H GLU 87 H GLU 87 19.461 -7.909 -24.648 718 HA GLU 87 HA GLU 87 19.520 -5.682 -24.378 719 HB2 GLU 87 2HB GLU 87 17.790 -6.181 -22.639 720 HB3 GLU 87 1HB GLU 87 19.056 -6.303 -21.438 721 HG2 GLU 87 2HG GLU 87 19.550 -3.942 -21.681 722 HG3 GLU 87 1HG GLU 87 18.377 -3.810 -22.989 723 H VAL 88 H VAL 88 21.874 -7.448 -24.020 724 HA VAL 88 HA VAL 88 23.673 -5.629 -22.596 725 HB VAL 88 HB VAL 88 24.193 -8.466 -23.551 726 HG11 VAL 88 1HG1 VAL 88 26.228 -7.141 -23.479 727 HG12 VAL 88 2HG1 VAL 88 26.230 -8.333 -22.177 728 HG13 VAL 88 3HG1 VAL 88 25.874 -6.643 -21.826 729 HG21 VAL 88 3HG2 VAL 88 22.581 -8.424 -21.725 730 HG22 VAL 88 1HG2 VAL 88 23.675 -7.430 -20.764 731 HG23 VAL 88 2HG2 VAL 88 24.118 -9.087 -21.182 732 H GLY 89 H GLY 89 24.547 -4.181 -23.888 733 HA2 GLY 89 2HA GLY 89 25.980 -4.936 -26.236 734 HA3 GLY 89 1HA GLY 89 24.506 -4.057 -26.623 735 H VAL 90 H VAL 90 27.253 -3.875 -24.436 736 HA VAL 90 HA VAL 90 27.205 -0.964 -24.748 737 HB VAL 90 HB VAL 90 28.404 -0.832 -22.575 738 HG11 VAL 90 1HG1 VAL 90 26.510 -1.443 -21.139 739 HG12 VAL 90 2HG1 VAL 90 25.813 -2.367 -22.466 740 HG13 VAL 90 3HG1 VAL 90 25.985 -0.615 -22.605 741 HG21 VAL 90 3HG2 VAL 90 28.542 -2.819 -21.128 742 HG22 VAL 90 1HG2 VAL 90 29.494 -3.029 -22.598 743 HG23 VAL 90 2HG2 VAL 90 27.928 -3.818 -22.446 744 H LYS 91 H LYS 91 29.531 -0.080 -24.151 745 HA LYS 91 HA LYS 91 31.690 0.232 -24.718 746 HB2 LYS 91 2HB LYS 91 32.060 -1.966 -23.651 747 HB3 LYS 91 1HB LYS 91 31.804 -2.737 -25.205 748 HG2 LYS 91 2HG LYS 91 33.756 -1.640 -26.116 749 HG3 LYS 91 1HG LYS 91 33.996 -0.763 -24.598 750 HD2 LYS 91 2HD LYS 91 34.185 -2.866 -23.443 751 HD3 LYS 91 1HD LYS 91 34.062 -3.737 -24.978 752 HE2 LYS 91 2HE LYS 91 36.216 -1.756 -24.214 753 HE3 LYS 91 1HE LYS 91 36.414 -3.501 -24.225 754 HZ1 LYS 91 3HZ LYS 91 37.338 -2.428 -26.172 755 HZ2 LYS 91 1HZ LYS 91 35.849 -1.820 -26.628 756 HZ3 LYS 91 2HZ LYS 91 36.126 -3.477 -26.640 757 H ALA 92 H ALA 92 31.602 1.475 -26.431 758 HA ALA 92 HA ALA 92 31.009 0.373 -29.041 759 HB1 ALA 92 1HB ALA 92 31.108 2.707 -29.797 760 HB2 ALA 92 2HB ALA 92 31.656 3.205 -28.199 761 HB3 ALA 92 3HB ALA 92 30.035 2.538 -28.406 762 H ALA 93 H ALA 93 32.507 1.322 -30.821 763 HA ALA 93 HA ALA 93 35.065 0.161 -30.473 764 HB1 ALA 93 1HB ALA 93 35.511 0.984 -32.737 765 HB2 ALA 93 2HB ALA 93 34.022 1.940 -32.664 766 HB3 ALA 93 3HB ALA 93 33.945 0.185 -32.621 767 H LEU 94 H LEU 94 37.070 1.087 -30.376 768 HA LEU 94 HA LEU 94 37.238 3.545 -28.941 769 HB2 LEU 94 2HB LEU 94 39.403 1.736 -30.034 770 HB3 LEU 94 1HB LEU 94 39.724 3.161 -29.088 771 HG LEU 94 HG LEU 94 38.502 2.086 -27.172 772 HD11 LEU 94 1HD1 LEU 94 38.118 -0.317 -27.205 773 HD12 LEU 94 2HD1 LEU 94 38.570 -0.364 -28.906 774 HD13 LEU 94 3HD1 LEU 94 37.128 0.518 -28.401 775 HD21 LEU 94 3HD2 LEU 94 40.921 2.065 -27.293 776 HD22 LEU 94 1HD2 LEU 94 40.877 0.600 -28.273 777 HD23 LEU 94 2HD2 LEU 94 40.320 0.558 -26.601 778 H GLU 95 H GLU 95 37.488 5.517 -29.757 779 HA GLU 95 HA GLU 95 37.680 5.811 -32.591 780 HB2 GLU 95 2HB GLU 95 37.585 7.883 -30.419 781 HB3 GLU 95 1HB GLU 95 37.566 8.237 -32.134 782 HG2 GLU 95 2HG GLU 95 35.471 6.920 -32.318 783 HG3 GLU 95 1HG GLU 95 35.483 6.756 -30.560 784 H GLU 96 H GLU 96 39.131 7.409 -33.524 785 HA GLU 96 HA GLU 96 41.870 7.025 -32.543 786 HB2 GLU 96 2HB GLU 96 42.479 7.242 -34.951 787 HB3 GLU 96 1HB GLU 96 41.477 5.832 -34.608 788 HG2 GLU 96 2HG GLU 96 39.510 7.000 -35.399 789 HG3 GLU 96 1HG GLU 96 40.461 8.452 -35.669 790 H ALA 97 H ALA 97 43.329 8.821 -33.268 791 HA ALA 97 HA ALA 97 41.964 11.396 -33.109 792 HB1 ALA 97 1HB ALA 97 44.885 10.694 -32.795 793 HB2 ALA 97 2HB ALA 97 43.752 10.990 -31.476 794 HB3 ALA 97 3HB ALA 97 44.187 12.297 -32.580 795 H LYS 98 H LYS 98 41.838 12.654 -34.839 796 HA LYS 98 HA LYS 98 43.110 11.793 -37.320 797 HB2 LYS 98 2HB LYS 98 40.864 13.688 -36.713 798 HB3 LYS 98 1HB LYS 98 41.678 13.724 -38.260 799 HG2 LYS 98 2HG LYS 98 39.575 12.482 -38.339 800 HG3 LYS 98 1HG LYS 98 40.952 11.462 -38.721 801 HD2 LYS 98 2HD LYS 98 40.861 10.454 -36.538 802 HD3 LYS 98 1HD LYS 98 39.603 11.583 -36.027 803 HE2 LYS 98 2HE LYS 98 38.696 9.377 -36.642 804 HE3 LYS 98 1HE LYS 98 38.065 10.678 -37.640 805 HZ1 LYS 98 3HZ LYS 98 38.618 8.789 -38.994 806 HZ2 LYS 98 1HZ LYS 98 40.218 8.753 -38.442 807 HZ3 LYS 98 2HZ LYS 98 39.638 10.038 -39.381 808 H LYS 99 H LYS 99 44.469 13.050 -38.516 809 HA LYS 99 HA LYS 99 45.731 15.263 -37.180 810 HB2 LYS 99 2HB LYS 99 47.065 13.714 -38.602 811 HB3 LYS 99 1HB LYS 99 46.110 14.181 -40.003 812 HG2 LYS 99 2HG LYS 99 46.928 16.515 -39.709 813 HG3 LYS 99 1HG LYS 99 47.971 15.937 -38.415 814 HD2 LYS 99 2HD LYS 99 48.062 15.026 -41.296 815 HD3 LYS 99 1HD LYS 99 49.174 16.168 -40.554 816 HE2 LYS 99 2HE LYS 99 49.921 14.398 -39.000 817 HE3 LYS 99 1HE LYS 99 48.822 13.265 -39.787 818 HZ1 LYS 99 3HZ LYS 99 51.080 14.665 -41.097 819 HZ2 LYS 99 1HZ LYS 99 50.071 13.560 -41.860 820 HZ3 LYS 99 2HZ LYS 99 51.110 13.071 -40.619 821 H VAL 100 H VAL 100 44.574 17.087 -37.160 822 HA VAL 100 HA VAL 100 42.686 17.555 -39.296 823 HB VAL 100 HB VAL 100 41.804 19.414 -37.932 824 HG11 VAL 100 1HG1 VAL 100 40.897 18.056 -36.098 825 HG12 VAL 100 2HG1 VAL 100 42.110 16.819 -36.434 826 HG13 VAL 100 3HG1 VAL 100 40.879 17.197 -37.636 827 HG21 VAL 100 3HG2 VAL 100 43.876 20.099 -36.809 828 HG22 VAL 100 1HG2 VAL 100 43.895 18.589 -35.902 829 HG23 VAL 100 2HG2 VAL 100 42.609 19.763 -35.632 830 H GLN 101 H GLN 101 42.799 19.127 -40.763 831 HA GLN 101 HA GLN 101 45.345 20.417 -41.023 832 HB2 GLN 101 2HB GLN 101 42.876 20.595 -42.755 833 HB3 GLN 101 1HB GLN 101 44.438 21.282 -43.163 834 HG2 GLN 101 2HG GLN 101 43.858 18.344 -42.800 835 HG3 GLN 101 1HG GLN 101 44.002 19.173 -44.345 836 HE21 GLN 101 1HE2 GLN 101 45.691 17.866 -45.010 837 HE22 GLN 101 2HE2 GLN 101 47.278 17.972 -44.328 838 H ILE 102 H ILE 102 45.783 22.386 -40.334 839 HA ILE 102 HA ILE 102 43.721 23.822 -39.002 840 HB ILE 102 HB ILE 102 45.492 25.512 -38.438 841 HG12 ILE 102 2HG1 ILE 102 47.356 23.536 -39.795 842 HG13 ILE 102 1HG1 ILE 102 46.963 25.140 -40.405 843 HG21 ILE 102 1HG2 ILE 102 46.683 24.048 -36.867 844 HG22 ILE 102 2HG2 ILE 102 46.075 22.642 -37.742 845 HG23 ILE 102 3HG2 ILE 102 44.952 23.717 -36.910 846 HD11 ILE 102 3HD1 ILE 102 48.021 26.130 -38.440 847 HD12 ILE 102 1HD1 ILE 102 49.141 25.097 -39.328 848 HD13 ILE 102 2HD1 ILE 102 48.400 24.518 -37.833 849 H GLU 103 H GLU 103 42.279 24.651 -40.254 850 HA GLU 103 HA GLU 103 43.062 26.153 -42.594 851 HB2 GLU 103 2HB GLU 103 40.324 25.526 -41.474 852 HB3 GLU 103 1HB GLU 103 40.630 26.349 -42.996 853 HG2 GLU 103 2HG GLU 103 41.748 24.375 -43.860 854 HG3 GLU 103 1HG GLU 103 41.484 23.543 -42.330 855 H LEU 104 H LEU 104 44.002 27.969 -41.923 856 HA LEU 104 HA LEU 104 42.315 29.893 -40.594 857 HB2 LEU 104 2HB LEU 104 43.652 28.716 -38.807 858 HB3 LEU 104 1HB LEU 104 45.112 29.232 -39.599 859 HG LEU 104 HG LEU 104 43.101 31.142 -38.340 860 HD11 LEU 104 1HD1 LEU 104 44.709 31.319 -36.509 861 HD12 LEU 104 2HD1 LEU 104 45.688 30.056 -37.253 862 HD13 LEU 104 3HD1 LEU 104 44.068 29.684 -36.665 863 HD21 LEU 104 3HD2 LEU 104 45.973 31.580 -39.186 864 HD22 LEU 104 1HD2 LEU 104 44.922 32.772 -38.422 865 HD23 LEU 104 2HD2 LEU 104 44.557 32.189 -40.047 866 H ASP 105 H ASP 105 42.205 30.974 -42.455 867 HA ASP 105 HA ASP 105 44.611 31.892 -43.828 868 HB2 ASP 105 2HB ASP 105 42.457 31.347 -45.048 869 HB3 ASP 105 1HB ASP 105 41.716 32.711 -44.225 870 H THR 106 H THR 106 42.243 32.766 -41.573 871 HA THR 106 HA THR 106 43.672 35.040 -40.662 872 HB THR 106 HB THR 106 42.280 36.082 -42.352 873 HG1 THR 106 1HG THR 106 41.131 37.489 -41.116 874 HG21 THR 106 3HG2 THR 106 39.816 35.910 -42.353 875 HG22 THR 106 1HG2 THR 106 39.908 34.720 -41.057 876 HG23 THR 106 2HG2 THR 106 40.578 34.348 -42.641 877 H SER 107 H SER 107 42.725 35.640 -38.535 878 HA SER 107 HA SER 107 41.700 33.324 -37.156 879 HB2 SER 107 2HB SER 107 42.463 36.066 -36.127 880 HB3 SER 107 1HB SER 107 42.115 34.648 -35.131 881 HG SER 107 HG SER 107 43.849 33.626 -35.966 882 H LEU 108 H LEU 108 40.523 35.922 -38.772 883 HA LEU 108 HA LEU 108 38.577 36.849 -39.150 884 HB2 LEU 108 2HB LEU 108 37.350 34.708 -37.367 885 HB3 LEU 108 1HB LEU 108 36.432 35.896 -38.264 886 HG LEU 108 HG LEU 108 37.367 34.909 -40.353 887 HD11 LEU 108 1HD1 LEU 108 38.203 32.660 -38.530 888 HD12 LEU 108 2HD1 LEU 108 39.289 33.720 -39.412 889 HD13 LEU 108 3HD1 LEU 108 38.225 32.616 -40.292 890 HD21 LEU 108 3HD2 LEU 108 35.667 33.162 -38.593 891 HD22 LEU 108 1HD2 LEU 108 35.820 32.998 -40.343 892 HD23 LEU 108 2HD2 LEU 108 35.120 34.460 -39.656 893 H SER 109 H SER 109 39.150 38.751 -38.288 894 HA SER 109 HA SER 109 38.476 39.236 -35.526 895 HB2 SER 109 2HB SER 109 39.517 41.137 -37.641 896 HB3 SER 109 1HB SER 109 39.407 41.463 -35.908 897 HG SER 109 HG SER 109 40.726 39.316 -35.922 898 H TYR 110 H TYR 110 36.342 38.811 -35.622 899 HA TYR 110 HA TYR 110 34.689 40.387 -37.414 900 HB2 TYR 110 2HB TYR 110 34.461 37.900 -37.285 901 HB3 TYR 110 1HB TYR 110 33.967 38.076 -35.612 902 HD1 TYR 110 2HD TYR 110 33.045 39.300 -39.008 903 HD2 TYR 110 1HD TYR 110 31.692 38.088 -35.164 904 HE1 TYR 110 2HE TYR 110 30.727 39.485 -39.774 905 HE2 TYR 110 1HE TYR 110 29.360 38.260 -35.928 906 HH TYR 110 HH TYR 110 28.104 39.479 -37.693 907 H ILE 111 H ILE 111 34.541 42.323 -36.531 908 HA ILE 111 HA ILE 111 33.612 42.425 -33.832 909 HB ILE 111 HB ILE 111 34.468 44.923 -33.945 910 HG12 ILE 111 2HG1 ILE 111 36.715 45.034 -35.090 911 HG13 ILE 111 1HG1 ILE 111 36.358 43.499 -35.856 912 HG21 ILE 111 1HG2 ILE 111 35.096 43.339 -32.280 913 HG22 ILE 111 2HG2 ILE 111 36.523 44.204 -32.843 914 HG23 ILE 111 3HG2 ILE 111 36.215 42.552 -33.393 915 HD11 ILE 111 3HD1 ILE 111 36.035 45.335 -37.381 916 HD12 ILE 111 1HD1 ILE 111 34.900 46.095 -36.266 917 HD13 ILE 111 2HD1 ILE 111 34.490 44.560 -37.034 Start of MODEL 15 1 H1 GLY -1 1HT GLY -1 -4.944 -8.908 -26.014 2 H2 GLY -1 2HT GLY -1 -3.720 -9.459 -25.045 3 H3 GLY -1 3HT GLY -1 -4.101 -10.308 -26.467 4 HA2 GLY -1 1HA GLY -1 -2.109 -9.008 -26.816 5 HA3 GLY -1 2HA GLY -1 -3.441 -8.294 -27.719 6 H SER 0 H SER 0 -2.871 -6.159 -27.687 7 HA SER 0 HA SER 0 -1.973 -4.973 -25.233 8 HB2 SER 0 2HB SER 0 -2.548 -3.716 -27.921 9 HB3 SER 0 1HB SER 0 -1.744 -2.917 -26.573 10 HG SER 0 HG SER 0 -0.569 -5.259 -27.044 11 H MET 1 H MET 1 -3.674 -5.133 -23.850 12 HA MET 1 HA MET 1 -6.117 -3.677 -24.572 13 HB2 MET 1 2HB MET 1 -6.525 -6.028 -24.085 14 HB3 MET 1 1HB MET 1 -5.706 -5.878 -22.539 15 HG2 MET 1 2HG MET 1 -8.115 -5.913 -22.237 16 HG3 MET 1 1HG MET 1 -7.450 -4.353 -21.757 17 HE1 MET 1 3HE MET 1 -10.962 -3.360 -23.152 18 HE2 MET 1 1HE MET 1 -9.839 -3.236 -21.794 19 HE3 MET 1 2HE MET 1 -10.543 -4.795 -22.219 20 H THR 2 H THR 2 -6.832 -2.065 -23.264 21 HA THR 2 HA THR 2 -5.061 -1.097 -21.174 22 HB THR 2 HB THR 2 -7.703 0.006 -22.180 23 HG1 THR 2 1HG THR 2 -5.419 -0.167 -23.437 24 HG21 THR 2 3HG2 THR 2 -7.032 0.863 -19.973 25 HG22 THR 2 1HG2 THR 2 -6.906 2.125 -21.199 26 HG23 THR 2 2HG2 THR 2 -5.456 1.309 -20.623 27 H VAL 3 H VAL 3 -5.387 -1.872 -19.150 28 HA VAL 3 HA VAL 3 -8.080 -2.892 -18.500 29 HB VAL 3 HB VAL 3 -5.557 -3.492 -16.958 30 HG11 VAL 3 1HG1 VAL 3 -7.564 -3.928 -15.736 31 HG12 VAL 3 2HG1 VAL 3 -6.764 -5.426 -16.243 32 HG13 VAL 3 3HG1 VAL 3 -8.189 -4.872 -17.116 33 HG21 VAL 3 3HG2 VAL 3 -6.726 -5.193 -19.148 34 HG22 VAL 3 1HG2 VAL 3 -5.455 -5.635 -18.010 35 HG23 VAL 3 2HG2 VAL 3 -5.162 -4.345 -19.188 36 H TYR 4 H TYR 4 -9.167 -2.049 -16.699 37 HA TYR 4 HA TYR 4 -7.856 0.206 -15.404 38 HB2 TYR 4 2HB TYR 4 -10.771 -0.578 -15.525 39 HB3 TYR 4 1HB TYR 4 -10.106 0.896 -14.824 40 HD1 TYR 4 2HD TYR 4 -10.730 -0.895 -17.992 41 HD2 TYR 4 1HD TYR 4 -9.509 2.759 -16.216 42 HE1 TYR 4 2HE TYR 4 -10.963 0.221 -20.156 43 HE2 TYR 4 1HE TYR 4 -9.740 3.893 -18.382 44 HH TYR 4 HH TYR 4 -11.310 2.419 -21.043 45 H ILE 5 H ILE 5 -7.408 0.132 -13.287 46 HA ILE 5 HA ILE 5 -8.196 -2.277 -11.736 47 HB ILE 5 HB ILE 5 -5.817 -0.483 -11.268 48 HG12 ILE 5 2HG1 ILE 5 -4.344 -2.237 -11.794 49 HG13 ILE 5 1HG1 ILE 5 -5.551 -3.385 -12.219 50 HG21 ILE 5 1HG2 ILE 5 -6.626 -1.423 -9.235 51 HG22 ILE 5 2HG2 ILE 5 -5.059 -2.144 -9.625 52 HG23 ILE 5 3HG2 ILE 5 -6.556 -3.046 -9.902 53 HD11 ILE 5 3HD1 ILE 5 -4.698 -0.882 -13.702 54 HD12 ILE 5 1HD1 ILE 5 -6.118 -1.819 -14.170 55 HD13 ILE 5 2HD1 ILE 5 -4.517 -2.555 -14.230 56 H CYS 6 H CYS 6 -9.606 -1.758 -10.140 57 HA CYS 6 HA CYS 6 -8.931 0.586 -8.579 58 HB2 CYS 6 2HB CYS 6 -11.170 1.009 -9.624 59 HB3 CYS 6 1HB CYS 6 -11.744 -0.487 -8.893 60 HG CYS 6 HG CYS 6 -12.747 1.688 -7.490 61 HA PRO 7 HA PRO 7 -8.056 -3.070 -6.131 62 HB2 PRO 7 2HB PRO 7 -6.769 -1.733 -4.127 63 HB3 PRO 7 1HB PRO 7 -6.004 -2.185 -5.653 64 HG2 PRO 7 2HG PRO 7 -7.173 0.448 -4.832 65 HG3 PRO 7 1HG PRO 7 -5.657 0.114 -5.686 66 HD2 PRO 7 2HD PRO 7 -7.844 0.937 -6.967 67 HD3 PRO 7 1HD PRO 7 -6.720 -0.223 -7.711 68 H GLU 8 H GLU 8 -10.132 -0.567 -5.480 69 HA GLU 8 HA GLU 8 -10.820 -1.568 -2.799 70 HB2 GLU 8 2HB GLU 8 -11.660 1.012 -4.066 71 HB3 GLU 8 1HB GLU 8 -11.823 0.538 -2.380 72 HG2 GLU 8 2HG GLU 8 -9.403 0.428 -2.220 73 HG3 GLU 8 1HG GLU 8 -9.373 0.969 -3.917 74 H THR 9 H THR 9 -12.573 0.093 -5.421 75 HA THR 9 HA THR 9 -14.917 -1.334 -4.589 76 HB THR 9 HB THR 9 -16.127 0.421 -5.862 77 HG1 THR 9 1HG THR 9 -14.922 1.331 -7.344 78 HG21 THR 9 3HG2 THR 9 -14.039 1.416 -3.921 79 HG22 THR 9 1HG2 THR 9 -15.594 0.717 -3.478 80 HG23 THR 9 2HG2 THR 9 -15.537 2.265 -4.332 81 H GLY 10 H GLY 10 -12.609 -2.184 -6.677 82 HA2 GLY 10 2HA GLY 10 -14.683 -3.220 -8.426 83 HA3 GLY 10 1HA GLY 10 -13.090 -3.002 -9.081 84 H ASP 11 H ASP 11 -13.540 -5.408 -9.427 85 HA ASP 11 HA ASP 11 -12.501 -6.850 -7.112 86 HB2 ASP 11 2HB ASP 11 -14.939 -7.259 -7.140 87 HB3 ASP 11 1HB ASP 11 -14.831 -7.774 -8.821 88 H ASP 12 H ASP 12 -11.360 -8.788 -7.680 89 HA ASP 12 HA ASP 12 -9.897 -8.215 -10.051 90 HB2 ASP 12 2HB ASP 12 -8.297 -9.884 -9.303 91 HB3 ASP 12 1HB ASP 12 -8.711 -8.782 -7.999 92 H GLY 13 H GLY 13 -12.632 -10.064 -9.477 93 HA2 GLY 13 2HA GLY 13 -11.930 -12.178 -11.350 94 HA3 GLY 13 1HA GLY 13 -13.421 -12.027 -10.429 95 H ASN 14 H ASN 14 -12.942 -9.071 -11.562 96 HA ASN 14 HA ASN 14 -14.938 -9.331 -13.613 97 HB2 ASN 14 2HB ASN 14 -13.326 -6.937 -12.706 98 HB3 ASN 14 1HB ASN 14 -14.573 -6.868 -13.939 99 HD21 ASN 14 1HD2 ASN 14 -14.385 -5.510 -11.391 100 HD22 ASN 14 2HD2 ASN 14 -15.816 -5.956 -10.504 101 H ASP 15 H ASP 15 -14.451 -7.912 -15.676 102 HA ASP 15 HA ASP 15 -12.128 -9.155 -16.903 103 HB2 ASP 15 2HB ASP 15 -14.467 -7.708 -18.147 104 HB3 ASP 15 1HB ASP 15 -13.089 -8.284 -19.074 105 H GLY 16 H GLY 16 -12.654 -6.395 -15.322 106 HA2 GLY 16 2HA GLY 16 -11.182 -4.675 -14.952 107 HA3 GLY 16 1HA GLY 16 -10.170 -5.346 -16.226 108 H SER 17 H SER 17 -13.477 -4.435 -16.648 109 HA SER 17 HA SER 17 -12.829 -2.545 -18.703 110 HB2 SER 17 2HB SER 17 -15.461 -3.008 -17.283 111 HB3 SER 17 1HB SER 17 -15.219 -2.334 -18.893 112 HG SER 17 HG SER 17 -14.370 -4.390 -19.521 113 H GLU 18 H GLU 18 -13.795 -0.181 -18.432 114 HA GLU 18 HA GLU 18 -12.758 0.967 -16.167 115 HB2 GLU 18 2HB GLU 18 -13.083 2.245 -18.197 116 HB3 GLU 18 1HB GLU 18 -14.825 2.034 -18.112 117 HG2 GLU 18 2HG GLU 18 -14.850 3.337 -16.017 118 HG3 GLU 18 1HG GLU 18 -13.095 3.480 -16.208 119 H LEU 19 H LEU 19 -16.001 -0.095 -17.002 120 HA LEU 19 HA LEU 19 -17.230 0.877 -14.619 121 HB2 LEU 19 2HB LEU 19 -18.257 -0.952 -16.778 122 HB3 LEU 19 1HB LEU 19 -19.212 -0.349 -15.444 123 HG LEU 19 HG LEU 19 -19.768 0.862 -17.317 124 HD11 LEU 19 1HD1 LEU 19 -19.655 2.206 -15.346 125 HD12 LEU 19 2HD1 LEU 19 -19.212 3.186 -16.742 126 HD13 LEU 19 3HD1 LEU 19 -17.960 2.583 -15.654 127 HD21 LEU 19 3HD2 LEU 19 -17.905 0.446 -18.801 128 HD22 LEU 19 1HD2 LEU 19 -16.856 1.466 -17.813 129 HD23 LEU 19 2HD2 LEU 19 -18.189 2.185 -18.706 130 H LYS 20 H LYS 20 -15.329 -1.780 -15.336 131 HA LYS 20 HA LYS 20 -16.146 -3.252 -12.880 132 HB2 LYS 20 2HB LYS 20 -15.420 -4.636 -15.469 133 HB3 LYS 20 1HB LYS 20 -15.959 -5.337 -13.976 134 HG2 LYS 20 2HG LYS 20 -18.217 -4.467 -14.262 135 HG3 LYS 20 1HG LYS 20 -17.722 -3.661 -15.750 136 HD2 LYS 20 2HD LYS 20 -17.228 -5.789 -16.791 137 HD3 LYS 20 1HD LYS 20 -17.579 -6.615 -15.272 138 HE2 LYS 20 2HE LYS 20 -19.580 -5.033 -16.880 139 HE3 LYS 20 1HE LYS 20 -19.416 -6.788 -16.903 140 HZ1 LYS 20 3HZ LYS 20 -21.171 -6.148 -15.424 141 HZ2 LYS 20 1HZ LYS 20 -20.157 -5.127 -14.551 142 HZ3 LYS 20 2HZ LYS 20 -19.925 -6.805 -14.520 143 HA PRO 21 HA PRO 21 -11.706 -2.406 -13.530 144 HB2 PRO 21 2HB PRO 21 -11.205 -1.200 -11.157 145 HB3 PRO 21 1HB PRO 21 -11.750 -0.330 -12.592 146 HG2 PRO 21 2HG PRO 21 -13.303 -1.172 -10.193 147 HG3 PRO 21 1HG PRO 21 -13.450 0.296 -11.171 148 HD2 PRO 21 2HD PRO 21 -15.106 -1.896 -11.361 149 HD3 PRO 21 1HD PRO 21 -14.854 -0.709 -12.655 150 H LEU 22 H LEU 22 -9.999 -3.470 -12.649 151 HA LEU 22 HA LEU 22 -10.727 -5.785 -11.105 152 HB2 LEU 22 2HB LEU 22 -8.114 -4.928 -12.301 153 HB3 LEU 22 1HB LEU 22 -8.381 -6.445 -11.466 154 HG LEU 22 HG LEU 22 -9.776 -5.594 -13.988 155 HD11 LEU 22 1HD1 LEU 22 -8.443 -7.294 -15.043 156 HD12 LEU 22 2HD1 LEU 22 -7.599 -7.594 -13.523 157 HD13 LEU 22 3HD1 LEU 22 -7.433 -6.037 -14.336 158 HD21 LEU 22 3HD2 LEU 22 -9.812 -8.175 -12.453 159 HD22 LEU 22 1HD2 LEU 22 -10.541 -7.907 -14.035 160 HD23 LEU 22 2HD2 LEU 22 -11.156 -7.046 -12.629 161 H ARG 23 H ARG 23 -10.087 -6.249 -9.173 162 HA ARG 23 HA ARG 23 -9.378 -4.046 -7.507 163 HB2 ARG 23 2HB ARG 23 -11.023 -5.375 -6.692 164 HB3 ARG 23 1HB ARG 23 -10.244 -6.882 -7.019 165 HG2 ARG 23 2HG ARG 23 -8.664 -6.356 -5.289 166 HG3 ARG 23 1HG ARG 23 -9.567 -4.871 -4.868 167 HD2 ARG 23 2HD ARG 23 -10.461 -7.747 -4.765 168 HD3 ARG 23 1HD ARG 23 -10.199 -6.685 -3.377 169 HE ARG 23 HE ARG 23 -12.132 -5.536 -5.064 170 HH11 ARG 23 1HH1 ARG 23 -11.795 -8.287 -2.855 171 HH12 ARG 23 2HH1 ARG 23 -13.460 -8.407 -2.535 172 HH21 ARG 23 1HH2 ARG 23 -14.416 -5.702 -4.610 173 HH22 ARG 23 2HH2 ARG 23 -14.964 -6.927 -3.550 174 H THR 24 H THR 24 -7.583 -6.396 -9.193 175 HA THR 24 HA THR 24 -5.246 -5.719 -7.583 176 HB THR 24 HB THR 24 -4.338 -7.990 -8.145 177 HG1 THR 24 1HG THR 24 -6.151 -9.546 -8.648 178 HG21 THR 24 3HG2 THR 24 -5.642 -9.233 -6.465 179 HG22 THR 24 1HG2 THR 24 -6.911 -8.011 -6.548 180 HG23 THR 24 2HG2 THR 24 -5.316 -7.587 -5.923 181 H LEU 25 H LEU 25 -3.366 -5.315 -8.757 182 HA LEU 25 HA LEU 25 -3.668 -4.683 -11.529 183 HB2 LEU 25 2HB LEU 25 -2.254 -3.359 -10.019 184 HB3 LEU 25 1HB LEU 25 -1.255 -4.757 -9.717 185 HG LEU 25 HG LEU 25 -0.401 -4.695 -11.993 186 HD11 LEU 25 1HD1 LEU 25 -2.398 -3.871 -13.143 187 HD12 LEU 25 2HD1 LEU 25 -0.992 -2.884 -13.520 188 HD13 LEU 25 3HD1 LEU 25 -2.203 -2.296 -12.383 189 HD21 LEU 25 3HD2 LEU 25 0.773 -2.528 -11.853 190 HD22 LEU 25 1HD2 LEU 25 0.719 -3.373 -10.302 191 HD23 LEU 25 2HD2 LEU 25 -0.370 -2.026 -10.618 192 H TYR 26 H TYR 26 -2.575 -7.300 -9.609 193 HA TYR 26 HA TYR 26 -1.069 -8.839 -11.319 194 HB2 TYR 26 2HB TYR 26 -1.343 -9.325 -8.980 195 HB3 TYR 26 1HB TYR 26 -3.064 -9.612 -9.194 196 HD1 TYR 26 1HD TYR 26 0.219 -10.777 -10.403 197 HD2 TYR 26 2HD TYR 26 -3.770 -11.800 -9.428 198 HE1 TYR 26 1HE TYR 26 0.758 -13.076 -10.762 199 HE2 TYR 26 2HE TYR 26 -3.260 -14.172 -9.810 200 HH TYR 26 HH TYR 26 -1.647 -15.503 -11.062 201 H GLN 27 H GLN 27 -4.640 -8.834 -10.937 202 HA GLN 27 HA GLN 27 -5.060 -10.866 -12.832 203 HB2 GLN 27 2HB GLN 27 -6.780 -10.254 -11.217 204 HB3 GLN 27 1HB GLN 27 -6.949 -8.670 -11.948 205 HG2 GLN 27 2HG GLN 27 -8.774 -10.112 -12.646 206 HG3 GLN 27 1HG GLN 27 -7.751 -9.730 -14.020 207 HE21 GLN 27 1HE2 GLN 27 -8.431 -11.497 -15.149 208 HE22 GLN 27 2HE2 GLN 27 -7.976 -13.110 -14.821 209 H ALA 28 H ALA 28 -4.894 -7.346 -13.159 210 HA ALA 28 HA ALA 28 -5.704 -7.051 -15.770 211 HB1 ALA 28 1HB ALA 28 -5.342 -5.224 -14.170 212 HB2 ALA 28 2HB ALA 28 -4.460 -4.942 -15.668 213 HB3 ALA 28 3HB ALA 28 -3.607 -5.511 -14.231 214 H MET 29 H MET 29 -2.495 -7.726 -14.409 215 HA MET 29 HA MET 29 -1.298 -7.774 -16.922 216 HB2 MET 29 2HB MET 29 -0.286 -8.723 -14.256 217 HB3 MET 29 1HB MET 29 0.674 -8.555 -15.724 218 HG2 MET 29 2HG MET 29 0.149 -6.165 -15.798 219 HG3 MET 29 1HG MET 29 -0.750 -6.312 -14.280 220 HE1 MET 29 3HE MET 29 3.766 -6.486 -14.892 221 HE2 MET 29 1HE MET 29 2.579 -5.951 -16.086 222 HE3 MET 29 2HE MET 29 2.697 -7.676 -15.669 223 H ILE 30 H ILE 30 -2.789 -10.238 -14.927 224 HA ILE 30 HA ILE 30 -1.890 -12.520 -16.342 225 HB ILE 30 HB ILE 30 -4.636 -12.094 -15.122 226 HG12 ILE 30 2HG1 ILE 30 -2.205 -13.454 -13.956 227 HG13 ILE 30 1HG1 ILE 30 -2.864 -11.899 -13.438 228 HG21 ILE 30 1HG2 ILE 30 -4.827 -14.543 -15.076 229 HG22 ILE 30 2HG2 ILE 30 -3.293 -14.674 -15.935 230 HG23 ILE 30 3HG2 ILE 30 -4.685 -13.920 -16.716 231 HD11 ILE 30 3HD1 ILE 30 -4.913 -13.035 -12.729 232 HD12 ILE 30 1HD1 ILE 30 -3.489 -13.686 -11.919 233 HD13 ILE 30 2HD1 ILE 30 -4.230 -14.574 -13.248 234 H ILE 31 H ILE 31 -4.857 -10.622 -16.725 235 HA ILE 31 HA ILE 31 -5.975 -11.946 -18.870 236 HB ILE 31 HB ILE 31 -6.248 -8.983 -18.298 237 HG12 ILE 31 2HG1 ILE 31 -7.833 -11.339 -17.268 238 HG13 ILE 31 1HG1 ILE 31 -6.717 -10.355 -16.322 239 HG21 ILE 31 1HG2 ILE 31 -7.107 -9.738 -20.479 240 HG22 ILE 31 2HG2 ILE 31 -8.430 -9.280 -19.366 241 HG23 ILE 31 3HG2 ILE 31 -8.032 -10.984 -19.607 242 HD11 ILE 31 3HD1 ILE 31 -8.131 -8.415 -16.710 243 HD12 ILE 31 1HD1 ILE 31 -9.016 -9.722 -15.897 244 HD13 ILE 31 2HD1 ILE 31 -9.236 -9.440 -17.630 245 H THR 32 H THR 32 -3.639 -9.287 -18.845 246 HA THR 32 HA THR 32 -3.764 -9.045 -21.680 247 HB THR 32 HB THR 32 -1.902 -7.399 -21.332 248 HG1 THR 32 1HG THR 32 -2.400 -7.478 -18.604 249 HG21 THR 32 3HG2 THR 32 -4.326 -6.986 -19.541 250 HG22 THR 32 1HG2 THR 32 -4.287 -6.704 -21.273 251 HG23 THR 32 2HG2 THR 32 -3.289 -5.728 -20.201 252 H LYS 33 H LYS 33 -1.506 -10.378 -19.221 253 HA LYS 33 HA LYS 33 0.184 -11.720 -19.256 254 HB2 LYS 33 2HB LYS 33 -1.516 -13.148 -20.399 255 HB3 LYS 33 1HB LYS 33 -0.853 -12.625 -21.944 256 HG2 LYS 33 2HG LYS 33 1.295 -13.520 -21.291 257 HG3 LYS 33 1HG LYS 33 0.578 -14.092 -19.787 258 HD2 LYS 33 2HD LYS 33 -0.299 -14.958 -22.553 259 HD3 LYS 33 1HD LYS 33 0.735 -15.907 -21.477 260 HE2 LYS 33 2HE LYS 33 -1.074 -16.015 -19.830 261 HE3 LYS 33 1HE LYS 33 -2.091 -15.031 -20.877 262 HZ1 LYS 33 3HZ LYS 33 -1.054 -17.734 -21.558 263 HZ2 LYS 33 1HZ LYS 33 -2.025 -16.765 -22.531 264 HZ3 LYS 33 2HZ LYS 33 -2.629 -17.376 -21.086 265 H SER 34 H SER 34 0.160 -9.093 -20.761 266 HA SER 34 HA SER 34 2.273 -9.537 -22.718 267 HB2 SER 34 2HB SER 34 0.311 -8.097 -23.315 268 HB3 SER 34 1HB SER 34 0.824 -6.972 -22.060 269 HG SER 34 HG SER 34 2.947 -7.151 -23.358 270 H SER 35 H SER 35 2.095 -8.863 -19.465 271 HA SER 35 HA SER 35 3.424 -7.955 -17.855 272 HB2 SER 35 2HB SER 35 5.906 -8.262 -18.139 273 HB3 SER 35 1HB SER 35 4.987 -9.706 -18.541 274 HG SER 35 HG SER 35 5.144 -8.768 -20.801 275 H LYS 36 H LYS 36 2.464 -6.133 -20.113 276 HA LYS 36 HA LYS 36 3.578 -3.730 -19.355 277 HB2 LYS 36 2HB LYS 36 5.476 -4.566 -20.715 278 HB3 LYS 36 1HB LYS 36 4.371 -4.924 -22.029 279 HG2 LYS 36 2HG LYS 36 3.856 -2.534 -22.207 280 HG3 LYS 36 1HG LYS 36 5.041 -2.206 -20.939 281 HD2 LYS 36 2HD LYS 36 6.808 -3.149 -22.321 282 HD3 LYS 36 1HD LYS 36 5.626 -3.545 -23.574 283 HE2 LYS 36 2HE LYS 36 5.116 -1.168 -23.834 284 HE3 LYS 36 1HE LYS 36 6.302 -0.788 -22.588 285 HZ1 LYS 36 3HZ LYS 36 7.202 -0.477 -24.812 286 HZ2 LYS 36 1HZ LYS 36 6.882 -2.083 -25.189 287 HZ3 LYS 36 2HZ LYS 36 8.032 -1.703 -24.014 288 H GLY 37 H GLY 37 2.352 -2.183 -20.456 289 HA2 GLY 37 2HA GLY 37 0.829 -2.066 -22.574 290 HA3 GLY 37 1HA GLY 37 -0.135 -3.179 -21.595 291 H ASP 38 H ASP 38 -1.716 -1.378 -21.838 292 HA ASP 38 HA ASP 38 -1.068 0.798 -20.035 293 HB2 ASP 38 2HB ASP 38 -3.499 0.414 -21.791 294 HB3 ASP 38 1HB ASP 38 -3.286 1.755 -20.677 295 H PHE 39 H PHE 39 -1.350 0.508 -18.053 296 HA PHE 39 HA PHE 39 -3.684 -0.973 -17.123 297 HB2 PHE 39 2HB PHE 39 -0.919 -0.885 -15.873 298 HB3 PHE 39 1HB PHE 39 -2.321 -1.687 -15.179 299 HD1 PHE 39 1HD PHE 39 -3.440 -3.460 -16.744 300 HD2 PHE 39 2HD PHE 39 0.602 -2.176 -17.123 301 HE1 PHE 39 1HE PHE 39 -2.883 -5.521 -17.946 302 HE2 PHE 39 2HE PHE 39 1.145 -4.214 -18.323 303 HZ PHE 39 HZ PHE 39 -0.583 -5.899 -18.743 304 H LEU 40 H LEU 40 -5.007 0.477 -16.327 305 HA LEU 40 HA LEU 40 -3.805 2.904 -15.191 306 HB2 LEU 40 2HB LEU 40 -6.581 2.607 -16.344 307 HB3 LEU 40 1HB LEU 40 -5.747 4.031 -15.731 308 HG LEU 40 HG LEU 40 -4.909 2.538 -18.208 309 HD11 LEU 40 1HD1 LEU 40 -6.424 5.126 -17.937 310 HD12 LEU 40 2HD1 LEU 40 -7.066 3.602 -18.544 311 HD13 LEU 40 3HD1 LEU 40 -5.802 4.445 -19.439 312 HD21 LEU 40 3HD2 LEU 40 -3.071 3.691 -17.112 313 HD22 LEU 40 1HD2 LEU 40 -4.014 5.177 -17.046 314 HD23 LEU 40 2HD2 LEU 40 -3.508 4.521 -18.603 315 H ILE 41 H ILE 41 -4.087 3.205 -13.112 316 HA ILE 41 HA ILE 41 -6.092 1.547 -11.795 317 HB ILE 41 HB ILE 41 -3.559 2.705 -10.596 318 HG12 ILE 41 2HG1 ILE 41 -4.166 -0.018 -11.819 319 HG13 ILE 41 1HG1 ILE 41 -2.873 1.083 -12.125 320 HG21 ILE 41 1HG2 ILE 41 -5.561 0.743 -9.483 321 HG22 ILE 41 2HG2 ILE 41 -5.374 2.418 -8.990 322 HG23 ILE 41 3HG2 ILE 41 -4.073 1.258 -8.673 323 HD11 ILE 41 3HD1 ILE 41 -1.740 0.498 -10.117 324 HD12 ILE 41 1HD1 ILE 41 -2.306 -0.970 -10.952 325 HD13 ILE 41 2HD1 ILE 41 -3.187 -0.398 -9.562 326 H ARG 42 H ARG 42 -7.560 2.423 -10.543 327 HA ARG 42 HA ARG 42 -8.226 5.159 -10.896 328 HB2 ARG 42 2HB ARG 42 -9.790 3.181 -10.507 329 HB3 ARG 42 1HB ARG 42 -9.364 3.320 -8.815 330 HG2 ARG 42 2HG ARG 42 -11.458 4.482 -9.122 331 HG3 ARG 42 1HG ARG 42 -10.197 5.662 -8.874 332 HD2 ARG 42 2HD ARG 42 -10.367 6.531 -10.918 333 HD3 ARG 42 1HD ARG 42 -10.689 4.969 -11.721 334 HE ARG 42 HE ARG 42 -12.861 5.809 -10.146 335 HH11 ARG 42 1HH1 ARG 42 -11.228 6.694 -13.184 336 HH12 ARG 42 2HH1 ARG 42 -12.615 7.318 -13.911 337 HH21 ARG 42 1HH2 ARG 42 -14.768 6.674 -11.169 338 HH22 ARG 42 2HH2 ARG 42 -14.697 7.299 -12.745 339 H THR 43 H THR 43 -7.715 6.779 -9.736 340 HA THR 43 HA THR 43 -6.740 6.447 -7.015 341 HB THR 43 HB THR 43 -4.807 6.665 -8.560 342 HG1 THR 43 1HG THR 43 -3.806 7.927 -7.234 343 HG21 THR 43 3HG2 THR 43 -5.999 9.337 -9.268 344 HG22 THR 43 1HG2 THR 43 -5.806 7.951 -10.345 345 HG23 THR 43 2HG2 THR 43 -4.386 8.792 -9.723 346 H LYS 44 H LYS 44 -7.196 8.358 -5.753 347 HA LYS 44 HA LYS 44 -9.124 10.062 -7.113 348 HB2 LYS 44 2HB LYS 44 -10.123 8.798 -5.313 349 HB3 LYS 44 1HB LYS 44 -8.911 9.417 -4.187 350 HG2 LYS 44 2HG LYS 44 -9.828 11.635 -4.379 351 HG3 LYS 44 1HG LYS 44 -10.946 11.100 -5.632 352 HD2 LYS 44 2HD LYS 44 -12.090 9.662 -4.081 353 HD3 LYS 44 1HD LYS 44 -10.902 10.009 -2.827 354 HE2 LYS 44 2HE LYS 44 -12.692 12.060 -4.097 355 HE3 LYS 44 1HE LYS 44 -13.041 11.257 -2.567 356 HZ1 LYS 44 3HZ LYS 44 -11.001 12.214 -1.669 357 HZ2 LYS 44 1HZ LYS 44 -12.030 13.406 -2.212 358 HZ3 LYS 44 2HZ LYS 44 -10.685 12.990 -3.128 359 H LYS 45 H LYS 45 -8.419 11.783 -7.636 360 HA LYS 45 HA LYS 45 -6.312 13.187 -6.134 361 HB2 LYS 45 2HB LYS 45 -5.439 11.789 -8.177 362 HB3 LYS 45 1HB LYS 45 -6.437 12.845 -9.108 363 HG2 LYS 45 2HG LYS 45 -5.132 14.728 -8.588 364 HG3 LYS 45 1HG LYS 45 -4.194 13.825 -7.397 365 HD2 LYS 45 2HD LYS 45 -4.444 13.039 -10.235 366 HD3 LYS 45 1HD LYS 45 -3.068 14.053 -9.687 367 HE2 LYS 45 2HE LYS 45 -2.524 12.104 -8.152 368 HE3 LYS 45 1HE LYS 45 -3.804 11.190 -8.933 369 HZ1 LYS 45 3HZ LYS 45 -1.746 10.601 -9.955 370 HZ2 LYS 45 1HZ LYS 45 -1.347 12.220 -10.253 371 HZ3 LYS 45 2HZ LYS 45 -2.631 11.482 -11.043 372 H ASP 46 H ASP 46 -6.745 15.361 -6.048 373 HA ASP 46 HA ASP 46 -7.823 17.378 -6.294 374 HB2 ASP 46 2HB ASP 46 -6.914 17.187 -8.607 375 HB3 ASP 46 1HB ASP 46 -8.325 16.272 -9.090 376 H GLY 47 H GLY 47 -9.206 15.051 -5.271 377 HA2 GLY 47 2HA GLY 47 -11.269 14.657 -4.343 378 HA3 GLY 47 1HA GLY 47 -11.861 16.096 -5.150 379 H LYS 48 H LYS 48 -10.416 14.064 -7.402 380 HA LYS 48 HA LYS 48 -13.044 12.959 -8.138 381 HB2 LYS 48 2HB LYS 48 -10.867 13.999 -9.959 382 HB3 LYS 48 1HB LYS 48 -12.426 13.353 -10.460 383 HG2 LYS 48 2HG LYS 48 -13.578 15.191 -9.420 384 HG3 LYS 48 1HG LYS 48 -12.070 15.797 -8.747 385 HD2 LYS 48 2HD LYS 48 -11.231 16.145 -11.041 386 HD3 LYS 48 1HD LYS 48 -12.795 15.620 -11.669 387 HE2 LYS 48 2HE LYS 48 -12.648 18.062 -11.583 388 HE3 LYS 48 1HE LYS 48 -13.896 17.456 -10.498 389 HZ1 LYS 48 3HZ LYS 48 -12.550 19.184 -9.445 390 HZ2 LYS 48 1HZ LYS 48 -11.147 18.276 -9.661 391 HZ3 LYS 48 2HZ LYS 48 -12.354 17.726 -8.637 392 H GLN 49 H GLN 49 -13.001 10.846 -9.045 393 HA GLN 49 HA GLN 49 -10.589 9.406 -8.510 394 HB2 GLN 49 2HB GLN 49 -13.329 8.429 -9.399 395 HB3 GLN 49 1HB GLN 49 -11.969 7.413 -9.010 396 HG2 GLN 49 2HG GLN 49 -13.323 7.275 -7.124 397 HG3 GLN 49 1HG GLN 49 -12.082 8.420 -6.656 398 HE21 GLN 49 1HE2 GLN 49 -14.701 7.979 -5.560 399 HE22 GLN 49 2HE2 GLN 49 -15.578 9.453 -5.656 400 H VAL 50 H VAL 50 -9.225 8.990 -10.049 401 HA VAL 50 HA VAL 50 -10.115 9.175 -12.827 402 HB VAL 50 HB VAL 50 -7.990 10.389 -13.407 403 HG11 VAL 50 1HG1 VAL 50 -8.695 12.597 -12.616 404 HG12 VAL 50 2HG1 VAL 50 -9.753 11.834 -11.432 405 HG13 VAL 50 3HG1 VAL 50 -10.084 11.649 -13.159 406 HG21 VAL 50 3HG2 VAL 50 -6.744 11.516 -11.616 407 HG22 VAL 50 1HG2 VAL 50 -6.673 9.762 -11.443 408 HG23 VAL 50 2HG2 VAL 50 -7.747 10.700 -10.417 409 H TRP 51 H TRP 51 -8.258 8.385 -14.276 410 HA TRP 51 HA TRP 51 -7.265 5.899 -13.114 411 HB2 TRP 51 2HB TRP 51 -7.671 6.790 -15.957 412 HB3 TRP 51 1HB TRP 51 -7.023 5.235 -15.573 413 HD1 TRP 51 HD TRP 51 -9.987 6.743 -16.560 414 HE1 TRP 51 1HE TRP 51 -12.093 5.359 -15.983 415 HE3 TRP 51 3HE TRP 51 -7.897 3.589 -13.179 416 HZ2 TRP 51 2HZ TRP 51 -12.747 3.176 -14.255 417 HZ3 TRP 51 3HZ TRP 51 -9.308 1.882 -12.117 418 HH2 TRP 51 HH TRP 51 -11.681 1.690 -12.645 419 H GLU 52 H GLU 52 -5.151 5.765 -12.634 420 HA GLU 52 HA GLU 52 -3.289 7.603 -13.979 421 HB2 GLU 52 2HB GLU 52 -3.566 7.969 -11.536 422 HB3 GLU 52 1HB GLU 52 -3.074 6.310 -11.251 423 HG2 GLU 52 2HG GLU 52 -0.881 6.804 -12.218 424 HG3 GLU 52 1HG GLU 52 -1.380 8.478 -12.465 425 H ALA 53 H ALA 53 -1.536 6.699 -14.943 426 HA ALA 53 HA ALA 53 -1.654 3.954 -15.639 427 HB1 ALA 53 1HB ALA 53 0.591 5.923 -16.068 428 HB2 ALA 53 2HB ALA 53 -0.774 5.676 -17.156 429 HB3 ALA 53 3HB ALA 53 0.391 4.378 -16.893 430 H ALA 54 H ALA 54 -0.679 2.245 -14.846 431 HA ALA 54 HA ALA 54 0.675 2.339 -12.362 432 HB1 ALA 54 1HB ALA 54 0.449 0.071 -14.341 433 HB2 ALA 54 2HB ALA 54 -0.689 0.415 -13.044 434 HB3 ALA 54 3HB ALA 54 0.965 -0.074 -12.659 435 H SER 55 H SER 55 2.863 1.419 -12.031 436 HA SER 55 HA SER 55 4.647 2.522 -14.067 437 HB2 SER 55 2HB SER 55 5.107 2.168 -11.091 438 HB3 SER 55 1HB SER 55 6.142 3.034 -12.227 439 HG SER 55 HG SER 55 3.702 3.730 -11.123 440 H LYS 56 H LYS 56 6.630 1.315 -14.414 441 HA LYS 56 HA LYS 56 6.267 -1.435 -14.737 442 HB2 LYS 56 2HB LYS 56 7.868 -0.114 -16.018 443 HB3 LYS 56 1HB LYS 56 8.888 0.026 -14.583 444 HG2 LYS 56 2HG LYS 56 9.180 -2.373 -14.515 445 HG3 LYS 56 1HG LYS 56 8.102 -2.563 -15.891 446 HD2 LYS 56 2HD LYS 56 10.674 -1.064 -15.875 447 HD3 LYS 56 1HD LYS 56 10.468 -2.728 -16.477 448 HE2 LYS 56 2HE LYS 56 8.823 -1.828 -18.127 449 HE3 LYS 56 1HE LYS 56 9.208 -0.201 -17.570 450 HZ1 LYS 56 3HZ LYS 56 11.096 -2.104 -18.811 451 HZ2 LYS 56 1HZ LYS 56 11.505 -0.555 -18.283 452 HZ3 LYS 56 2HZ LYS 56 10.413 -0.769 -19.562 453 H THR 57 H THR 57 7.668 0.297 -12.050 454 HA THR 57 HA THR 57 8.718 -1.939 -10.725 455 HB THR 57 HB THR 57 8.450 -0.414 -8.669 456 HG1 THR 57 1HG THR 57 8.151 1.710 -10.404 457 HG21 THR 57 3HG2 THR 57 9.964 0.585 -11.092 458 HG22 THR 57 1HG2 THR 57 10.540 -0.627 -9.944 459 HG23 THR 57 2HG2 THR 57 10.280 1.032 -9.413 460 H ALA 58 H ALA 58 5.526 -0.426 -10.548 461 HA ALA 58 HA ALA 58 4.539 -2.227 -8.540 462 HB1 ALA 58 1HB ALA 58 3.005 -0.429 -10.429 463 HB2 ALA 58 2HB ALA 58 3.582 0.026 -8.826 464 HB3 ALA 58 3HB ALA 58 2.347 -1.222 -8.998 465 H LEU 59 H LEU 59 4.514 -2.060 -12.015 466 HA LEU 59 HA LEU 59 2.794 -4.232 -12.500 467 HB2 LEU 59 2HB LEU 59 4.957 -2.892 -14.077 468 HB3 LEU 59 1HB LEU 59 3.952 -4.214 -14.748 469 HG LEU 59 HG LEU 59 3.043 -1.479 -13.822 470 HD11 LEU 59 1HD1 LEU 59 4.369 -1.393 -15.880 471 HD12 LEU 59 2HD1 LEU 59 2.667 -1.058 -16.198 472 HD13 LEU 59 3HD1 LEU 59 3.342 -2.637 -16.594 473 HD21 LEU 59 3HD2 LEU 59 0.908 -2.098 -14.790 474 HD22 LEU 59 1HD2 LEU 59 1.355 -3.261 -13.545 475 HD23 LEU 59 2HD2 LEU 59 1.563 -3.676 -15.240 476 H LYS 60 H LYS 60 6.312 -3.982 -12.106 477 HA LYS 60 HA LYS 60 6.880 -6.663 -12.662 478 HB2 LYS 60 2HB LYS 60 8.633 -4.964 -12.582 479 HB3 LYS 60 1HB LYS 60 8.401 -4.765 -10.832 480 HG2 LYS 60 2HG LYS 60 10.353 -6.028 -11.314 481 HG3 LYS 60 1HG LYS 60 9.142 -7.091 -10.589 482 HD2 LYS 60 2HD LYS 60 8.520 -7.900 -12.805 483 HD3 LYS 60 1HD LYS 60 9.727 -6.830 -13.533 484 HE2 LYS 60 2HE LYS 60 10.238 -8.972 -11.552 485 HE3 LYS 60 1HE LYS 60 10.479 -9.147 -13.307 486 HZ1 LYS 60 3HZ LYS 60 12.135 -7.342 -13.142 487 HZ2 LYS 60 1HZ LYS 60 12.564 -8.681 -12.221 488 HZ3 LYS 60 2HZ LYS 60 11.946 -7.312 -11.460 489 H LYS 61 H LYS 61 5.818 -5.049 -9.737 490 HA LYS 61 HA LYS 61 6.176 -7.148 -7.931 491 HB2 LYS 61 2HB LYS 61 5.854 -4.911 -7.112 492 HB3 LYS 61 1HB LYS 61 4.389 -4.706 -8.030 493 HG2 LYS 61 2HG LYS 61 4.593 -6.594 -5.677 494 HG3 LYS 61 1HG LYS 61 4.168 -4.890 -5.517 495 HD2 LYS 61 2HD LYS 61 2.266 -5.243 -7.032 496 HD3 LYS 61 1HD LYS 61 2.684 -6.943 -7.153 497 HE2 LYS 61 2HE LYS 61 0.857 -6.665 -5.571 498 HE3 LYS 61 1HE LYS 61 2.304 -7.188 -4.715 499 HZ1 LYS 61 3HZ LYS 61 1.284 -4.395 -4.843 500 HZ2 LYS 61 1HZ LYS 61 2.661 -4.905 -4.011 501 HZ3 LYS 61 2HZ LYS 61 1.139 -5.434 -3.534 502 H SER 62 H SER 62 3.572 -6.361 -10.152 503 HA SER 62 HA SER 62 1.795 -8.353 -9.127 504 HB2 SER 62 2HB SER 62 1.726 -6.696 -11.652 505 HB3 SER 62 1HB SER 62 0.371 -7.581 -10.952 506 HG SER 62 HG SER 62 1.628 -5.245 -10.071 507 H TRP 63 H TRP 63 4.021 -7.999 -11.874 508 HA TRP 63 HA TRP 63 3.330 -10.434 -13.117 509 HB2 TRP 63 2HB TRP 63 4.332 -8.589 -14.349 510 HB3 TRP 63 1HB TRP 63 5.774 -8.666 -13.351 511 HD1 TRP 63 HD TRP 63 7.624 -10.231 -14.096 512 HE1 TRP 63 1HE TRP 63 7.952 -11.885 -16.079 513 HE3 TRP 63 3HE TRP 63 2.847 -10.307 -15.903 514 HZ2 TRP 63 2HZ TRP 63 6.390 -13.046 -18.102 515 HZ3 TRP 63 3HZ TRP 63 2.356 -11.750 -17.877 516 HH2 TRP 63 HH TRP 63 4.092 -13.059 -18.930 517 H LYS 64 H LYS 64 5.574 -9.545 -10.588 518 HA LYS 64 HA LYS 64 7.198 -11.836 -10.581 519 HB2 LYS 64 2HB LYS 64 7.708 -9.754 -9.387 520 HB3 LYS 64 1HB LYS 64 6.350 -10.059 -8.315 521 HG2 LYS 64 2HG LYS 64 7.454 -11.991 -7.403 522 HG3 LYS 64 1HG LYS 64 8.777 -11.815 -8.557 523 HD2 LYS 64 2HD LYS 64 9.413 -10.912 -6.390 524 HD3 LYS 64 1HD LYS 64 9.321 -9.649 -7.620 525 HE2 LYS 64 2HE LYS 64 7.122 -8.972 -6.782 526 HE3 LYS 64 1HE LYS 64 7.178 -10.258 -5.575 527 HZ1 LYS 64 3HZ LYS 64 7.789 -8.136 -4.626 528 HZ2 LYS 64 1HZ LYS 64 9.010 -7.924 -5.745 529 HZ3 LYS 64 2HZ LYS 64 9.117 -9.167 -4.608 530 H ARG 65 H ARG 65 4.036 -11.201 -9.254 531 HA ARG 65 HA ARG 65 3.832 -13.588 -7.695 532 HB2 ARG 65 2HB ARG 65 2.387 -11.482 -7.425 533 HB3 ARG 65 1HB ARG 65 1.647 -11.932 -8.918 534 HG2 ARG 65 2HG ARG 65 0.729 -13.935 -8.009 535 HG3 ARG 65 1HG ARG 65 1.573 -13.684 -6.480 536 HD2 ARG 65 2HD ARG 65 0.310 -11.648 -6.087 537 HD3 ARG 65 1HD ARG 65 -0.477 -11.808 -7.656 538 HE ARG 65 HE ARG 65 -0.945 -14.130 -6.221 539 HH11 ARG 65 1HH1 ARG 65 -1.838 -10.684 -5.995 540 HH12 ARG 65 2HH1 ARG 65 -3.343 -11.027 -5.254 541 HH21 ARG 65 1HH2 ARG 65 -3.012 -14.522 -5.194 542 HH22 ARG 65 2HH2 ARG 65 -4.001 -13.203 -4.778 543 H TYR 66 H TYR 66 3.024 -12.584 -10.927 544 HA TYR 66 HA TYR 66 1.509 -14.768 -11.860 545 HB2 TYR 66 2HB TYR 66 1.839 -12.461 -12.873 546 HB3 TYR 66 1HB TYR 66 3.409 -13.011 -13.419 547 HD1 TYR 66 2HD TYR 66 -0.200 -13.586 -13.690 548 HD2 TYR 66 1HD TYR 66 3.601 -14.218 -15.424 549 HE1 TYR 66 2HE TYR 66 -1.290 -14.392 -15.721 550 HE2 TYR 66 1HE TYR 66 2.555 -15.015 -17.479 551 HH TYR 66 HH TYR 66 0.432 -16.024 -18.171 552 H GLU 67 H GLU 67 4.971 -14.073 -11.935 553 HA GLU 67 HA GLU 67 6.080 -16.394 -13.161 554 HB2 GLU 67 2HB GLU 67 7.109 -14.825 -10.819 555 HB3 GLU 67 1HB GLU 67 8.057 -15.857 -11.883 556 HG2 GLU 67 2HG GLU 67 6.564 -13.457 -12.697 557 HG3 GLU 67 1HG GLU 67 8.268 -13.401 -12.248 558 H GLN 68 H GLN 68 5.435 -15.701 -9.740 559 HA GLN 68 HA GLN 68 6.368 -18.033 -8.712 560 HB2 GLN 68 2HB GLN 68 6.059 -16.089 -7.444 561 HB3 GLN 68 1HB GLN 68 4.371 -15.975 -7.911 562 HG2 GLN 68 2HG GLN 68 4.584 -16.584 -5.753 563 HG3 GLN 68 1HG GLN 68 3.898 -17.929 -6.695 564 HE21 GLN 68 1HE2 GLN 68 5.192 -19.805 -7.000 565 HE22 GLN 68 2HE2 GLN 68 6.558 -20.190 -6.023 566 H GLU 69 H GLU 69 3.164 -17.159 -9.920 567 HA GLU 69 HA GLU 69 1.967 -19.532 -8.976 568 HB2 GLU 69 2HB GLU 69 0.987 -17.552 -11.011 569 HB3 GLU 69 1HB GLU 69 0.009 -18.832 -10.295 570 HG2 GLU 69 2HG GLU 69 1.327 -16.584 -8.788 571 HG3 GLU 69 1HG GLU 69 -0.375 -16.668 -9.226 572 H MET 70 H MET 70 3.408 -18.613 -12.026 573 HA MET 70 HA MET 70 2.636 -21.043 -13.349 574 HB2 MET 70 2HB MET 70 4.801 -19.066 -14.024 575 HB3 MET 70 1HB MET 70 4.339 -20.415 -15.057 576 HG2 MET 70 2HG MET 70 2.097 -19.474 -15.275 577 HG3 MET 70 1HG MET 70 2.570 -18.123 -14.242 578 HE1 MET 70 3HE MET 70 5.298 -16.358 -16.392 579 HE2 MET 70 1HE MET 70 5.593 -17.679 -15.266 580 HE3 MET 70 2HE MET 70 4.440 -16.411 -14.847 581 H LEU 71 H LEU 71 5.471 -19.892 -11.659 582 HA LEU 71 HA LEU 71 7.147 -22.092 -12.042 583 HB2 LEU 71 2HB LEU 71 8.014 -20.013 -11.483 584 HB3 LEU 71 1HB LEU 71 7.045 -19.807 -10.066 585 HG LEU 71 HG LEU 71 8.378 -21.704 -9.054 586 HD11 LEU 71 1HD1 LEU 71 10.546 -22.237 -10.089 587 HD12 LEU 71 2HD1 LEU 71 10.100 -21.268 -11.497 588 HD13 LEU 71 3HD1 LEU 71 9.192 -22.725 -11.107 589 HD21 LEU 71 3HD2 LEU 71 8.817 -19.380 -8.510 590 HD22 LEU 71 1HD2 LEU 71 9.887 -19.238 -9.904 591 HD23 LEU 71 2HD2 LEU 71 10.320 -20.301 -8.563 592 H LYS 72 H LYS 72 4.516 -21.518 -9.944 593 HA LYS 72 HA LYS 72 4.800 -23.329 -7.825 594 HB2 LYS 72 2HB LYS 72 3.026 -21.652 -8.142 595 HB3 LYS 72 1HB LYS 72 2.338 -22.660 -9.404 596 HG2 LYS 72 2HG LYS 72 2.113 -24.470 -7.693 597 HG3 LYS 72 1HG LYS 72 2.559 -23.270 -6.475 598 HD2 LYS 72 2HD LYS 72 0.260 -23.131 -8.376 599 HD3 LYS 72 1HD LYS 72 0.162 -23.483 -6.638 600 HE2 LYS 72 2HE LYS 72 1.043 -21.218 -6.174 601 HE3 LYS 72 1HE LYS 72 1.117 -20.914 -7.909 602 HZ1 LYS 72 3HZ LYS 72 -1.296 -21.196 -8.004 603 HZ2 LYS 72 1HZ LYS 72 -0.850 -19.924 -7.029 604 HZ3 LYS 72 2HZ LYS 72 -1.337 -21.408 -6.327 605 H ASN 73 H ASN 73 3.790 -23.790 -11.160 606 HA ASN 73 HA ASN 73 2.745 -26.388 -10.855 607 HB2 ASN 73 2HB ASN 73 2.153 -24.868 -12.734 608 HB3 ASN 73 1HB ASN 73 3.783 -25.046 -13.364 609 HD21 ASN 73 1HD2 ASN 73 3.003 -25.880 -15.280 610 HD22 ASN 73 2HD2 ASN 73 2.359 -27.476 -15.424 611 H GLU 74 H GLU 74 3.595 -28.328 -11.729 612 HA GLU 74 HA GLU 74 5.006 -29.978 -11.878 613 HB2 GLU 74 2HB GLU 74 6.290 -28.707 -13.586 614 HB3 GLU 74 1HB GLU 74 7.230 -27.952 -12.310 615 HG2 GLU 74 2HG GLU 74 8.129 -30.142 -11.683 616 HG3 GLU 74 1HG GLU 74 7.187 -30.887 -12.970 617 H LYS 75 H LYS 75 4.286 -30.188 -9.819 618 HA LYS 75 HA LYS 75 4.430 -30.809 -7.676 619 HB2 LYS 75 2HB LYS 75 6.215 -32.286 -8.735 620 HB3 LYS 75 1HB LYS 75 7.390 -31.129 -8.150 621 HG2 LYS 75 2HG LYS 75 5.527 -32.681 -6.337 622 HG3 LYS 75 1HG LYS 75 7.138 -33.220 -6.767 623 HD2 LYS 75 2HD LYS 75 6.596 -30.587 -5.377 624 HD3 LYS 75 1HD LYS 75 6.830 -32.087 -4.496 625 HE2 LYS 75 2HE LYS 75 8.903 -30.803 -4.546 626 HE3 LYS 75 1HE LYS 75 9.092 -32.285 -5.460 627 HZ1 LYS 75 3HZ LYS 75 8.982 -31.028 -7.499 628 HZ2 LYS 75 1HZ LYS 75 10.107 -30.349 -6.476 629 HZ3 LYS 75 2HZ LYS 75 8.616 -29.592 -6.682 630 H VAL 76 H VAL 76 3.856 -28.989 -6.630 631 HA VAL 76 HA VAL 76 6.104 -27.513 -5.457 632 HB VAL 76 HB VAL 76 4.452 -26.090 -6.719 633 HG11 VAL 76 1HG1 VAL 76 2.385 -27.237 -6.247 634 HG12 VAL 76 2HG1 VAL 76 2.278 -25.560 -5.711 635 HG13 VAL 76 3HG1 VAL 76 2.536 -26.848 -4.537 636 HG21 VAL 76 3HG2 VAL 76 4.678 -25.518 -3.774 637 HG22 VAL 76 1HG2 VAL 76 4.267 -24.336 -5.013 638 HG23 VAL 76 2HG2 VAL 76 5.858 -25.097 -5.016 639 H ALA 77 H ALA 77 3.141 -29.253 -4.839 640 HA ALA 77 HA ALA 77 2.395 -30.478 -3.178 641 HB1 ALA 77 1HB ALA 77 3.853 -31.359 -1.475 642 HB2 ALA 77 2HB ALA 77 5.055 -30.113 -1.815 643 HB3 ALA 77 3HB ALA 77 4.699 -31.345 -3.026 644 H ALA 78 H ALA 78 4.203 -27.822 -1.643 645 HA ALA 78 HA ALA 78 2.094 -27.728 0.383 646 HB1 ALA 78 1HB ALA 78 3.619 -26.484 1.772 647 HB2 ALA 78 2HB ALA 78 4.784 -26.397 0.447 648 HB3 ALA 78 3HB ALA 78 4.393 -27.954 1.178 649 H LYS 79 H LYS 79 3.970 -25.305 -1.501 650 HA LYS 79 HA LYS 79 2.009 -23.309 -0.813 651 HB2 LYS 79 2HB LYS 79 4.394 -22.718 -0.966 652 HB3 LYS 79 1HB LYS 79 4.389 -23.140 -2.670 653 HG2 LYS 79 2HG LYS 79 2.899 -21.323 -3.162 654 HG3 LYS 79 1HG LYS 79 2.733 -20.945 -1.449 655 HD2 LYS 79 2HD LYS 79 5.115 -20.456 -1.335 656 HD3 LYS 79 1HD LYS 79 5.273 -20.806 -3.060 657 HE2 LYS 79 2HE LYS 79 3.767 -18.991 -3.596 658 HE3 LYS 79 1HE LYS 79 3.498 -18.665 -1.886 659 HZ1 LYS 79 3HZ LYS 79 5.861 -18.084 -1.702 660 HZ2 LYS 79 1HZ LYS 79 5.064 -17.119 -2.823 661 HZ3 LYS 79 2HZ LYS 79 6.072 -18.341 -3.357 662 H MET 80 H MET 80 0.107 -23.936 -1.679 663 HA MET 80 HA MET 80 -0.002 -24.467 -4.558 664 HB2 MET 80 2HB MET 80 -0.836 -26.209 -2.967 665 HB3 MET 80 1HB MET 80 -2.062 -25.089 -2.427 666 HG2 MET 80 2HG MET 80 -1.843 -26.157 -5.248 667 HG3 MET 80 1HG MET 80 -2.858 -26.859 -4.001 668 HE1 MET 80 3HE MET 80 -3.937 -26.099 -6.865 669 HE2 MET 80 1HE MET 80 -5.452 -25.288 -6.468 670 HE3 MET 80 2HE MET 80 -4.974 -26.738 -5.588 671 H LEU 81 H LEU 81 -1.524 -22.482 -2.037 672 HA LEU 81 HA LEU 81 -2.931 -20.740 -2.074 673 HB2 LEU 81 2HB LEU 81 -1.624 -20.177 -4.748 674 HB3 LEU 81 1HB LEU 81 -2.800 -19.101 -4.031 675 HG LEU 81 HG LEU 81 -0.631 -18.199 -3.678 676 HD11 LEU 81 1HD1 LEU 81 -2.157 -17.872 -1.856 677 HD12 LEU 81 2HD1 LEU 81 -0.504 -18.012 -1.264 678 HD13 LEU 81 3HD1 LEU 81 -1.614 -19.368 -1.092 679 HD21 LEU 81 3HD2 LEU 81 1.137 -19.359 -2.449 680 HD22 LEU 81 1HD2 LEU 81 0.716 -20.196 -3.941 681 HD23 LEU 81 2HD2 LEU 81 0.136 -20.813 -2.393 682 H GLU 82 H GLU 82 -4.781 -21.688 -1.956 683 HA GLU 82 HA GLU 82 -6.123 -22.796 -4.237 684 HB2 GLU 82 2HB GLU 82 -7.022 -22.411 -1.392 685 HB3 GLU 82 1HB GLU 82 -7.854 -23.366 -2.611 686 HG2 GLU 82 2HG GLU 82 -6.005 -24.897 -2.740 687 HG3 GLU 82 1HG GLU 82 -5.065 -23.912 -1.623 688 H LYS 83 H LYS 83 -7.365 -21.677 -5.525 689 HA LYS 83 HA LYS 83 -8.300 -19.037 -4.754 690 HB2 LYS 83 2HB LYS 83 -7.078 -19.380 -6.925 691 HB3 LYS 83 1HB LYS 83 -8.340 -20.471 -7.442 692 HG2 LYS 83 2HG LYS 83 -8.803 -17.543 -6.856 693 HG3 LYS 83 1HG LYS 83 -8.383 -18.159 -8.451 694 HD2 LYS 83 2HD LYS 83 -10.403 -19.525 -8.442 695 HD3 LYS 83 1HD LYS 83 -10.824 -18.910 -6.843 696 HE2 LYS 83 2HE LYS 83 -10.964 -16.648 -7.773 697 HE3 LYS 83 1HE LYS 83 -10.557 -17.281 -9.369 698 HZ1 LYS 83 3HZ LYS 83 -12.587 -18.600 -9.323 699 HZ2 LYS 83 1HZ LYS 83 -12.939 -16.970 -9.100 700 HZ3 LYS 83 2HZ LYS 83 -12.962 -18.008 -7.783 701 H ASP 84 H ASP 84 -10.410 -18.647 -4.296 702 HA ASP 84 HA ASP 84 -12.140 -20.877 -3.844 703 HB2 ASP 84 2HB ASP 84 -12.659 -17.918 -3.585 704 HB3 ASP 84 1HB ASP 84 -13.822 -19.159 -3.157 705 H ALA 85 H ALA 85 -13.386 -21.813 -5.264 706 HA ALA 85 HA ALA 85 -14.185 -20.423 -7.669 707 HB1 ALA 85 1HB ALA 85 -14.803 -23.218 -6.678 708 HB2 ALA 85 2HB ALA 85 -13.522 -22.790 -7.810 709 HB3 ALA 85 3HB ALA 85 -15.213 -22.590 -8.273 710 H THR 86 H THR 86 -16.044 -19.278 -7.747 711 HA THR 86 HA THR 86 -18.288 -20.115 -6.121 712 HB THR 86 HB THR 86 -17.137 -17.311 -5.943 713 HG1 THR 86 1HG THR 86 -16.735 -19.598 -4.560 714 HG21 THR 86 3HG2 THR 86 -18.877 -16.961 -4.227 715 HG22 THR 86 1HG2 THR 86 -19.494 -18.589 -4.522 716 HG23 THR 86 2HG2 THR 86 -19.600 -17.363 -5.784 717 H GLU 87 H GLU 87 -19.793 -20.339 -7.666 718 HA GLU 87 HA GLU 87 -20.326 -18.054 -9.387 719 HB2 GLU 87 2HB GLU 87 -19.074 -19.694 -10.738 720 HB3 GLU 87 1HB GLU 87 -20.221 -20.946 -10.300 721 HG2 GLU 87 2HG GLU 87 -20.566 -20.067 -12.576 722 HG3 GLU 87 1HG GLU 87 -21.971 -19.844 -11.535 723 H VAL 88 H VAL 88 -22.513 -17.812 -9.917 724 HA VAL 88 HA VAL 88 -24.253 -19.089 -7.942 725 HB VAL 88 HB VAL 88 -25.825 -17.240 -8.347 726 HG11 VAL 88 1HG1 VAL 88 -23.019 -16.301 -7.780 727 HG12 VAL 88 2HG1 VAL 88 -24.155 -16.968 -6.606 728 HG13 VAL 88 3HG1 VAL 88 -24.496 -15.421 -7.389 729 HG21 VAL 88 3HG2 VAL 88 -25.334 -16.783 -10.694 730 HG22 VAL 88 1HG2 VAL 88 -23.726 -16.204 -10.263 731 HG23 VAL 88 2HG2 VAL 88 -25.152 -15.309 -9.742 732 H GLY 89 H GLY 89 -26.594 -19.259 -8.723 733 HA2 GLY 89 2HA GLY 89 -26.579 -21.010 -10.999 734 HA3 GLY 89 1HA GLY 89 -27.939 -20.643 -9.945 735 H VAL 90 H VAL 90 -28.285 -20.806 -12.654 736 HA VAL 90 HA VAL 90 -28.346 -18.044 -13.587 737 HB VAL 90 HB VAL 90 -28.964 -18.923 -15.792 738 HG11 VAL 90 1HG1 VAL 90 -26.883 -20.103 -16.330 739 HG12 VAL 90 2HG1 VAL 90 -26.580 -20.331 -14.607 740 HG13 VAL 90 3HG1 VAL 90 -26.610 -18.704 -15.291 741 HG21 VAL 90 3HG2 VAL 90 -30.262 -20.867 -15.110 742 HG22 VAL 90 1HG2 VAL 90 -28.804 -21.643 -14.496 743 HG23 VAL 90 2HG2 VAL 90 -28.983 -21.350 -16.226 744 H LYS 91 H LYS 91 -30.261 -17.111 -14.393 745 HA LYS 91 HA LYS 91 -32.521 -17.775 -12.798 746 HB2 LYS 91 2HB LYS 91 -31.907 -15.405 -13.402 747 HB3 LYS 91 1HB LYS 91 -32.301 -15.756 -15.072 748 HG2 LYS 91 2HG LYS 91 -34.317 -15.887 -12.808 749 HG3 LYS 91 1HG LYS 91 -34.032 -14.457 -13.783 750 HD2 LYS 91 2HD LYS 91 -34.791 -15.595 -15.768 751 HD3 LYS 91 1HD LYS 91 -34.881 -17.130 -14.910 752 HE2 LYS 91 2HE LYS 91 -36.546 -14.690 -14.282 753 HE3 LYS 91 1HE LYS 91 -37.089 -16.057 -15.248 754 HZ1 LYS 91 3HZ LYS 91 -37.850 -16.259 -12.988 755 HZ2 LYS 91 1HZ LYS 91 -36.272 -16.216 -12.379 756 HZ3 LYS 91 2HZ LYS 91 -36.777 -17.497 -13.347 757 H ALA 92 H ALA 92 -33.867 -19.313 -13.238 758 HA ALA 92 HA ALA 92 -34.058 -20.300 -15.961 759 HB1 ALA 92 1HB ALA 92 -35.242 -22.218 -14.963 760 HB2 ALA 92 2HB ALA 92 -35.090 -21.467 -13.371 761 HB3 ALA 92 3HB ALA 92 -33.651 -21.977 -14.247 762 H ALA 93 H ALA 93 -35.892 -20.136 -17.112 763 HA ALA 93 HA ALA 93 -38.018 -18.559 -15.867 764 HB1 ALA 93 1HB ALA 93 -38.546 -17.739 -18.093 765 HB2 ALA 93 2HB ALA 93 -37.259 -18.743 -18.767 766 HB3 ALA 93 3HB ALA 93 -36.864 -17.411 -17.679 767 H LEU 94 H LEU 94 -40.066 -19.208 -16.020 768 HA LEU 94 HA LEU 94 -40.513 -21.951 -16.780 769 HB2 LEU 94 2HB LEU 94 -42.670 -21.758 -15.750 770 HB3 LEU 94 1HB LEU 94 -41.497 -21.052 -14.676 771 HG LEU 94 HG LEU 94 -43.490 -19.555 -16.392 772 HD11 LEU 94 1HD1 LEU 94 -44.535 -18.976 -14.258 773 HD12 LEU 94 2HD1 LEU 94 -43.372 -20.005 -13.424 774 HD13 LEU 94 3HD1 LEU 94 -44.526 -20.714 -14.550 775 HD21 LEU 94 3HD2 LEU 94 -41.474 -18.197 -16.093 776 HD22 LEU 94 1HD2 LEU 94 -41.533 -18.485 -14.350 777 HD23 LEU 94 2HD2 LEU 94 -42.807 -17.553 -15.140 778 H GLU 95 H GLU 95 -42.177 -22.574 -18.273 779 HA GLU 95 HA GLU 95 -42.871 -20.470 -20.162 780 HB2 GLU 95 2HB GLU 95 -40.884 -21.625 -21.012 781 HB3 GLU 95 1HB GLU 95 -41.728 -23.159 -20.887 782 HG2 GLU 95 2HG GLU 95 -43.292 -22.501 -22.580 783 HG3 GLU 95 1HG GLU 95 -42.592 -20.884 -22.649 784 H GLU 96 H GLU 96 -44.930 -20.381 -20.255 785 HA GLU 96 HA GLU 96 -46.691 -22.480 -19.537 786 HB2 GLU 96 2HB GLU 96 -48.456 -20.931 -20.329 787 HB3 GLU 96 1HB GLU 96 -47.341 -20.166 -19.210 788 HG2 GLU 96 2HG GLU 96 -46.192 -19.087 -21.067 789 HG3 GLU 96 1HG GLU 96 -47.261 -19.897 -22.209 790 H ALA 97 H ALA 97 -47.696 -23.929 -20.802 791 HA ALA 97 HA ALA 97 -47.712 -23.587 -23.670 792 HB1 ALA 97 1HB ALA 97 -45.626 -24.804 -23.257 793 HB2 ALA 97 2HB ALA 97 -46.808 -25.840 -24.062 794 HB3 ALA 97 3HB ALA 97 -46.510 -26.014 -22.332 795 H LYS 98 H LYS 98 -49.843 -23.630 -23.921 796 HA LYS 98 HA LYS 98 -51.535 -25.209 -22.288 797 HB2 LYS 98 2HB LYS 98 -52.336 -23.121 -23.318 798 HB3 LYS 98 1HB LYS 98 -52.114 -23.813 -24.917 799 HG2 LYS 98 2HG LYS 98 -53.835 -25.463 -24.465 800 HG3 LYS 98 1HG LYS 98 -54.036 -24.824 -22.835 801 HD2 LYS 98 2HD LYS 98 -54.717 -22.665 -23.770 802 HD3 LYS 98 1HD LYS 98 -54.515 -23.321 -25.396 803 HE2 LYS 98 2HE LYS 98 -56.232 -24.976 -24.969 804 HE3 LYS 98 1HE LYS 98 -56.397 -24.398 -23.312 805 HZ1 LYS 98 3HZ LYS 98 -57.003 -22.813 -25.750 806 HZ2 LYS 98 1HZ LYS 98 -57.160 -22.296 -24.152 807 HZ3 LYS 98 2HZ LYS 98 -58.129 -23.535 -24.717 808 H LYS 99 H LYS 99 -51.167 -25.325 -25.790 809 HA LYS 99 HA LYS 99 -51.423 -26.963 -27.256 810 HB2 LYS 99 2HB LYS 99 -49.348 -28.191 -25.459 811 HB3 LYS 99 1HB LYS 99 -49.754 -28.817 -27.052 812 HG2 LYS 99 2HG LYS 99 -48.675 -26.060 -26.471 813 HG3 LYS 99 1HG LYS 99 -47.765 -27.414 -27.152 814 HD2 LYS 99 2HD LYS 99 -49.252 -27.456 -29.085 815 HD3 LYS 99 1HD LYS 99 -50.196 -26.138 -28.415 816 HE2 LYS 99 2HE LYS 99 -48.252 -24.676 -28.544 817 HE3 LYS 99 1HE LYS 99 -47.307 -25.998 -29.233 818 HZ1 LYS 99 3HZ LYS 99 -48.186 -24.561 -30.999 819 HZ2 LYS 99 1HZ LYS 99 -49.750 -24.819 -30.431 820 HZ3 LYS 99 2HZ LYS 99 -48.882 -26.084 -31.078 821 H VAL 100 H VAL 100 -53.518 -27.298 -26.909 822 HA VAL 100 HA VAL 100 -54.078 -29.976 -25.886 823 HB VAL 100 HB VAL 100 -55.317 -28.174 -24.673 824 HG11 VAL 100 1HG1 VAL 100 -55.479 -26.508 -26.389 825 HG12 VAL 100 2HG1 VAL 100 -57.095 -26.912 -25.802 826 HG13 VAL 100 3HG1 VAL 100 -56.529 -27.550 -27.347 827 HG21 VAL 100 3HG2 VAL 100 -57.598 -29.096 -24.912 828 HG22 VAL 100 1HG2 VAL 100 -56.371 -30.363 -24.828 829 HG23 VAL 100 2HG2 VAL 100 -57.086 -29.929 -26.377 830 H GLN 101 H GLN 101 -55.291 -31.311 -27.294 831 HA GLN 101 HA GLN 101 -55.613 -30.176 -29.946 832 HB2 GLN 101 2HB GLN 101 -55.032 -32.384 -30.942 833 HB3 GLN 101 1HB GLN 101 -53.701 -31.605 -30.102 834 HG2 GLN 101 2HG GLN 101 -54.077 -33.083 -28.180 835 HG3 GLN 101 1HG GLN 101 -55.386 -33.869 -29.065 836 HE21 GLN 101 1HE2 GLN 101 -52.888 -34.943 -28.022 837 HE22 GLN 101 2HE2 GLN 101 -52.077 -35.666 -29.365 838 H ILE 102 H ILE 102 -57.475 -30.224 -30.746 839 HA ILE 102 HA ILE 102 -59.384 -32.201 -29.822 840 HB ILE 102 HB ILE 102 -60.056 -30.132 -28.791 841 HG12 ILE 102 2HG1 ILE 102 -61.801 -30.616 -31.219 842 HG13 ILE 102 1HG1 ILE 102 -61.884 -31.500 -29.701 843 HG21 ILE 102 1HG2 ILE 102 -59.880 -28.796 -31.476 844 HG22 ILE 102 2HG2 ILE 102 -58.829 -28.529 -30.084 845 HG23 ILE 102 3HG2 ILE 102 -60.526 -28.058 -30.010 846 HD11 ILE 102 3HD1 ILE 102 -63.671 -29.857 -29.880 847 HD12 ILE 102 1HD1 ILE 102 -62.477 -28.572 -30.080 848 HD13 ILE 102 2HD1 ILE 102 -62.575 -29.452 -28.556 849 H GLU 103 H GLU 103 -59.575 -33.532 -31.412 850 HA GLU 103 HA GLU 103 -59.459 -32.551 -34.163 851 HB2 GLU 103 2HB GLU 103 -59.180 -35.338 -33.049 852 HB3 GLU 103 1HB GLU 103 -59.109 -34.917 -34.751 853 HG2 GLU 103 2HG GLU 103 -57.123 -33.567 -34.330 854 HG3 GLU 103 1HG GLU 103 -57.201 -33.994 -32.619 855 H LEU 104 H LEU 104 -60.796 -34.070 -35.652 856 HA LEU 104 HA LEU 104 -63.532 -33.812 -34.809 857 HB2 LEU 104 2HB LEU 104 -62.329 -34.737 -37.438 858 HB3 LEU 104 1HB LEU 104 -64.042 -34.602 -37.135 859 HG LEU 104 HG LEU 104 -63.363 -32.750 -38.453 860 HD11 LEU 104 1HD1 LEU 104 -65.058 -32.259 -36.843 861 HD12 LEU 104 2HD1 LEU 104 -64.032 -30.850 -37.103 862 HD13 LEU 104 3HD1 LEU 104 -63.841 -31.819 -35.643 863 HD21 LEU 104 3HD2 LEU 104 -61.696 -31.087 -37.721 864 HD22 LEU 104 1HD2 LEU 104 -60.977 -32.682 -37.963 865 HD23 LEU 104 2HD2 LEU 104 -61.309 -32.104 -36.331 866 H ASP 105 H ASP 105 -65.013 -35.591 -34.996 867 HA ASP 105 HA ASP 105 -64.224 -37.834 -33.488 868 HB2 ASP 105 2HB ASP 105 -66.643 -37.626 -35.291 869 HB3 ASP 105 1HB ASP 105 -66.406 -38.821 -34.033 870 H THR 106 H THR 106 -64.906 -37.482 -36.902 871 HA THR 106 HA THR 106 -64.767 -38.785 -38.664 872 HB THR 106 HB THR 106 -62.617 -39.911 -39.094 873 HG1 THR 106 1HG THR 106 -62.395 -39.661 -36.398 874 HG21 THR 106 3HG2 THR 106 -62.444 -37.110 -37.987 875 HG22 THR 106 1HG2 THR 106 -62.911 -37.553 -39.625 876 HG23 THR 106 2HG2 THR 106 -61.260 -37.834 -39.073 877 H SER 107 H SER 107 -66.580 -39.847 -37.914 878 HA SER 107 HA SER 107 -66.109 -42.626 -37.133 879 HB2 SER 107 2HB SER 107 -67.583 -41.394 -35.638 880 HB3 SER 107 1HB SER 107 -68.609 -40.932 -36.992 881 HG SER 107 HG SER 107 -68.504 -43.497 -37.161 882 H LEU 108 H LEU 108 -67.090 -40.595 -39.690 883 HA LEU 108 HA LEU 108 -67.850 -40.862 -41.736 884 HB2 LEU 108 2HB LEU 108 -67.277 -43.804 -41.318 885 HB3 LEU 108 1HB LEU 108 -67.924 -43.180 -42.814 886 HG LEU 108 HG LEU 108 -65.595 -43.576 -43.102 887 HD11 LEU 108 1HD1 LEU 108 -66.052 -40.625 -42.851 888 HD12 LEU 108 2HD1 LEU 108 -66.432 -41.646 -44.237 889 HD13 LEU 108 3HD1 LEU 108 -64.753 -41.402 -43.757 890 HD21 LEU 108 3HD2 LEU 108 -64.881 -43.543 -40.776 891 HD22 LEU 108 1HD2 LEU 108 -65.087 -41.794 -40.722 892 HD23 LEU 108 2HD2 LEU 108 -63.856 -42.504 -41.769 893 H SER 109 H SER 109 -69.777 -40.939 -42.713 894 HA SER 109 HA SER 109 -71.970 -41.781 -41.049 895 HB2 SER 109 2HB SER 109 -72.064 -39.624 -42.328 896 HB3 SER 109 1HB SER 109 -71.998 -40.540 -43.828 897 HG SER 109 HG SER 109 -73.976 -41.089 -41.919 898 H TYR 110 H TYR 110 -71.816 -44.005 -41.014 899 HA TYR 110 HA TYR 110 -71.509 -45.442 -43.490 900 HB2 TYR 110 2HB TYR 110 -70.381 -46.202 -41.403 901 HB3 TYR 110 1HB TYR 110 -71.958 -46.526 -40.698 902 HD1 TYR 110 2HD TYR 110 -69.539 -47.573 -43.260 903 HD2 TYR 110 1HD TYR 110 -73.188 -48.530 -41.291 904 HE1 TYR 110 2HE TYR 110 -69.464 -49.823 -44.227 905 HE2 TYR 110 1HE TYR 110 -73.115 -50.789 -42.255 906 HH TYR 110 HH TYR 110 -70.340 -52.047 -43.732 907 H ILE 111 H ILE 111 -73.204 -45.421 -44.748 908 HA ILE 111 HA ILE 111 -75.637 -46.604 -43.764 909 HB ILE 111 HB ILE 111 -76.169 -44.290 -43.543 910 HG12 ILE 111 2HG1 ILE 111 -77.402 -45.323 -46.102 911 HG13 ILE 111 1HG1 ILE 111 -77.899 -45.779 -44.478 912 HG21 ILE 111 1HG2 ILE 111 -74.471 -43.262 -44.898 913 HG22 ILE 111 2HG2 ILE 111 -76.060 -42.662 -45.387 914 HG23 ILE 111 3HG2 ILE 111 -75.230 -43.866 -46.370 915 HD11 ILE 111 3HD1 ILE 111 -78.513 -43.508 -44.026 916 HD12 ILE 111 1HD1 ILE 111 -79.390 -44.141 -45.426 917 HD13 ILE 111 2HD1 ILE 111 -78.019 -43.031 -45.661 Start of MODEL 16 1 H1 GLY -1 1HT GLY -1 1.580 -7.182 -26.954 2 H2 GLY -1 2HT GLY -1 1.500 -6.160 -25.603 3 H3 GLY -1 3HT GLY -1 1.334 -5.521 -27.133 4 HA2 GLY -1 1HA GLY -1 -0.747 -6.734 -27.429 5 HA3 GLY -1 2HA GLY -1 -0.544 -7.371 -25.800 6 H SER 0 H SER 0 -1.481 -4.681 -27.716 7 HA SER 0 HA SER 0 -1.596 -2.884 -25.479 8 HB2 SER 0 2HB SER 0 -2.531 -2.487 -28.326 9 HB3 SER 0 1HB SER 0 -2.439 -1.229 -27.094 10 HG SER 0 HG SER 0 -0.178 -2.777 -27.682 11 H MET 1 H MET 1 -2.988 -4.227 -24.242 12 HA MET 1 HA MET 1 -5.830 -3.755 -24.847 13 HB2 MET 1 2HB MET 1 -4.518 -5.814 -23.067 14 HB3 MET 1 1HB MET 1 -6.238 -5.479 -23.018 15 HG2 MET 1 2HG MET 1 -4.729 -6.489 -25.423 16 HG3 MET 1 1HG MET 1 -5.680 -7.483 -24.318 17 HE1 MET 1 3HE MET 1 -7.944 -7.493 -27.507 18 HE2 MET 1 1HE MET 1 -7.140 -8.477 -26.288 19 HE3 MET 1 2HE MET 1 -6.185 -7.559 -27.451 20 H THR 2 H THR 2 -7.014 -2.547 -23.392 21 HA THR 2 HA THR 2 -5.428 -1.278 -21.301 22 HB THR 2 HB THR 2 -8.105 -0.452 -22.443 23 HG1 THR 2 1HG THR 2 -7.083 0.494 -23.934 24 HG21 THR 2 3HG2 THR 2 -7.669 0.412 -20.203 25 HG22 THR 2 1HG2 THR 2 -7.589 1.718 -21.389 26 HG23 THR 2 2HG2 THR 2 -6.102 1.027 -20.727 27 H VAL 3 H VAL 3 -5.674 -2.037 -19.343 28 HA VAL 3 HA VAL 3 -8.267 -3.210 -18.549 29 HB VAL 3 HB VAL 3 -5.595 -3.629 -17.192 30 HG11 VAL 3 1HG1 VAL 3 -7.408 -4.029 -15.706 31 HG12 VAL 3 2HG1 VAL 3 -6.682 -5.564 -16.251 32 HG13 VAL 3 3HG1 VAL 3 -8.207 -5.042 -16.942 33 HG21 VAL 3 3HG2 VAL 3 -6.964 -5.486 -19.119 34 HG22 VAL 3 1HG2 VAL 3 -5.587 -5.861 -18.090 35 HG23 VAL 3 2HG2 VAL 3 -5.414 -4.649 -19.375 36 H TYR 4 H TYR 4 -9.290 -2.295 -16.777 37 HA TYR 4 HA TYR 4 -7.965 0.019 -15.586 38 HB2 TYR 4 2HB TYR 4 -10.904 -0.721 -15.709 39 HB3 TYR 4 1HB TYR 4 -10.244 0.755 -15.011 40 HD1 TYR 4 2HD TYR 4 -10.700 -1.097 -18.198 41 HD2 TYR 4 1HD TYR 4 -9.727 2.635 -16.405 42 HE1 TYR 4 2HE TYR 4 -10.865 -0.013 -20.392 43 HE2 TYR 4 1HE TYR 4 -9.894 3.734 -18.603 44 HH TYR 4 HH TYR 4 -9.737 3.145 -20.971 45 H ILE 5 H ILE 5 -7.505 0.026 -13.440 46 HA ILE 5 HA ILE 5 -8.354 -2.309 -11.845 47 HB ILE 5 HB ILE 5 -5.628 -0.871 -11.608 48 HG12 ILE 5 2HG1 ILE 5 -4.759 -3.086 -12.012 49 HG13 ILE 5 1HG1 ILE 5 -6.345 -3.698 -12.453 50 HG21 ILE 5 1HG2 ILE 5 -6.451 -1.437 -9.477 51 HG22 ILE 5 2HG2 ILE 5 -5.096 -2.483 -9.910 52 HG23 ILE 5 3HG2 ILE 5 -6.752 -3.105 -9.955 53 HD11 ILE 5 3HD1 ILE 5 -4.758 -1.584 -13.939 54 HD12 ILE 5 1HD1 ILE 5 -6.401 -2.076 -14.339 55 HD13 ILE 5 2HD1 ILE 5 -5.074 -3.229 -14.492 56 H CYS 6 H CYS 6 -9.682 -1.766 -10.297 57 HA CYS 6 HA CYS 6 -8.986 0.533 -8.674 58 HB2 CYS 6 2HB CYS 6 -11.041 1.121 -9.900 59 HB3 CYS 6 1HB CYS 6 -11.804 -0.357 -9.327 60 HG CYS 6 HG CYS 6 -12.924 1.760 -7.947 61 HA PRO 7 HA PRO 7 -8.697 -3.222 -6.049 62 HB2 PRO 7 2HB PRO 7 -7.280 -1.945 -4.072 63 HB3 PRO 7 1HB PRO 7 -6.541 -2.696 -5.486 64 HG2 PRO 7 2HG PRO 7 -7.201 0.183 -5.001 65 HG3 PRO 7 1HG PRO 7 -5.753 -0.527 -5.736 66 HD2 PRO 7 2HD PRO 7 -7.671 0.583 -7.219 67 HD3 PRO 7 1HD PRO 7 -6.796 -0.866 -7.772 68 H GLU 8 H GLU 8 -10.135 -0.238 -5.612 69 HA GLU 8 HA GLU 8 -10.972 -0.608 -2.867 70 HB2 GLU 8 2HB GLU 8 -11.771 1.515 -4.829 71 HB3 GLU 8 1HB GLU 8 -12.002 1.536 -3.088 72 HG2 GLU 8 2HG GLU 8 -9.426 1.492 -4.546 73 HG3 GLU 8 1HG GLU 8 -10.170 2.923 -3.804 74 H THR 9 H THR 9 -12.853 0.311 -5.749 75 HA THR 9 HA THR 9 -15.090 -1.056 -4.546 76 HB THR 9 HB THR 9 -16.427 0.418 -6.101 77 HG1 THR 9 1HG THR 9 -15.239 1.302 -7.579 78 HG21 THR 9 3HG2 THR 9 -14.546 1.770 -4.161 79 HG22 THR 9 1HG2 THR 9 -16.066 0.980 -3.727 80 HG23 THR 9 2HG2 THR 9 -16.077 2.435 -4.728 81 H GLY 10 H GLY 10 -12.844 -1.715 -6.851 82 HA2 GLY 10 2HA GLY 10 -14.830 -3.226 -8.370 83 HA3 GLY 10 1HA GLY 10 -13.267 -2.926 -9.059 84 H ASP 11 H ASP 11 -13.078 -5.220 -9.371 85 HA ASP 11 HA ASP 11 -12.059 -6.716 -7.165 86 HB2 ASP 11 2HB ASP 11 -14.543 -7.010 -6.894 87 HB3 ASP 11 1HB ASP 11 -14.571 -7.732 -8.504 88 H ASP 12 H ASP 12 -10.962 -8.579 -7.946 89 HA ASP 12 HA ASP 12 -10.190 -8.152 -10.691 90 HB2 ASP 12 2HB ASP 12 -8.398 -9.739 -10.394 91 HB3 ASP 12 1HB ASP 12 -8.419 -8.616 -9.047 92 H GLY 13 H GLY 13 -12.620 -9.946 -9.364 93 HA2 GLY 13 2HA GLY 13 -12.482 -12.124 -11.241 94 HA3 GLY 13 1HA GLY 13 -13.820 -11.758 -10.153 95 H ASN 14 H ASN 14 -13.059 -8.977 -11.581 96 HA ASN 14 HA ASN 14 -15.306 -9.026 -13.388 97 HB2 ASN 14 2HB ASN 14 -13.365 -6.879 -12.578 98 HB3 ASN 14 1HB ASN 14 -14.605 -6.611 -13.786 99 HD21 ASN 14 1HD2 ASN 14 -14.195 -5.319 -11.216 100 HD22 ASN 14 2HD2 ASN 14 -15.638 -5.581 -10.302 101 H ASP 15 H ASP 15 -14.782 -7.570 -15.487 102 HA ASP 15 HA ASP 15 -12.962 -9.209 -17.085 103 HB2 ASP 15 2HB ASP 15 -14.829 -6.993 -17.947 104 HB3 ASP 15 1HB ASP 15 -13.967 -8.096 -19.009 105 H GLY 16 H GLY 16 -12.589 -6.569 -15.246 106 HA2 GLY 16 2HA GLY 16 -11.016 -4.904 -15.155 107 HA3 GLY 16 1HA GLY 16 -10.265 -5.687 -16.546 108 H SER 17 H SER 17 -13.494 -4.666 -16.706 109 HA SER 17 HA SER 17 -13.012 -2.822 -18.842 110 HB2 SER 17 2HB SER 17 -15.057 -4.192 -18.791 111 HB3 SER 17 1HB SER 17 -15.506 -3.493 -17.239 112 HG SER 17 HG SER 17 -15.345 -2.182 -19.747 113 H GLU 18 H GLU 18 -13.962 -0.486 -18.626 114 HA GLU 18 HA GLU 18 -12.745 0.831 -16.474 115 HB2 GLU 18 2HB GLU 18 -13.311 1.829 -18.756 116 HB3 GLU 18 1HB GLU 18 -14.982 1.884 -18.208 117 HG2 GLU 18 2HG GLU 18 -14.278 3.336 -16.340 118 HG3 GLU 18 1HG GLU 18 -12.662 3.312 -17.056 119 H LEU 19 H LEU 19 -15.970 -0.363 -17.162 120 HA LEU 19 HA LEU 19 -17.196 0.786 -14.845 121 HB2 LEU 19 2HB LEU 19 -18.177 -1.233 -16.849 122 HB3 LEU 19 1HB LEU 19 -19.142 -0.588 -15.546 123 HG LEU 19 HG LEU 19 -19.780 0.466 -17.476 124 HD11 LEU 19 1HD1 LEU 19 -19.704 1.953 -15.612 125 HD12 LEU 19 2HD1 LEU 19 -19.295 2.851 -17.073 126 HD13 LEU 19 3HD1 LEU 19 -18.023 2.366 -15.957 127 HD21 LEU 19 3HD2 LEU 19 -17.928 0.029 -18.966 128 HD22 LEU 19 1HD2 LEU 19 -16.906 1.152 -18.068 129 HD23 LEU 19 2HD2 LEU 19 -18.286 1.754 -18.985 130 H LYS 20 H LYS 20 -15.408 -2.003 -15.572 131 HA LYS 20 HA LYS 20 -16.121 -3.287 -12.977 132 HB2 LYS 20 2HB LYS 20 -15.489 -4.854 -15.476 133 HB3 LYS 20 1HB LYS 20 -16.058 -5.410 -13.928 134 HG2 LYS 20 2HG LYS 20 -18.241 -4.450 -14.222 135 HG3 LYS 20 1HG LYS 20 -17.750 -3.757 -15.766 136 HD2 LYS 20 2HD LYS 20 -17.420 -5.952 -16.702 137 HD3 LYS 20 1HD LYS 20 -17.779 -6.700 -15.146 138 HE2 LYS 20 2HE LYS 20 -19.686 -5.003 -16.737 139 HE3 LYS 20 1HE LYS 20 -19.688 -6.764 -16.712 140 HZ1 LYS 20 3HZ LYS 20 -21.329 -5.907 -15.173 141 HZ2 LYS 20 1HZ LYS 20 -20.171 -4.993 -14.361 142 HZ3 LYS 20 2HZ LYS 20 -20.094 -6.656 -14.314 143 HA PRO 21 HA PRO 21 -11.701 -2.621 -13.670 144 HB2 PRO 21 2HB PRO 21 -11.166 -1.406 -11.319 145 HB3 PRO 21 1HB PRO 21 -11.720 -0.541 -12.758 146 HG2 PRO 21 2HG PRO 21 -13.265 -1.365 -10.338 147 HG3 PRO 21 1HG PRO 21 -13.388 0.115 -11.301 148 HD2 PRO 21 2HD PRO 21 -15.085 -2.028 -11.498 149 HD3 PRO 21 1HD PRO 21 -14.801 -0.850 -12.792 150 H LEU 22 H LEU 22 -10.064 -3.785 -12.853 151 HA LEU 22 HA LEU 22 -10.751 -6.044 -11.191 152 HB2 LEU 22 2HB LEU 22 -8.092 -5.189 -12.320 153 HB3 LEU 22 1HB LEU 22 -8.427 -6.728 -11.558 154 HG LEU 22 HG LEU 22 -9.601 -5.749 -14.148 155 HD11 LEU 22 1HD1 LEU 22 -8.268 -7.493 -15.147 156 HD12 LEU 22 2HD1 LEU 22 -7.573 -7.874 -13.569 157 HD13 LEU 22 3HD1 LEU 22 -7.264 -6.307 -14.312 158 HD21 LEU 22 3HD2 LEU 22 -9.903 -8.404 -12.758 159 HD22 LEU 22 1HD2 LEU 22 -10.516 -7.993 -14.358 160 HD23 LEU 22 2HD2 LEU 22 -11.162 -7.179 -12.935 161 H ARG 23 H ARG 23 -9.569 -6.519 -9.227 162 HA ARG 23 HA ARG 23 -9.109 -4.011 -7.849 163 HB2 ARG 23 2HB ARG 23 -9.450 -5.197 -5.767 164 HB3 ARG 23 1HB ARG 23 -10.645 -5.631 -6.909 165 HG2 ARG 23 2HG ARG 23 -9.568 -7.731 -7.401 166 HG3 ARG 23 1HG ARG 23 -8.236 -7.300 -6.336 167 HD2 ARG 23 2HD ARG 23 -9.721 -7.273 -4.426 168 HD3 ARG 23 1HD ARG 23 -11.099 -7.621 -5.468 169 HE ARG 23 HE ARG 23 -9.395 -9.644 -5.997 170 HH11 ARG 23 1HH1 ARG 23 -10.726 -8.384 -2.982 171 HH12 ARG 23 2HH1 ARG 23 -10.762 -9.896 -2.196 172 HH21 ARG 23 1HH2 ARG 23 -9.433 -11.687 -4.955 173 HH22 ARG 23 2HH2 ARG 23 -10.023 -11.820 -3.353 174 H THR 24 H THR 24 -7.309 -6.430 -9.353 175 HA THR 24 HA THR 24 -4.970 -5.499 -7.934 176 HB THR 24 HB THR 24 -3.962 -7.766 -8.374 177 HG1 THR 24 1HG THR 24 -5.805 -9.405 -8.429 178 HG21 THR 24 3HG2 THR 24 -5.004 -8.855 -6.425 179 HG22 THR 24 1HG2 THR 24 -6.347 -7.715 -6.508 180 HG23 THR 24 2HG2 THR 24 -4.728 -7.139 -6.128 181 H LEU 25 H LEU 25 -3.234 -5.158 -9.147 182 HA LEU 25 HA LEU 25 -3.569 -4.766 -11.955 183 HB2 LEU 25 2HB LEU 25 -2.297 -3.237 -10.519 184 HB3 LEU 25 1HB LEU 25 -1.194 -4.524 -10.107 185 HG LEU 25 HG LEU 25 -0.301 -4.536 -12.358 186 HD11 LEU 25 1HD1 LEU 25 -2.317 -4.027 -13.597 187 HD12 LEU 25 2HD1 LEU 25 -1.057 -2.873 -14.003 188 HD13 LEU 25 3HD1 LEU 25 -2.375 -2.410 -12.916 189 HD21 LEU 25 3HD2 LEU 25 0.672 -2.293 -12.355 190 HD22 LEU 25 1HD2 LEU 25 0.618 -2.982 -10.729 191 HD23 LEU 25 2HD2 LEU 25 -0.567 -1.775 -11.216 192 H TYR 26 H TYR 26 -2.446 -7.134 -9.817 193 HA TYR 26 HA TYR 26 -0.852 -8.755 -11.418 194 HB2 TYR 26 2HB TYR 26 -1.030 -9.170 -9.047 195 HB3 TYR 26 1HB TYR 26 -2.763 -9.450 -9.175 196 HD1 TYR 26 1HD TYR 26 0.182 -10.752 -11.023 197 HD2 TYR 26 2HD TYR 26 -3.236 -11.670 -8.698 198 HE1 TYR 26 1HE TYR 26 0.617 -13.080 -11.354 199 HE2 TYR 26 2HE TYR 26 -2.848 -14.067 -9.054 200 HH TYR 26 HH TYR 26 -1.721 -15.530 -10.561 201 H GLN 27 H GLN 27 -4.417 -8.842 -11.002 202 HA GLN 27 HA GLN 27 -4.791 -10.948 -12.830 203 HB2 GLN 27 2HB GLN 27 -6.502 -10.357 -11.199 204 HB3 GLN 27 1HB GLN 27 -6.753 -8.805 -11.969 205 HG2 GLN 27 2HG GLN 27 -8.547 -10.370 -12.563 206 HG3 GLN 27 1HG GLN 27 -7.632 -9.924 -13.975 207 HE21 GLN 27 1HE2 GLN 27 -8.226 -11.756 -15.076 208 HE22 GLN 27 2HE2 GLN 27 -7.602 -13.316 -14.775 209 H ALA 28 H ALA 28 -4.631 -7.452 -13.268 210 HA ALA 28 HA ALA 28 -5.503 -7.236 -15.865 211 HB1 ALA 28 1HB ALA 28 -5.064 -5.373 -14.331 212 HB2 ALA 28 2HB ALA 28 -4.268 -5.145 -15.884 213 HB3 ALA 28 3HB ALA 28 -3.334 -5.672 -14.477 214 H MET 29 H MET 29 -2.250 -8.021 -14.603 215 HA MET 29 HA MET 29 -1.122 -8.185 -17.163 216 HB2 MET 29 2HB MET 29 -0.228 -8.997 -14.448 217 HB3 MET 29 1HB MET 29 0.659 -9.529 -15.857 218 HG2 MET 29 2HG MET 29 0.969 -7.097 -16.481 219 HG3 MET 29 1HG MET 29 0.214 -6.660 -14.961 220 HE1 MET 29 3HE MET 29 4.005 -5.929 -14.611 221 HE2 MET 29 1HE MET 29 2.388 -5.237 -14.692 222 HE3 MET 29 2HE MET 29 3.121 -5.907 -16.149 223 H ILE 30 H ILE 30 -2.743 -10.481 -15.110 224 HA ILE 30 HA ILE 30 -1.936 -12.817 -16.505 225 HB ILE 30 HB ILE 30 -4.518 -12.368 -14.975 226 HG12 ILE 30 2HG1 ILE 30 -1.906 -13.606 -14.074 227 HG13 ILE 30 1HG1 ILE 30 -2.523 -12.036 -13.576 228 HG21 ILE 30 1HG2 ILE 30 -4.627 -14.817 -14.797 229 HG22 ILE 30 2HG2 ILE 30 -3.198 -14.948 -15.819 230 HG23 ILE 30 3HG2 ILE 30 -4.694 -14.282 -16.477 231 HD11 ILE 30 3HD1 ILE 30 -4.426 -13.134 -12.503 232 HD12 ILE 30 1HD1 ILE 30 -2.890 -13.711 -11.863 233 HD13 ILE 30 2HD1 ILE 30 -3.797 -14.701 -13.007 234 H ILE 31 H ILE 31 -4.647 -10.667 -16.918 235 HA ILE 31 HA ILE 31 -5.882 -12.195 -18.926 236 HB ILE 31 HB ILE 31 -6.237 -9.233 -18.401 237 HG12 ILE 31 2HG1 ILE 31 -7.671 -11.639 -17.261 238 HG13 ILE 31 1HG1 ILE 31 -6.603 -10.550 -16.378 239 HG21 ILE 31 1HG2 ILE 31 -7.118 -10.076 -20.540 240 HG22 ILE 31 2HG2 ILE 31 -8.430 -9.631 -19.409 241 HG23 ILE 31 3HG2 ILE 31 -7.977 -11.329 -19.611 242 HD11 ILE 31 3HD1 ILE 31 -8.170 -8.718 -16.795 243 HD12 ILE 31 1HD1 ILE 31 -8.923 -10.059 -15.908 244 HD13 ILE 31 2HD1 ILE 31 -9.220 -9.860 -17.640 245 H THR 32 H THR 32 -3.524 -9.515 -19.020 246 HA THR 32 HA THR 32 -3.836 -9.256 -21.864 247 HB THR 32 HB THR 32 -2.174 -7.416 -21.599 248 HG1 THR 32 1HG THR 32 -2.478 -7.583 -18.833 249 HG21 THR 32 3HG2 THR 32 -4.483 -7.268 -19.625 250 HG22 THR 32 1HG2 THR 32 -4.638 -7.008 -21.360 251 HG23 THR 32 2HG2 THR 32 -3.674 -5.913 -20.372 252 H LYS 33 H LYS 33 -1.388 -10.335 -19.525 253 HA LYS 33 HA LYS 33 0.447 -11.597 -19.655 254 HB2 LYS 33 2HB LYS 33 -0.556 -12.278 -22.412 255 HB3 LYS 33 1HB LYS 33 0.779 -13.094 -21.616 256 HG2 LYS 33 2HG LYS 33 -0.700 -13.925 -19.895 257 HG3 LYS 33 1HG LYS 33 -2.047 -13.016 -20.573 258 HD2 LYS 33 2HD LYS 33 -0.545 -15.228 -21.987 259 HD3 LYS 33 1HD LYS 33 -2.114 -15.407 -21.196 260 HE2 LYS 33 2HE LYS 33 -3.049 -13.712 -22.737 261 HE3 LYS 33 1HE LYS 33 -1.491 -13.612 -23.553 262 HZ1 LYS 33 3HZ LYS 33 -1.714 -15.953 -24.130 263 HZ2 LYS 33 1HZ LYS 33 -2.981 -15.046 -24.743 264 HZ3 LYS 33 2HZ LYS 33 -3.223 -16.017 -23.395 265 H SER 34 H SER 34 0.127 -8.848 -21.165 266 HA SER 34 HA SER 34 2.502 -9.096 -22.851 267 HB2 SER 34 2HB SER 34 0.522 -7.947 -23.775 268 HB3 SER 34 1HB SER 34 0.668 -6.709 -22.535 269 HG SER 34 HG SER 34 2.962 -7.179 -24.010 270 H SER 35 H SER 35 1.698 -7.947 -19.729 271 HA SER 35 HA SER 35 2.865 -7.000 -18.035 272 HB2 SER 35 2HB SER 35 5.278 -7.757 -19.697 273 HB3 SER 35 1HB SER 35 5.310 -7.313 -17.991 274 HG SER 35 HG SER 35 4.437 -9.666 -19.205 275 H LYS 36 H LYS 36 2.591 -5.428 -20.849 276 HA LYS 36 HA LYS 36 3.628 -2.938 -19.786 277 HB2 LYS 36 2HB LYS 36 4.973 -2.424 -21.751 278 HB3 LYS 36 1HB LYS 36 5.574 -3.845 -20.913 279 HG2 LYS 36 2HG LYS 36 4.465 -5.269 -22.632 280 HG3 LYS 36 1HG LYS 36 3.985 -3.805 -23.487 281 HD2 LYS 36 2HD LYS 36 6.829 -4.703 -22.937 282 HD3 LYS 36 1HD LYS 36 5.986 -4.775 -24.476 283 HE2 LYS 36 2HE LYS 36 5.856 -2.355 -24.582 284 HE3 LYS 36 1HE LYS 36 6.547 -2.223 -22.970 285 HZ1 LYS 36 3HZ LYS 36 8.174 -1.803 -24.697 286 HZ2 LYS 36 1HZ LYS 36 7.965 -3.361 -25.322 287 HZ3 LYS 36 2HZ LYS 36 8.581 -3.140 -23.752 288 H GLY 37 H GLY 37 1.110 -4.278 -20.648 289 HA2 GLY 37 2HA GLY 37 0.197 -2.814 -22.958 290 HA3 GLY 37 1HA GLY 37 -0.781 -3.845 -21.920 291 H ASP 38 H ASP 38 -2.319 -1.956 -22.202 292 HA ASP 38 HA ASP 38 -1.541 0.343 -20.647 293 HB2 ASP 38 2HB ASP 38 -4.041 -0.264 -22.227 294 HB3 ASP 38 1HB ASP 38 -3.818 1.202 -21.275 295 H PHE 39 H PHE 39 -1.710 0.230 -18.602 296 HA PHE 39 HA PHE 39 -3.992 -1.186 -17.449 297 HB2 PHE 39 2HB PHE 39 -1.226 -0.860 -16.262 298 HB3 PHE 39 1HB PHE 39 -2.573 -1.721 -15.532 299 HD1 PHE 39 1HD PHE 39 -3.543 -3.655 -17.034 300 HD2 PHE 39 2HD PHE 39 0.384 -2.083 -17.383 301 HE1 PHE 39 1HE PHE 39 -2.806 -5.731 -18.121 302 HE2 PHE 39 2HE PHE 39 1.126 -4.140 -18.475 303 HZ PHE 39 HZ PHE 39 -0.466 -5.976 -18.843 304 H LEU 40 H LEU 40 -5.296 0.236 -16.535 305 HA LEU 40 HA LEU 40 -4.093 2.774 -15.649 306 HB2 LEU 40 2HB LEU 40 -6.950 2.397 -16.568 307 HB3 LEU 40 1HB LEU 40 -6.110 3.865 -16.127 308 HG LEU 40 HG LEU 40 -5.514 2.214 -18.569 309 HD11 LEU 40 1HD1 LEU 40 -6.872 4.877 -18.263 310 HD12 LEU 40 2HD1 LEU 40 -7.633 3.356 -18.729 311 HD13 LEU 40 3HD1 LEU 40 -6.440 4.101 -19.792 312 HD21 LEU 40 3HD2 LEU 40 -3.530 3.319 -17.708 313 HD22 LEU 40 1HD2 LEU 40 -4.389 4.858 -17.652 314 HD23 LEU 40 2HD2 LEU 40 -4.070 4.074 -19.204 315 H ILE 41 H ILE 41 -4.258 3.153 -13.572 316 HA ILE 41 HA ILE 41 -6.030 1.384 -12.033 317 HB ILE 41 HB ILE 41 -3.870 3.163 -10.924 318 HG12 ILE 41 2HG1 ILE 41 -2.671 1.607 -12.432 319 HG13 ILE 41 1HG1 ILE 41 -2.496 1.126 -10.719 320 HG21 ILE 41 1HG2 ILE 41 -5.235 0.739 -9.812 321 HG22 ILE 41 2HG2 ILE 41 -5.545 2.411 -9.385 322 HG23 ILE 41 3HG2 ILE 41 -3.977 1.679 -8.983 323 HD11 ILE 41 3HD1 ILE 41 -2.655 -0.610 -12.299 324 HD12 ILE 41 1HD1 ILE 41 -4.288 -0.084 -12.694 325 HD13 ILE 41 2HD1 ILE 41 -3.874 -0.654 -11.033 326 H ARG 42 H ARG 42 -7.565 2.238 -10.809 327 HA ARG 42 HA ARG 42 -8.268 5.027 -11.105 328 HB2 ARG 42 2HB ARG 42 -9.931 3.118 -10.869 329 HB3 ARG 42 1HB ARG 42 -9.450 3.029 -9.187 330 HG2 ARG 42 2HG ARG 42 -11.467 4.331 -9.244 331 HG3 ARG 42 1HG ARG 42 -10.136 5.407 -8.946 332 HD2 ARG 42 2HD ARG 42 -10.354 6.511 -10.875 333 HD3 ARG 42 1HD ARG 42 -10.838 5.065 -11.811 334 HE ARG 42 HE ARG 42 -12.815 5.874 -9.967 335 HH11 ARG 42 1HH1 ARG 42 -11.403 6.845 -13.071 336 HH12 ARG 42 2HH1 ARG 42 -12.818 7.599 -13.643 337 HH21 ARG 42 1HH2 ARG 42 -14.775 6.910 -10.782 338 HH22 ARG 42 2HH2 ARG 42 -14.757 7.633 -12.311 339 H THR 43 H THR 43 -7.559 6.456 -9.872 340 HA THR 43 HA THR 43 -6.468 5.771 -7.269 341 HB THR 43 HB THR 43 -4.605 5.971 -8.896 342 HG1 THR 43 1HG THR 43 -3.394 7.483 -7.662 343 HG21 THR 43 3HG2 THR 43 -5.535 8.827 -9.185 344 HG22 THR 43 1HG2 THR 43 -5.590 7.579 -10.430 345 HG23 THR 43 2HG2 THR 43 -4.034 8.168 -9.843 346 H LYS 44 H LYS 44 -6.385 7.556 -5.828 347 HA LYS 44 HA LYS 44 -8.563 9.433 -6.361 348 HB2 LYS 44 2HB LYS 44 -7.289 8.563 -3.754 349 HB3 LYS 44 1HB LYS 44 -8.737 9.545 -3.932 350 HG2 LYS 44 2HG LYS 44 -9.900 7.655 -4.946 351 HG3 LYS 44 1HG LYS 44 -8.447 6.670 -4.779 352 HD2 LYS 44 2HD LYS 44 -8.560 6.922 -2.357 353 HD3 LYS 44 1HD LYS 44 -10.006 7.921 -2.532 354 HE2 LYS 44 2HE LYS 44 -11.165 6.029 -3.604 355 HE3 LYS 44 1HE LYS 44 -9.729 5.038 -3.381 356 HZ1 LYS 44 3HZ LYS 44 -11.403 4.646 -1.683 357 HZ2 LYS 44 1HZ LYS 44 -11.333 6.257 -1.205 358 HZ3 LYS 44 2HZ LYS 44 -9.991 5.248 -0.982 359 H LYS 45 H LYS 45 -7.708 11.298 -7.010 360 HA LYS 45 HA LYS 45 -5.195 12.164 -5.784 361 HB2 LYS 45 2HB LYS 45 -4.836 11.093 -8.100 362 HB3 LYS 45 1HB LYS 45 -5.866 12.349 -8.705 363 HG2 LYS 45 2HG LYS 45 -4.277 14.017 -8.223 364 HG3 LYS 45 1HG LYS 45 -3.283 12.880 -7.299 365 HD2 LYS 45 2HD LYS 45 -4.019 12.479 -10.142 366 HD3 LYS 45 1HD LYS 45 -2.490 13.307 -9.712 367 HE2 LYS 45 2HE LYS 45 -1.887 11.175 -8.493 368 HE3 LYS 45 1HE LYS 45 -3.364 10.445 -9.101 369 HZ1 LYS 45 3HZ LYS 45 -1.575 9.779 -10.458 370 HZ2 LYS 45 1HZ LYS 45 -1.030 11.349 -10.708 371 HZ3 LYS 45 2HZ LYS 45 -2.498 10.840 -11.380 372 H ASP 46 H ASP 46 -5.765 13.869 -4.689 373 HA ASP 46 HA ASP 46 -6.512 15.893 -4.074 374 HB2 ASP 46 2HB ASP 46 -5.077 16.540 -6.014 375 HB3 ASP 46 1HB ASP 46 -6.497 16.474 -7.048 376 H GLY 47 H GLY 47 -8.433 13.876 -4.457 377 HA2 GLY 47 2HA GLY 47 -10.705 13.906 -3.912 378 HA3 GLY 47 1HA GLY 47 -10.775 15.580 -4.427 379 H LYS 48 H LYS 48 -9.282 13.755 -6.827 380 HA LYS 48 HA LYS 48 -11.882 13.225 -8.062 381 HB2 LYS 48 2HB LYS 48 -9.322 14.076 -9.400 382 HB3 LYS 48 1HB LYS 48 -10.687 13.446 -10.319 383 HG2 LYS 48 2HG LYS 48 -10.927 15.713 -10.574 384 HG3 LYS 48 1HG LYS 48 -11.921 15.453 -9.149 385 HD2 LYS 48 2HD LYS 48 -10.546 17.382 -8.720 386 HD3 LYS 48 1HD LYS 48 -9.925 16.003 -7.785 387 HE2 LYS 48 2HE LYS 48 -8.112 15.663 -9.263 388 HE3 LYS 48 1HE LYS 48 -8.803 16.741 -10.476 389 HZ1 LYS 48 3HZ LYS 48 -8.382 18.581 -9.070 390 HZ2 LYS 48 1HZ LYS 48 -6.963 17.749 -9.266 391 HZ3 LYS 48 2HZ LYS 48 -7.805 17.667 -7.804 392 H GLN 49 H GLN 49 -12.227 11.226 -8.982 393 HA GLN 49 HA GLN 49 -10.246 9.200 -8.378 394 HB2 GLN 49 2HB GLN 49 -12.955 8.902 -9.692 395 HB3 GLN 49 1HB GLN 49 -12.008 7.658 -8.910 396 HG2 GLN 49 2HG GLN 49 -13.402 9.948 -7.562 397 HG3 GLN 49 1HG GLN 49 -13.978 8.286 -7.623 398 HE21 GLN 49 1HE2 GLN 49 -14.041 8.092 -5.425 399 HE22 GLN 49 2HE2 GLN 49 -12.649 8.012 -4.418 400 H VAL 50 H VAL 50 -8.893 8.701 -9.996 401 HA VAL 50 HA VAL 50 -9.778 9.167 -12.757 402 HB VAL 50 HB VAL 50 -7.606 10.198 -13.396 403 HG11 VAL 50 1HG1 VAL 50 -8.003 12.429 -12.460 404 HG12 VAL 50 2HG1 VAL 50 -9.099 11.723 -11.269 405 HG13 VAL 50 3HG1 VAL 50 -9.496 11.653 -12.986 406 HG21 VAL 50 3HG2 VAL 50 -6.123 11.115 -11.656 407 HG22 VAL 50 1HG2 VAL 50 -6.209 9.352 -11.585 408 HG23 VAL 50 2HG2 VAL 50 -7.103 10.322 -10.421 409 H TRP 51 H TRP 51 -8.458 8.133 -14.373 410 HA TRP 51 HA TRP 51 -7.286 5.662 -13.399 411 HB2 TRP 51 2HB TRP 51 -8.154 6.562 -16.144 412 HB3 TRP 51 1HB TRP 51 -7.540 4.984 -15.828 413 HD1 TRP 51 HD TRP 51 -10.512 6.784 -16.231 414 HE1 TRP 51 1HE TRP 51 -12.610 5.417 -15.475 415 HE3 TRP 51 3HE TRP 51 -8.142 3.242 -13.560 416 HZ2 TRP 51 2HZ TRP 51 -13.114 3.132 -13.945 417 HZ3 TRP 51 3HZ TRP 51 -9.474 1.469 -12.462 418 HH2 TRP 51 HH TRP 51 -11.913 1.430 -12.647 419 H GLU 52 H GLU 52 -5.118 5.766 -13.199 420 HA GLU 52 HA GLU 52 -3.656 7.356 -15.186 421 HB2 GLU 52 2HB GLU 52 -1.803 7.603 -13.632 422 HB3 GLU 52 1HB GLU 52 -3.272 8.267 -12.934 423 HG2 GLU 52 2HG GLU 52 -3.509 6.400 -11.507 424 HG3 GLU 52 1HG GLU 52 -2.217 5.529 -12.314 425 H ALA 53 H ALA 53 -1.880 6.504 -16.082 426 HA ALA 53 HA ALA 53 -1.869 3.738 -16.605 427 HB1 ALA 53 1HB ALA 53 0.373 5.721 -17.012 428 HB2 ALA 53 2HB ALA 53 -0.922 5.392 -18.160 429 HB3 ALA 53 3HB ALA 53 0.253 4.133 -17.764 430 H ALA 54 H ALA 54 -1.113 2.118 -15.527 431 HA ALA 54 HA ALA 54 -0.122 2.247 -12.949 432 HB1 ALA 54 1HB ALA 54 0.230 -0.005 -14.911 433 HB2 ALA 54 2HB ALA 54 -1.194 0.269 -13.912 434 HB3 ALA 54 3HB ALA 54 0.357 -0.122 -13.155 435 H SER 55 H SER 55 1.912 1.720 -12.088 436 HA SER 55 HA SER 55 4.008 2.971 -13.658 437 HB2 SER 55 2HB SER 55 3.825 2.411 -10.693 438 HB3 SER 55 1HB SER 55 5.078 3.355 -11.499 439 HG SER 55 HG SER 55 2.667 4.256 -12.215 440 H LYS 56 H LYS 56 6.017 1.997 -13.852 441 HA LYS 56 HA LYS 56 6.029 -0.756 -14.308 442 HB2 LYS 56 2HB LYS 56 8.369 1.099 -13.940 443 HB3 LYS 56 1HB LYS 56 8.440 -0.503 -14.659 444 HG2 LYS 56 2HG LYS 56 6.959 0.228 -16.455 445 HG3 LYS 56 1HG LYS 56 6.889 1.836 -15.742 446 HD2 LYS 56 2HD LYS 56 9.305 2.073 -16.040 447 HD3 LYS 56 1HD LYS 56 9.375 0.460 -16.750 448 HE2 LYS 56 2HE LYS 56 7.834 2.806 -17.836 449 HE3 LYS 56 1HE LYS 56 9.348 2.180 -18.489 450 HZ1 LYS 56 3HZ LYS 56 8.188 0.072 -18.933 451 HZ2 LYS 56 1HZ LYS 56 7.478 1.369 -19.749 452 HZ3 LYS 56 2HZ LYS 56 6.759 0.728 -18.368 453 H THR 57 H THR 57 6.858 1.088 -11.472 454 HA THR 57 HA THR 57 8.209 -0.906 -10.061 455 HB THR 57 HB THR 57 7.390 0.427 -8.055 456 HG1 THR 57 1HG THR 57 5.838 1.803 -8.379 457 HG21 THR 57 3HG2 THR 57 8.758 1.932 -10.303 458 HG22 THR 57 1HG2 THR 57 9.552 0.900 -9.123 459 HG23 THR 57 2HG2 THR 57 8.786 2.398 -8.599 460 H ALA 58 H ALA 58 4.814 0.099 -9.968 461 HA ALA 58 HA ALA 58 3.962 -1.980 -8.224 462 HB1 ALA 58 1HB ALA 58 2.295 -0.328 -10.122 463 HB2 ALA 58 2HB ALA 58 2.712 0.137 -8.476 464 HB3 ALA 58 3HB ALA 58 1.691 -1.273 -8.764 465 H LEU 59 H LEU 59 3.915 -1.597 -11.724 466 HA LEU 59 HA LEU 59 2.576 -3.930 -12.390 467 HB2 LEU 59 2HB LEU 59 4.729 -2.339 -13.766 468 HB3 LEU 59 1HB LEU 59 3.954 -3.795 -14.498 469 HG LEU 59 HG LEU 59 2.491 -1.276 -13.696 470 HD11 LEU 59 1HD1 LEU 59 4.201 -0.749 -15.402 471 HD12 LEU 59 2HD1 LEU 59 2.577 -0.697 -16.083 472 HD13 LEU 59 3HD1 LEU 59 3.617 -2.087 -16.389 473 HD21 LEU 59 3HD2 LEU 59 0.796 -2.146 -15.142 474 HD22 LEU 59 1HD2 LEU 59 1.201 -3.394 -13.971 475 HD23 LEU 59 2HD2 LEU 59 1.814 -3.481 -15.634 476 H LYS 60 H LYS 60 6.032 -3.372 -11.745 477 HA LYS 60 HA LYS 60 6.861 -5.961 -12.364 478 HB2 LYS 60 2HB LYS 60 8.426 -4.100 -12.201 479 HB3 LYS 60 1HB LYS 60 8.139 -3.981 -10.462 480 HG2 LYS 60 2HG LYS 60 10.217 -5.078 -10.955 481 HG3 LYS 60 1HG LYS 60 9.085 -6.206 -10.204 482 HD2 LYS 60 2HD LYS 60 8.512 -7.124 -12.374 483 HD3 LYS 60 1HD LYS 60 9.586 -5.965 -13.165 484 HE2 LYS 60 2HE LYS 60 10.605 -8.119 -12.976 485 HE3 LYS 60 1HE LYS 60 11.450 -6.914 -11.992 486 HZ1 LYS 60 3HZ LYS 60 11.185 -9.029 -10.834 487 HZ2 LYS 60 1HZ LYS 60 9.529 -8.951 -10.998 488 HZ3 LYS 60 2HZ LYS 60 10.330 -7.825 -10.028 489 H LYS 61 H LYS 61 5.807 -4.556 -9.275 490 HA LYS 61 HA LYS 61 6.321 -6.916 -7.805 491 HB2 LYS 61 2HB LYS 61 4.698 -4.466 -7.187 492 HB3 LYS 61 1HB LYS 61 4.603 -5.867 -6.141 493 HG2 LYS 61 2HG LYS 61 6.174 -4.253 -5.251 494 HG3 LYS 61 1HG LYS 61 7.014 -5.719 -5.728 495 HD2 LYS 61 2HD LYS 61 7.721 -4.598 -7.805 496 HD3 LYS 61 1HD LYS 61 6.904 -3.130 -7.266 497 HE2 LYS 61 2HE LYS 61 8.362 -3.082 -5.274 498 HE3 LYS 61 1HE LYS 61 9.162 -4.527 -5.858 499 HZ1 LYS 61 3HZ LYS 61 10.422 -2.595 -6.380 500 HZ2 LYS 61 1HZ LYS 61 9.151 -1.881 -7.194 501 HZ3 LYS 61 2HZ LYS 61 9.888 -3.277 -7.821 502 H SER 62 H SER 62 3.653 -5.892 -9.725 503 HA SER 62 HA SER 62 1.809 -7.807 -8.704 504 HB2 SER 62 2HB SER 62 1.811 -6.332 -11.348 505 HB3 SER 62 1HB SER 62 0.431 -7.144 -10.601 506 HG SER 62 HG SER 62 1.806 -4.832 -9.755 507 H TRP 63 H TRP 63 4.123 -7.701 -11.399 508 HA TRP 63 HA TRP 63 3.291 -10.140 -12.517 509 HB2 TRP 63 2HB TRP 63 4.398 -8.404 -13.835 510 HB3 TRP 63 1HB TRP 63 5.856 -8.581 -12.861 511 HD1 TRP 63 HD TRP 63 7.514 -10.293 -13.601 512 HE1 TRP 63 1HE TRP 63 7.611 -12.129 -15.446 513 HE3 TRP 63 3HE TRP 63 2.664 -10.128 -15.127 514 HZ2 TRP 63 2HZ TRP 63 5.822 -13.322 -17.279 515 HZ3 TRP 63 3HZ TRP 63 1.908 -11.668 -16.918 516 HH2 TRP 63 HH TRP 63 3.465 -13.213 -17.969 517 H LYS 64 H LYS 64 5.499 -9.262 -9.997 518 HA LYS 64 HA LYS 64 7.059 -11.553 -9.916 519 HB2 LYS 64 2HB LYS 64 7.514 -9.466 -8.614 520 HB3 LYS 64 1HB LYS 64 6.164 -9.830 -7.566 521 HG2 LYS 64 2HG LYS 64 8.599 -11.616 -7.799 522 HG3 LYS 64 1HG LYS 64 8.495 -10.297 -6.651 523 HD2 LYS 64 2HD LYS 64 6.566 -12.617 -6.782 524 HD3 LYS 64 1HD LYS 64 7.954 -12.554 -5.700 525 HE2 LYS 64 2HE LYS 64 5.639 -10.605 -5.723 526 HE3 LYS 64 1HE LYS 64 5.866 -11.923 -4.579 527 HZ1 LYS 64 3HZ LYS 64 6.589 -9.752 -3.741 528 HZ2 LYS 64 1HZ LYS 64 7.776 -9.670 -4.916 529 HZ3 LYS 64 2HZ LYS 64 7.820 -10.875 -3.719 530 H ARG 65 H ARG 65 3.802 -10.960 -8.735 531 HA ARG 65 HA ARG 65 3.302 -13.287 -7.178 532 HB2 ARG 65 2HB ARG 65 1.653 -11.230 -7.707 533 HB3 ARG 65 1HB ARG 65 1.407 -12.110 -9.140 534 HG2 ARG 65 2HG ARG 65 -0.380 -12.701 -7.783 535 HG3 ARG 65 1HG ARG 65 0.682 -14.099 -7.885 536 HD2 ARG 65 2HD ARG 65 1.635 -13.349 -5.653 537 HD3 ARG 65 1HD ARG 65 0.323 -12.148 -5.726 538 HE ARG 65 HE ARG 65 -0.682 -14.764 -6.077 539 HH11 ARG 65 1HH1 ARG 65 0.331 -12.458 -3.605 540 HH12 ARG 65 2HH1 ARG 65 -0.610 -13.121 -2.362 541 HH21 ARG 65 1HH2 ARG 65 -1.987 -15.729 -4.378 542 HH22 ARG 65 2HH2 ARG 65 -1.956 -15.057 -2.821 543 H TYR 66 H TYR 66 3.044 -12.532 -10.593 544 HA TYR 66 HA TYR 66 1.701 -14.763 -11.600 545 HB2 TYR 66 2HB TYR 66 2.297 -12.524 -12.717 546 HB3 TYR 66 1HB TYR 66 3.846 -13.265 -13.070 547 HD1 TYR 66 1HD TYR 66 3.813 -15.457 -14.442 548 HD2 TYR 66 2HD TYR 66 0.492 -12.852 -14.073 549 HE1 TYR 66 1HE TYR 66 2.824 -16.444 -16.451 550 HE2 TYR 66 2HE TYR 66 -0.504 -13.798 -16.051 551 HH TYR 66 HH TYR 66 0.582 -16.710 -17.411 552 H GLU 67 H GLU 67 5.142 -14.063 -11.523 553 HA GLU 67 HA GLU 67 6.153 -16.503 -12.513 554 HB2 GLU 67 2HB GLU 67 7.390 -14.665 -10.465 555 HB3 GLU 67 1HB GLU 67 8.240 -15.795 -11.514 556 HG2 GLU 67 2HG GLU 67 6.613 -13.493 -12.457 557 HG3 GLU 67 1HG GLU 67 8.354 -13.397 -12.204 558 H GLN 68 H GLN 68 5.685 -15.387 -9.250 559 HA GLN 68 HA GLN 68 6.541 -17.705 -7.947 560 HB2 GLN 68 2HB GLN 68 4.668 -15.551 -7.075 561 HB3 GLN 68 1HB GLN 68 5.038 -16.901 -6.019 562 HG2 GLN 68 2HG GLN 68 7.040 -14.993 -7.204 563 HG3 GLN 68 1HG GLN 68 6.435 -14.944 -5.548 564 HE21 GLN 68 1HE2 GLN 68 8.511 -16.571 -7.789 565 HE22 GLN 68 2HE2 GLN 68 9.310 -17.587 -6.643 566 H GLU 69 H GLU 69 3.315 -16.931 -9.068 567 HA GLU 69 HA GLU 69 2.142 -19.286 -7.978 568 HB2 GLU 69 2HB GLU 69 1.183 -17.398 -10.114 569 HB3 GLU 69 1HB GLU 69 0.214 -18.696 -9.432 570 HG2 GLU 69 2HG GLU 69 1.365 -16.390 -7.876 571 HG3 GLU 69 1HG GLU 69 -0.288 -16.477 -8.475 572 H MET 70 H MET 70 3.052 -18.395 -11.304 573 HA MET 70 HA MET 70 2.195 -20.959 -12.267 574 HB2 MET 70 2HB MET 70 2.744 -20.207 -14.501 575 HB3 MET 70 1HB MET 70 1.833 -18.984 -13.652 576 HG2 MET 70 2HG MET 70 3.441 -17.816 -14.868 577 HG3 MET 70 1HG MET 70 4.061 -17.843 -13.224 578 HE1 MET 70 3HE MET 70 4.104 -20.772 -15.896 579 HE2 MET 70 1HE MET 70 5.646 -20.458 -16.681 580 HE3 MET 70 2HE MET 70 4.329 -19.299 -16.836 581 H LEU 71 H LEU 71 5.252 -19.833 -11.116 582 HA LEU 71 HA LEU 71 6.768 -21.606 -12.623 583 HB2 LEU 71 2HB LEU 71 7.739 -19.701 -11.581 584 HB3 LEU 71 1HB LEU 71 7.316 -20.236 -9.984 585 HG LEU 71 HG LEU 71 8.874 -22.096 -10.230 586 HD11 LEU 71 1HD1 LEU 71 10.503 -22.070 -12.115 587 HD12 LEU 71 2HD1 LEU 71 9.597 -20.745 -12.849 588 HD13 LEU 71 3HD1 LEU 71 8.852 -22.335 -12.673 589 HD21 LEU 71 3HD2 LEU 71 9.615 -20.032 -9.178 590 HD22 LEU 71 1HD2 LEU 71 10.082 -19.381 -10.746 591 HD23 LEU 71 2HD2 LEU 71 10.939 -20.766 -10.076 592 H LYS 72 H LYS 72 4.732 -22.123 -9.874 593 HA LYS 72 HA LYS 72 5.891 -24.653 -9.155 594 HB2 LYS 72 2HB LYS 72 3.262 -23.404 -8.391 595 HB3 LYS 72 1HB LYS 72 3.629 -25.063 -7.996 596 HG2 LYS 72 2HG LYS 72 4.028 -23.681 -6.081 597 HG3 LYS 72 1HG LYS 72 5.569 -24.278 -6.679 598 HD2 LYS 72 2HD LYS 72 6.018 -22.147 -7.716 599 HD3 LYS 72 1HD LYS 72 4.421 -21.560 -7.258 600 HE2 LYS 72 2HE LYS 72 5.010 -21.848 -4.888 601 HE3 LYS 72 1HE LYS 72 6.624 -22.376 -5.361 602 HZ1 LYS 72 3HZ LYS 72 5.428 -19.776 -6.029 603 HZ2 LYS 72 1HZ LYS 72 7.017 -20.240 -6.340 604 HZ3 LYS 72 2HZ LYS 72 6.511 -20.006 -4.734 605 H ASN 73 H ASN 73 3.754 -23.684 -11.675 606 HA ASN 73 HA ASN 73 2.873 -26.433 -11.838 607 HB2 ASN 73 2HB ASN 73 1.081 -25.741 -13.422 608 HB3 ASN 73 1HB ASN 73 0.966 -24.925 -11.883 609 HD21 ASN 73 1HD2 ASN 73 3.086 -23.969 -14.591 610 HD22 ASN 73 2HD2 ASN 73 2.229 -22.515 -14.935 611 H GLU 74 H GLU 74 3.619 -27.835 -13.193 612 HA GLU 74 HA GLU 74 5.589 -26.899 -15.044 613 HB2 GLU 74 2HB GLU 74 4.824 -29.703 -14.263 614 HB3 GLU 74 1HB GLU 74 5.884 -29.383 -15.622 615 HG2 GLU 74 2HG GLU 74 7.172 -29.970 -13.664 616 HG3 GLU 74 1HG GLU 74 7.489 -28.302 -14.109 617 H LYS 75 H LYS 75 3.883 -25.729 -16.098 618 HA LYS 75 HA LYS 75 3.599 -26.898 -18.603 619 HB2 LYS 75 2HB LYS 75 1.087 -26.535 -18.886 620 HB3 LYS 75 1HB LYS 75 1.554 -27.899 -17.906 621 HG2 LYS 75 2HG LYS 75 -0.324 -26.989 -16.834 622 HG3 LYS 75 1HG LYS 75 1.034 -26.405 -15.885 623 HD2 LYS 75 2HD LYS 75 0.861 -24.222 -16.971 624 HD3 LYS 75 1HD LYS 75 -0.444 -24.821 -18.003 625 HE2 LYS 75 2HE LYS 75 -1.814 -25.237 -16.010 626 HE3 LYS 75 1HE LYS 75 -0.520 -24.620 -14.986 627 HZ1 LYS 75 3HZ LYS 75 -2.050 -23.060 -17.013 628 HZ2 LYS 75 1HZ LYS 75 -0.776 -22.458 -16.096 629 HZ3 LYS 75 2HZ LYS 75 -2.194 -22.930 -15.348 630 H VAL 76 H VAL 76 4.514 -25.535 -19.757 631 HA VAL 76 HA VAL 76 4.382 -22.765 -19.076 632 HB VAL 76 HB VAL 76 5.877 -24.091 -21.333 633 HG11 VAL 76 1HG1 VAL 76 5.498 -21.734 -21.753 634 HG12 VAL 76 2HG1 VAL 76 7.204 -22.021 -21.400 635 HG13 VAL 76 3HG1 VAL 76 6.152 -21.327 -20.167 636 HG21 VAL 76 3HG2 VAL 76 6.863 -23.264 -18.603 637 HG22 VAL 76 1HG2 VAL 76 7.882 -23.848 -19.921 638 HG23 VAL 76 2HG2 VAL 76 6.677 -24.915 -19.198 639 H ALA 77 H ALA 77 2.429 -22.400 -19.455 640 HA ALA 77 HA ALA 77 0.915 -22.692 -21.822 641 HB1 ALA 77 1HB ALA 77 -0.112 -22.095 -19.684 642 HB2 ALA 77 2HB ALA 77 -0.536 -20.916 -20.928 643 HB3 ALA 77 3HB ALA 77 0.693 -20.528 -19.730 644 H ALA 78 H ALA 78 2.759 -19.865 -20.637 645 HA ALA 78 HA ALA 78 3.400 -19.131 -23.349 646 HB1 ALA 78 1HB ALA 78 2.538 -16.855 -23.105 647 HB2 ALA 78 2HB ALA 78 1.857 -17.276 -21.532 648 HB3 ALA 78 3HB ALA 78 1.238 -18.043 -22.994 649 H LYS 79 H LYS 79 4.998 -17.449 -23.398 650 HA LYS 79 HA LYS 79 6.261 -16.729 -20.890 651 HB2 LYS 79 2HB LYS 79 7.732 -17.886 -23.286 652 HB3 LYS 79 1HB LYS 79 8.536 -17.002 -22.007 653 HG2 LYS 79 2HG LYS 79 6.952 -19.492 -21.428 654 HG3 LYS 79 1HG LYS 79 8.606 -19.582 -22.008 655 HD2 LYS 79 2HD LYS 79 8.545 -19.794 -19.564 656 HD3 LYS 79 1HD LYS 79 9.360 -18.311 -20.016 657 HE2 LYS 79 2HE LYS 79 7.409 -17.024 -19.421 658 HE3 LYS 79 1HE LYS 79 6.474 -18.496 -19.087 659 HZ1 LYS 79 3HZ LYS 79 8.074 -18.944 -17.261 660 HZ2 LYS 79 1HZ LYS 79 7.306 -17.460 -17.057 661 HZ3 LYS 79 2HZ LYS 79 8.872 -17.503 -17.605 662 H MET 80 H MET 80 5.486 -14.707 -21.075 663 HA MET 80 HA MET 80 6.507 -13.095 -23.292 664 HB2 MET 80 2HB MET 80 3.739 -12.921 -22.063 665 HB3 MET 80 1HB MET 80 4.401 -11.777 -23.218 666 HG2 MET 80 2HG MET 80 4.512 -13.503 -24.915 667 HG3 MET 80 1HG MET 80 3.954 -14.703 -23.753 668 HE1 MET 80 3HE MET 80 3.002 -11.483 -25.804 669 HE2 MET 80 1HE MET 80 2.640 -10.988 -24.151 670 HE3 MET 80 2HE MET 80 1.330 -11.217 -25.308 671 H LEU 81 H LEU 81 7.547 -11.313 -22.613 672 HA LEU 81 HA LEU 81 7.194 -10.392 -19.850 673 HB2 LEU 81 2HB LEU 81 9.837 -11.142 -21.107 674 HB3 LEU 81 1HB LEU 81 9.649 -10.323 -19.578 675 HG LEU 81 HG LEU 81 8.723 -13.143 -20.160 676 HD11 LEU 81 1HD1 LEU 81 11.100 -12.122 -18.616 677 HD12 LEU 81 2HD1 LEU 81 11.147 -12.951 -20.170 678 HD13 LEU 81 3HD1 LEU 81 10.591 -13.807 -18.732 679 HD21 LEU 81 3HD2 LEU 81 8.875 -11.595 -17.577 680 HD22 LEU 81 1HD2 LEU 81 8.413 -13.287 -17.744 681 HD23 LEU 81 2HD2 LEU 81 7.395 -12.030 -18.436 682 H GLU 82 H GLU 82 8.467 -8.352 -19.529 683 HA GLU 82 HA GLU 82 8.372 -6.658 -21.891 684 HB2 GLU 82 2HB GLU 82 7.646 -6.131 -19.354 685 HB3 GLU 82 1HB GLU 82 9.362 -5.786 -19.206 686 HG2 GLU 82 2HG GLU 82 7.424 -4.422 -21.058 687 HG3 GLU 82 1HG GLU 82 8.067 -3.760 -19.566 688 H LYS 83 H LYS 83 10.090 -7.286 -23.077 689 HA LYS 83 HA LYS 83 12.555 -8.122 -21.832 690 HB2 LYS 83 2HB LYS 83 11.743 -8.054 -24.725 691 HB3 LYS 83 1HB LYS 83 13.213 -8.782 -24.098 692 HG2 LYS 83 2HG LYS 83 11.880 -10.374 -22.800 693 HG3 LYS 83 1HG LYS 83 10.403 -9.650 -23.434 694 HD2 LYS 83 2HD LYS 83 12.553 -11.004 -25.069 695 HD3 LYS 83 1HD LYS 83 11.008 -11.721 -24.625 696 HE2 LYS 83 2HE LYS 83 9.851 -9.930 -25.889 697 HE3 LYS 83 1HE LYS 83 11.421 -9.280 -26.359 698 HZ1 LYS 83 3HZ LYS 83 10.481 -10.676 -28.094 699 HZ2 LYS 83 1HZ LYS 83 10.401 -11.980 -27.041 700 HZ3 LYS 83 2HZ LYS 83 11.895 -11.368 -27.506 701 H ASP 84 H ASP 84 11.639 -5.701 -24.280 702 HA ASP 84 HA ASP 84 13.832 -4.015 -23.430 703 HB2 ASP 84 2HB ASP 84 14.991 -5.515 -24.967 704 HB3 ASP 84 1HB ASP 84 13.804 -5.180 -26.219 705 H ALA 85 H ALA 85 13.498 -1.949 -23.852 706 HA ALA 85 HA ALA 85 11.707 -1.042 -25.958 707 HB1 ALA 85 1HB ALA 85 11.395 -0.318 -23.037 708 HB2 ALA 85 2HB ALA 85 10.257 -1.288 -23.977 709 HB3 ALA 85 3HB ALA 85 10.498 0.416 -24.365 710 H THR 86 H THR 86 14.546 -1.051 -25.590 711 HA THR 86 HA THR 86 15.434 1.320 -24.309 712 HB THR 86 HB THR 86 17.655 0.758 -25.398 713 HG1 THR 86 1HG THR 86 16.514 -1.773 -25.976 714 HG21 THR 86 3HG2 THR 86 18.012 -1.176 -23.909 715 HG22 THR 86 1HG2 THR 86 16.267 -1.330 -23.715 716 HG23 THR 86 2HG2 THR 86 17.098 0.106 -23.112 717 H GLU 87 H GLU 87 16.715 3.010 -25.241 718 HA GLU 87 HA GLU 87 15.427 4.114 -27.605 719 HB2 GLU 87 2HB GLU 87 15.524 5.455 -25.543 720 HB3 GLU 87 1HB GLU 87 17.274 5.344 -25.549 721 HG2 GLU 87 2HG GLU 87 16.520 7.513 -26.344 722 HG3 GLU 87 1HG GLU 87 17.360 6.627 -27.614 723 H VAL 88 H VAL 88 18.647 3.481 -26.288 724 HA VAL 88 HA VAL 88 20.677 3.193 -27.167 725 HB VAL 88 HB VAL 88 19.228 2.678 -29.798 726 HG11 VAL 88 1HG1 VAL 88 22.071 2.016 -29.028 727 HG12 VAL 88 2HG1 VAL 88 21.576 3.265 -30.166 728 HG13 VAL 88 3HG1 VAL 88 21.278 1.567 -30.538 729 HG21 VAL 88 3HG2 VAL 88 20.289 0.746 -27.731 730 HG22 VAL 88 1HG2 VAL 88 19.556 0.300 -29.271 731 HG23 VAL 88 2HG2 VAL 88 18.591 1.104 -28.031 732 H GLY 89 H GLY 89 21.433 5.235 -26.783 733 HA2 GLY 89 2HA GLY 89 22.519 6.645 -28.827 734 HA3 GLY 89 1HA GLY 89 20.931 7.365 -28.606 735 H VAL 90 H VAL 90 23.057 8.926 -28.264 736 HA VAL 90 HA VAL 90 22.767 10.069 -25.746 737 HB VAL 90 HB VAL 90 24.152 8.016 -25.117 738 HG11 VAL 90 1HG1 VAL 90 25.517 7.786 -27.044 739 HG12 VAL 90 2HG1 VAL 90 26.546 7.988 -25.625 740 HG13 VAL 90 3HG1 VAL 90 26.301 9.334 -26.734 741 HG21 VAL 90 3HG2 VAL 90 25.446 10.690 -24.587 742 HG22 VAL 90 1HG2 VAL 90 25.760 9.217 -23.673 743 HG23 VAL 90 2HG2 VAL 90 24.155 9.949 -23.646 744 H LYS 91 H LYS 91 24.624 11.948 -25.604 745 HA LYS 91 HA LYS 91 24.800 12.877 -28.333 746 HB2 LYS 91 2HB LYS 91 25.501 14.405 -25.800 747 HB3 LYS 91 1HB LYS 91 25.611 15.063 -27.412 748 HG2 LYS 91 2HG LYS 91 23.624 15.907 -26.411 749 HG3 LYS 91 1HG LYS 91 23.128 14.722 -27.616 750 HD2 LYS 91 2HD LYS 91 22.843 13.053 -25.846 751 HD3 LYS 91 1HD LYS 91 23.368 14.246 -24.659 752 HE2 LYS 91 2HE LYS 91 21.452 15.645 -25.187 753 HE3 LYS 91 1HE LYS 91 20.934 14.490 -26.415 754 HZ1 LYS 91 3HZ LYS 91 20.636 12.837 -24.688 755 HZ2 LYS 91 1HZ LYS 91 19.716 14.212 -24.374 756 HZ3 LYS 91 2HZ LYS 91 21.134 13.931 -23.497 757 H ALA 92 H ALA 92 26.299 11.253 -28.895 758 HA ALA 92 HA ALA 92 29.041 11.756 -28.021 759 HB1 ALA 92 1HB ALA 92 28.287 9.421 -27.961 760 HB2 ALA 92 2HB ALA 92 29.567 9.633 -29.159 761 HB3 ALA 92 3HB ALA 92 27.884 9.506 -29.676 762 H ALA 93 H ALA 93 30.105 13.196 -29.207 763 HA ALA 93 HA ALA 93 29.948 13.040 -32.091 764 HB1 ALA 93 1HB ALA 93 29.446 15.417 -32.363 765 HB2 ALA 93 2HB ALA 93 29.258 15.581 -30.618 766 HB3 ALA 93 3HB ALA 93 28.135 14.576 -31.533 767 H LEU 94 H LEU 94 32.004 13.009 -32.686 768 HA LEU 94 HA LEU 94 33.925 14.366 -31.016 769 HB2 LEU 94 2HB LEU 94 35.737 13.336 -32.307 770 HB3 LEU 94 1HB LEU 94 34.624 12.127 -31.731 771 HG LEU 94 HG LEU 94 34.779 13.133 -34.591 772 HD11 LEU 94 1HD1 LEU 94 35.814 10.587 -33.364 773 HD12 LEU 94 2HD1 LEU 94 36.787 11.929 -33.967 774 HD13 LEU 94 3HD1 LEU 94 35.814 10.975 -35.085 775 HD21 LEU 94 3HD2 LEU 94 33.414 11.139 -35.118 776 HD22 LEU 94 1HD2 LEU 94 32.563 12.278 -34.079 777 HD23 LEU 94 2HD2 LEU 94 33.257 10.810 -33.391 778 H GLU 95 H GLU 95 33.403 16.399 -31.297 779 HA GLU 95 HA GLU 95 33.527 17.558 -33.946 780 HB2 GLU 95 2HB GLU 95 32.839 18.791 -31.278 781 HB3 GLU 95 1HB GLU 95 32.760 19.616 -32.827 782 HG2 GLU 95 2HG GLU 95 31.064 17.995 -33.571 783 HG3 GLU 95 1HG GLU 95 31.108 17.253 -31.972 784 H GLU 96 H GLU 96 35.463 17.963 -34.626 785 HA GLU 96 HA GLU 96 37.501 18.814 -32.721 786 HB2 GLU 96 2HB GLU 96 37.926 16.819 -34.164 787 HB3 GLU 96 1HB GLU 96 37.776 17.847 -35.575 788 HG2 GLU 96 2HG GLU 96 40.108 17.363 -34.969 789 HG3 GLU 96 1HG GLU 96 39.731 19.087 -34.946 790 H ALA 97 H ALA 97 38.657 20.734 -33.099 791 HA ALA 97 HA ALA 97 37.543 22.471 -35.175 792 HB1 ALA 97 1HB ALA 97 37.579 24.358 -33.619 793 HB2 ALA 97 2HB ALA 97 38.133 23.292 -32.329 794 HB3 ALA 97 3HB ALA 97 36.527 23.072 -33.025 795 H LYS 98 H LYS 98 39.092 23.076 -36.489 796 HA LYS 98 HA LYS 98 41.843 23.072 -35.526 797 HB2 LYS 98 2HB LYS 98 40.748 23.240 -38.349 798 HB3 LYS 98 1HB LYS 98 42.444 23.421 -37.966 799 HG2 LYS 98 2HG LYS 98 42.047 21.200 -38.790 800 HG3 LYS 98 1HG LYS 98 42.443 21.100 -37.077 801 HD2 LYS 98 2HD LYS 98 40.050 20.879 -36.559 802 HD3 LYS 98 1HD LYS 98 39.677 20.974 -38.278 803 HE2 LYS 98 2HE LYS 98 41.364 18.846 -36.963 804 HE3 LYS 98 1HE LYS 98 39.688 18.649 -37.447 805 HZ1 LYS 98 3HZ LYS 98 41.159 17.723 -39.072 806 HZ2 LYS 98 1HZ LYS 98 41.990 19.167 -39.253 807 HZ3 LYS 98 2HZ LYS 98 40.386 19.036 -39.754 808 H LYS 99 H LYS 99 43.191 24.841 -35.784 809 HA LYS 99 HA LYS 99 41.762 27.400 -35.840 810 HB2 LYS 99 2HB LYS 99 44.492 26.676 -34.772 811 HB3 LYS 99 1HB LYS 99 43.752 28.261 -34.639 812 HG2 LYS 99 2HG LYS 99 42.721 25.722 -33.360 813 HG3 LYS 99 1HG LYS 99 43.636 26.982 -32.539 814 HD2 LYS 99 2HD LYS 99 40.945 27.390 -33.857 815 HD3 LYS 99 1HD LYS 99 41.186 27.093 -32.139 816 HE2 LYS 99 2HE LYS 99 42.307 29.439 -33.685 817 HE3 LYS 99 1HE LYS 99 40.886 29.481 -32.650 818 HZ1 LYS 99 3HZ LYS 99 42.831 30.303 -31.477 819 HZ2 LYS 99 1HZ LYS 99 43.656 28.860 -31.736 820 HZ3 LYS 99 2HZ LYS 99 42.298 28.894 -30.759 821 H VAL 100 H VAL 100 42.553 29.050 -37.192 822 HA VAL 100 HA VAL 100 44.023 28.018 -39.464 823 HB VAL 100 HB VAL 100 43.467 30.124 -40.615 824 HG11 VAL 100 1HG1 VAL 100 41.041 29.813 -40.748 825 HG12 VAL 100 2HG1 VAL 100 41.103 28.811 -39.296 826 HG13 VAL 100 3HG1 VAL 100 41.913 28.278 -40.765 827 HG21 VAL 100 3HG2 VAL 100 42.045 30.879 -38.051 828 HG22 VAL 100 1HG2 VAL 100 41.953 31.767 -39.570 829 HG23 VAL 100 2HG2 VAL 100 43.483 31.656 -38.705 830 H GLN 101 H GLN 101 45.857 28.979 -40.310 831 HA GLN 101 HA GLN 101 47.385 30.635 -38.424 832 HB2 GLN 101 2HB GLN 101 48.357 28.365 -40.165 833 HB3 GLN 101 1HB GLN 101 49.423 29.490 -39.338 834 HG2 GLN 101 2HG GLN 101 47.425 27.719 -37.960 835 HG3 GLN 101 1HG GLN 101 49.135 27.329 -38.157 836 HE21 GLN 101 1HE2 GLN 101 46.829 29.385 -36.549 837 HE22 GLN 101 2HE2 GLN 101 47.910 29.994 -35.361 838 H ILE 102 H ILE 102 48.711 32.165 -39.321 839 HA ILE 102 HA ILE 102 47.906 32.904 -41.988 840 HB ILE 102 HB ILE 102 48.882 35.129 -41.596 841 HG12 ILE 102 2HG1 ILE 102 50.627 34.570 -39.879 842 HG13 ILE 102 1HG1 ILE 102 49.624 35.928 -39.412 843 HG21 ILE 102 1HG2 ILE 102 46.869 34.281 -39.558 844 HG22 ILE 102 2HG2 ILE 102 46.573 34.821 -41.211 845 HG23 ILE 102 3HG2 ILE 102 47.217 35.949 -40.014 846 HD11 ILE 102 3HD1 ILE 102 50.057 34.568 -37.495 847 HD12 ILE 102 1HD1 ILE 102 49.507 33.110 -38.315 848 HD13 ILE 102 2HD1 ILE 102 48.359 34.381 -37.917 849 H GLU 103 H GLU 103 48.984 31.957 -43.443 850 HA GLU 103 HA GLU 103 51.864 31.566 -43.185 851 HB2 GLU 103 2HB GLU 103 49.994 30.780 -45.426 852 HB3 GLU 103 1HB GLU 103 51.650 30.256 -45.215 853 HG2 GLU 103 2HG GLU 103 50.997 29.060 -43.172 854 HG3 GLU 103 1HG GLU 103 49.325 29.568 -43.435 855 H LEU 104 H LEU 104 53.033 32.015 -45.358 856 HA LEU 104 HA LEU 104 52.280 34.679 -46.216 857 HB2 LEU 104 2HB LEU 104 54.651 34.225 -45.579 858 HB3 LEU 104 1HB LEU 104 54.748 33.043 -46.862 859 HG LEU 104 HG LEU 104 54.397 34.846 -48.522 860 HD11 LEU 104 1HD1 LEU 104 54.589 37.179 -47.825 861 HD12 LEU 104 2HD1 LEU 104 54.569 36.676 -46.133 862 HD13 LEU 104 3HD1 LEU 104 53.153 36.410 -47.152 863 HD21 LEU 104 3HD2 LEU 104 56.654 34.136 -47.939 864 HD22 LEU 104 1HD2 LEU 104 56.690 35.298 -46.615 865 HD23 LEU 104 2HD2 LEU 104 56.610 35.868 -48.280 866 H ASP 105 H ASP 105 50.500 34.216 -47.415 867 HA ASP 105 HA ASP 105 50.395 32.154 -49.364 868 HB2 ASP 105 2HB ASP 105 48.614 34.588 -49.047 869 HB3 ASP 105 1HB ASP 105 48.312 33.279 -50.176 870 H THR 106 H THR 106 50.962 35.622 -49.554 871 HA THR 106 HA THR 106 51.713 35.294 -52.337 872 HB THR 106 HB THR 106 52.060 37.728 -52.284 873 HG1 THR 106 1HG THR 106 52.452 37.612 -49.903 874 HG21 THR 106 3HG2 THR 106 49.676 38.385 -51.997 875 HG22 THR 106 1HG2 THR 106 49.373 36.832 -51.221 876 HG23 THR 106 2HG2 THR 106 49.860 36.893 -52.917 877 H SER 107 H SER 107 53.523 33.971 -52.055 878 HA SER 107 HA SER 107 55.679 35.088 -50.457 879 HB2 SER 107 2HB SER 107 56.671 32.799 -50.689 880 HB3 SER 107 1HB SER 107 55.134 32.871 -49.827 881 HG SER 107 HG SER 107 55.781 31.498 -52.015 882 H LEU 108 H LEU 108 54.976 33.956 -53.729 883 HA LEU 108 HA LEU 108 57.656 34.738 -54.399 884 HB2 LEU 108 2HB LEU 108 57.212 33.665 -56.668 885 HB3 LEU 108 1HB LEU 108 57.307 32.623 -55.273 886 HG LEU 108 HG LEU 108 54.848 32.461 -55.271 887 HD11 LEU 108 1HD1 LEU 108 53.583 33.080 -57.279 888 HD12 LEU 108 2HD1 LEU 108 55.010 33.890 -57.925 889 HD13 LEU 108 3HD1 LEU 108 54.240 34.493 -56.456 890 HD21 LEU 108 3HD2 LEU 108 56.186 30.727 -56.255 891 HD22 LEU 108 1HD2 LEU 108 56.238 31.597 -57.788 892 HD23 LEU 108 2HD2 LEU 108 54.710 30.949 -57.195 893 H SER 109 H SER 109 58.278 36.421 -55.356 894 HA SER 109 HA SER 109 56.267 38.264 -56.419 895 HB2 SER 109 2HB SER 109 59.177 38.731 -55.719 896 HB3 SER 109 1HB SER 109 58.004 39.969 -56.173 897 HG SER 109 HG SER 109 57.944 38.289 -53.899 898 H TYR 110 H TYR 110 59.190 36.516 -57.138 899 HA TYR 110 HA TYR 110 59.215 37.388 -59.898 900 HB2 TYR 110 2HB TYR 110 61.347 37.371 -58.741 901 HB3 TYR 110 1HB TYR 110 61.098 35.709 -58.235 902 HD1 TYR 110 2HD TYR 110 61.538 37.818 -61.268 903 HD2 TYR 110 1HD TYR 110 61.952 33.962 -59.526 904 HE1 TYR 110 2HE TYR 110 62.747 37.043 -63.261 905 HE2 TYR 110 1HE TYR 110 63.161 33.182 -61.509 906 HH TYR 110 HH TYR 110 64.384 35.321 -63.760 907 H ILE 111 H ILE 111 57.926 36.288 -61.214 908 HA ILE 111 HA ILE 111 58.008 33.448 -61.192 909 HB ILE 111 HB ILE 111 56.207 33.780 -59.637 910 HG12 ILE 111 2HG1 ILE 111 54.279 32.704 -60.815 911 HG13 ILE 111 1HG1 ILE 111 55.100 33.006 -62.340 912 HG21 ILE 111 1HG2 ILE 111 54.138 35.014 -60.131 913 HG22 ILE 111 2HG2 ILE 111 54.890 35.610 -61.611 914 HG23 ILE 111 3HG2 ILE 111 55.573 36.040 -60.049 915 HD11 ILE 111 3HD1 ILE 111 56.128 31.288 -60.091 916 HD12 ILE 111 1HD1 ILE 111 56.946 31.575 -61.625 917 HD13 ILE 111 2HD1 ILE 111 55.411 30.712 -61.597 Start of MODEL 17 1 H1 GLY -1 1HT GLY -1 -4.531 -1.885 -30.358 2 H2 GLY -1 2HT GLY -1 -3.233 -2.440 -31.247 3 H3 GLY -1 3HT GLY -1 -3.944 -0.966 -31.643 4 HA2 GLY -1 1HA GLY -1 -1.843 -0.644 -30.497 5 HA3 GLY -1 2HA GLY -1 -3.189 -0.037 -29.542 6 H SER 0 H SER 0 -3.571 -0.919 -27.554 7 HA SER 0 HA SER 0 -2.348 -3.435 -26.873 8 HB2 SER 0 2HB SER 0 -1.418 -2.410 -24.765 9 HB3 SER 0 1HB SER 0 -0.611 -1.868 -26.237 10 HG SER 0 HG SER 0 -1.879 0.008 -26.149 11 H MET 1 H MET 1 -3.239 -4.189 -24.766 12 HA MET 1 HA MET 1 -6.024 -3.434 -24.639 13 HB2 MET 1 2HB MET 1 -4.498 -5.742 -23.437 14 HB3 MET 1 1HB MET 1 -6.185 -5.428 -23.068 15 HG2 MET 1 2HG MET 1 -5.991 -7.172 -24.737 16 HG3 MET 1 1HG MET 1 -6.746 -5.750 -25.437 17 HE1 MET 1 3HE MET 1 -4.777 -7.342 -28.444 18 HE2 MET 1 1HE MET 1 -6.345 -6.774 -27.871 19 HE3 MET 1 2HE MET 1 -5.596 -8.192 -27.134 20 H THR 2 H THR 2 -6.606 -1.890 -23.385 21 HA THR 2 HA THR 2 -5.030 -1.104 -21.108 22 HB THR 2 HB THR 2 -7.643 0.004 -22.167 23 HG1 THR 2 1HG THR 2 -4.926 0.534 -22.726 24 HG21 THR 2 3HG2 THR 2 -7.148 0.662 -19.843 25 HG22 THR 2 1HG2 THR 2 -6.985 2.038 -20.935 26 HG23 THR 2 2HG2 THR 2 -5.547 1.207 -20.339 27 H VAL 3 H VAL 3 -5.371 -1.960 -19.189 28 HA VAL 3 HA VAL 3 -8.051 -3.076 -18.586 29 HB VAL 3 HB VAL 3 -5.552 -3.680 -17.003 30 HG11 VAL 3 1HG1 VAL 3 -7.595 -4.180 -15.857 31 HG12 VAL 3 2HG1 VAL 3 -6.753 -5.668 -16.369 32 HG13 VAL 3 3HG1 VAL 3 -8.147 -5.111 -17.267 33 HG21 VAL 3 3HG2 VAL 3 -6.627 -5.359 -19.261 34 HG22 VAL 3 1HG2 VAL 3 -5.367 -5.787 -18.105 35 HG23 VAL 3 2HG2 VAL 3 -5.090 -4.462 -19.251 36 H TYR 4 H TYR 4 -9.167 -2.228 -16.830 37 HA TYR 4 HA TYR 4 -7.849 -0.039 -15.447 38 HB2 TYR 4 2HB TYR 4 -10.779 -0.736 -15.711 39 HB3 TYR 4 1HB TYR 4 -10.127 0.660 -14.851 40 HD1 TYR 4 2HD TYR 4 -10.574 -0.856 -18.196 41 HD2 TYR 4 1HD TYR 4 -9.428 2.608 -16.022 42 HE1 TYR 4 2HE TYR 4 -10.607 0.443 -20.270 43 HE2 TYR 4 1HE TYR 4 -9.459 3.923 -18.089 44 HH TYR 4 HH TYR 4 -10.874 2.773 -20.906 45 H ILE 5 H ILE 5 -7.404 -0.162 -13.380 46 HA ILE 5 HA ILE 5 -8.331 -2.506 -11.815 47 HB ILE 5 HB ILE 5 -5.888 -0.814 -11.267 48 HG12 ILE 5 2HG1 ILE 5 -4.458 -2.586 -11.818 49 HG13 ILE 5 1HG1 ILE 5 -5.694 -3.687 -12.311 50 HG21 ILE 5 1HG2 ILE 5 -6.808 -1.793 -9.306 51 HG22 ILE 5 2HG2 ILE 5 -5.262 -2.561 -9.670 52 HG23 ILE 5 3HG2 ILE 5 -6.777 -3.392 -10.030 53 HD11 ILE 5 3HD1 ILE 5 -4.723 -1.173 -13.721 54 HD12 ILE 5 1HD1 ILE 5 -6.147 -2.074 -14.235 55 HD13 ILE 5 2HD1 ILE 5 -4.565 -2.844 -14.266 56 H CYS 6 H CYS 6 -9.824 -1.784 -10.362 57 HA CYS 6 HA CYS 6 -9.076 0.609 -8.916 58 HB2 CYS 6 2HB CYS 6 -11.057 1.172 -10.301 59 HB3 CYS 6 1HB CYS 6 -11.923 -0.179 -9.573 60 HG CYS 6 HG CYS 6 -13.033 1.821 -8.327 61 HA PRO 7 HA PRO 7 -8.962 -2.882 -5.996 62 HB2 PRO 7 2HB PRO 7 -7.789 -0.714 -4.340 63 HB3 PRO 7 1HB PRO 7 -7.178 -2.343 -4.647 64 HG2 PRO 7 2HG PRO 7 -6.029 -0.232 -5.791 65 HG3 PRO 7 1HG PRO 7 -6.242 -1.747 -6.686 66 HD2 PRO 7 2HD PRO 7 -7.805 0.797 -6.865 67 HD3 PRO 7 1HD PRO 7 -7.279 -0.316 -8.154 68 H GLU 8 H GLU 8 -10.400 0.169 -5.901 69 HA GLU 8 HA GLU 8 -11.548 -0.071 -3.258 70 HB2 GLU 8 2HB GLU 8 -12.039 2.076 -5.306 71 HB3 GLU 8 1HB GLU 8 -12.246 2.174 -3.558 72 HG2 GLU 8 2HG GLU 8 -9.798 1.790 -3.324 73 HG3 GLU 8 1HG GLU 8 -9.758 1.846 -5.089 74 H THR 9 H THR 9 -12.830 0.478 -6.570 75 HA THR 9 HA THR 9 -15.440 -0.358 -5.576 76 HB THR 9 HB THR 9 -16.370 0.813 -7.511 77 HG1 THR 9 1HG THR 9 -15.110 0.973 -9.182 78 HG21 THR 9 3HG2 THR 9 -14.209 2.395 -6.113 79 HG22 THR 9 1HG2 THR 9 -15.857 2.158 -5.521 80 HG23 THR 9 2HG2 THR 9 -15.568 3.101 -6.985 81 H GLY 10 H GLY 10 -12.860 -1.558 -7.465 82 HA2 GLY 10 2HA GLY 10 -14.704 -3.303 -8.918 83 HA3 GLY 10 1HA GLY 10 -13.067 -3.061 -9.451 84 H ASP 11 H ASP 11 -13.108 -5.374 -9.514 85 HA ASP 11 HA ASP 11 -12.068 -6.629 -7.193 86 HB2 ASP 11 2HB ASP 11 -14.486 -6.726 -6.652 87 HB3 ASP 11 1HB ASP 11 -14.797 -7.499 -8.200 88 H ASP 12 H ASP 12 -11.046 -8.550 -7.783 89 HA ASP 12 HA ASP 12 -10.384 -8.671 -10.554 90 HB2 ASP 12 2HB ASP 12 -9.602 -10.661 -8.416 91 HB3 ASP 12 1HB ASP 12 -8.964 -10.622 -10.049 92 H GLY 13 H GLY 13 -13.071 -9.918 -9.051 93 HA2 GLY 13 2HA GLY 13 -13.306 -12.304 -10.625 94 HA3 GLY 13 1HA GLY 13 -14.576 -11.545 -9.673 95 H ASN 14 H ASN 14 -13.353 -9.148 -11.413 96 HA ASN 14 HA ASN 14 -15.479 -9.192 -13.385 97 HB2 ASN 14 2HB ASN 14 -13.435 -7.109 -12.640 98 HB3 ASN 14 1HB ASN 14 -14.621 -6.876 -13.911 99 HD21 ASN 14 1HD2 ASN 14 -14.214 -5.382 -11.452 100 HD22 ASN 14 2HD2 ASN 14 -15.706 -5.502 -10.581 101 H ASP 15 H ASP 15 -14.797 -8.245 -15.638 102 HA ASP 15 HA ASP 15 -12.615 -9.924 -16.610 103 HB2 ASP 15 2HB ASP 15 -13.572 -9.552 -18.846 104 HB3 ASP 15 1HB ASP 15 -14.792 -10.165 -17.735 105 H GLY 16 H GLY 16 -12.847 -6.988 -15.399 106 HA2 GLY 16 2HA GLY 16 -11.488 -5.216 -15.390 107 HA3 GLY 16 1HA GLY 16 -10.418 -6.100 -16.439 108 H SER 17 H SER 17 -13.158 -4.047 -16.281 109 HA SER 17 HA SER 17 -12.453 -2.858 -18.864 110 HB2 SER 17 2HB SER 17 -14.520 -4.312 -19.089 111 HB3 SER 17 1HB SER 17 -15.280 -3.339 -17.834 112 HG SER 17 HG SER 17 -14.389 -2.501 -20.379 113 H GLU 18 H GLU 18 -13.806 -0.544 -18.791 114 HA GLU 18 HA GLU 18 -12.790 0.737 -16.521 115 HB2 GLU 18 2HB GLU 18 -13.141 1.772 -18.810 116 HB3 GLU 18 1HB GLU 18 -14.862 1.774 -18.450 117 HG2 GLU 18 2HG GLU 18 -14.457 3.232 -16.546 118 HG3 GLU 18 1HG GLU 18 -12.744 3.231 -17.001 119 H LEU 19 H LEU 19 -15.920 -0.574 -17.483 120 HA LEU 19 HA LEU 19 -17.372 0.541 -15.273 121 HB2 LEU 19 2HB LEU 19 -18.174 -1.536 -17.301 122 HB3 LEU 19 1HB LEU 19 -19.235 -0.830 -16.107 123 HG LEU 19 HG LEU 19 -19.727 0.141 -18.109 124 HD11 LEU 19 1HD1 LEU 19 -19.756 1.724 -16.326 125 HD12 LEU 19 2HD1 LEU 19 -19.264 2.534 -17.813 126 HD13 LEU 19 3HD1 LEU 19 -18.056 2.118 -16.593 127 HD21 LEU 19 3HD2 LEU 19 -17.796 -0.396 -19.449 128 HD22 LEU 19 1HD2 LEU 19 -16.817 0.776 -18.567 129 HD23 LEU 19 2HD2 LEU 19 -18.147 1.327 -19.589 130 H LYS 20 H LYS 20 -15.484 -2.220 -15.844 131 HA LYS 20 HA LYS 20 -16.166 -3.317 -13.180 132 HB2 LYS 20 2HB LYS 20 -15.652 -5.131 -15.535 133 HB3 LYS 20 1HB LYS 20 -16.115 -5.544 -13.916 134 HG2 LYS 20 2HG LYS 20 -18.331 -4.559 -14.188 135 HG3 LYS 20 1HG LYS 20 -17.942 -4.152 -15.860 136 HD2 LYS 20 2HD LYS 20 -17.605 -6.531 -16.342 137 HD3 LYS 20 1HD LYS 20 -18.020 -6.922 -14.678 138 HE2 LYS 20 2HE LYS 20 -20.248 -5.950 -15.009 139 HE3 LYS 20 1HE LYS 20 -19.833 -5.568 -16.676 140 HZ1 LYS 20 3HZ LYS 20 -19.560 -7.940 -17.102 141 HZ2 LYS 20 1HZ LYS 20 -21.108 -7.600 -16.542 142 HZ3 LYS 20 2HZ LYS 20 -19.984 -8.297 -15.513 143 HA PRO 21 HA PRO 21 -11.780 -2.851 -13.908 144 HB2 PRO 21 2HB PRO 21 -11.219 -1.501 -11.633 145 HB3 PRO 21 1HB PRO 21 -11.760 -0.692 -13.108 146 HG2 PRO 21 2HG PRO 21 -13.308 -1.362 -10.645 147 HG3 PRO 21 1HG PRO 21 -13.414 0.062 -11.688 148 HD2 PRO 21 2HD PRO 21 -15.165 -2.057 -11.779 149 HD3 PRO 21 1HD PRO 21 -14.849 -0.952 -13.122 150 H LEU 22 H LEU 22 -10.124 -3.889 -12.896 151 HA LEU 22 HA LEU 22 -10.877 -6.090 -11.188 152 HB2 LEU 22 2HB LEU 22 -8.193 -5.179 -12.212 153 HB3 LEU 22 1HB LEU 22 -8.517 -6.717 -11.432 154 HG LEU 22 HG LEU 22 -9.696 -5.833 -14.063 155 HD11 LEU 22 1HD1 LEU 22 -8.230 -7.520 -15.027 156 HD12 LEU 22 2HD1 LEU 22 -7.486 -7.752 -13.436 157 HD13 LEU 22 3HD1 LEU 22 -7.343 -6.205 -14.260 158 HD21 LEU 22 3HD2 LEU 22 -9.806 -8.492 -12.641 159 HD22 LEU 22 1HD2 LEU 22 -10.430 -8.152 -14.252 160 HD23 LEU 22 2HD2 LEU 22 -11.155 -7.370 -12.850 161 H ARG 23 H ARG 23 -8.948 -6.395 -9.327 162 HA ARG 23 HA ARG 23 -9.049 -3.812 -7.948 163 HB2 ARG 23 2HB ARG 23 -9.620 -4.930 -5.838 164 HB3 ARG 23 1HB ARG 23 -10.679 -5.428 -7.098 165 HG2 ARG 23 2HG ARG 23 -9.597 -7.508 -7.346 166 HG3 ARG 23 1HG ARG 23 -8.309 -7.018 -6.255 167 HD2 ARG 23 2HD ARG 23 -11.211 -7.327 -5.486 168 HD3 ARG 23 1HD ARG 23 -9.956 -8.513 -5.195 169 HE ARG 23 HE ARG 23 -10.136 -5.868 -3.966 170 HH11 ARG 23 1HH1 ARG 23 -8.796 -9.183 -3.975 171 HH12 ARG 23 2HH1 ARG 23 -8.340 -9.149 -2.349 172 HH21 ARG 23 1HH2 ARG 23 -9.498 -5.863 -1.672 173 HH22 ARG 23 2HH2 ARG 23 -8.737 -7.235 -1.010 174 H THR 24 H THR 24 -7.176 -6.268 -9.208 175 HA THR 24 HA THR 24 -4.890 -5.363 -7.661 176 HB THR 24 HB THR 24 -5.411 -8.218 -8.546 177 HG1 THR 24 1HG THR 24 -6.714 -8.230 -6.981 178 HG21 THR 24 3HG2 THR 24 -3.637 -8.718 -6.967 179 HG22 THR 24 1HG2 THR 24 -3.499 -6.987 -6.590 180 HG23 THR 24 2HG2 THR 24 -3.102 -7.583 -8.213 181 H LEU 25 H LEU 25 -3.003 -5.225 -8.931 182 HA LEU 25 HA LEU 25 -3.437 -4.798 -11.725 183 HB2 LEU 25 2HB LEU 25 -2.026 -3.338 -10.365 184 HB3 LEU 25 1HB LEU 25 -0.947 -4.660 -10.020 185 HG LEU 25 HG LEU 25 -0.193 -4.688 -12.334 186 HD11 LEU 25 1HD1 LEU 25 -2.294 -4.006 -13.412 187 HD12 LEU 25 2HD1 LEU 25 -0.948 -2.992 -13.916 188 HD13 LEU 25 3HD1 LEU 25 -2.114 -2.381 -12.751 189 HD21 LEU 25 3HD2 LEU 25 0.889 -2.473 -12.321 190 HD22 LEU 25 1HD2 LEU 25 0.915 -3.249 -10.739 191 HD23 LEU 25 2HD2 LEU 25 -0.242 -1.962 -11.068 192 H TYR 26 H TYR 26 -2.329 -7.301 -9.761 193 HA TYR 26 HA TYR 26 -0.835 -9.000 -11.349 194 HB2 TYR 26 2HB TYR 26 -1.319 -9.327 -8.963 195 HB3 TYR 26 1HB TYR 26 -3.008 -9.601 -9.334 196 HD1 TYR 26 2HD TYR 26 -3.716 -11.755 -10.349 197 HD2 TYR 26 1HD TYR 26 0.324 -11.026 -9.255 198 HE1 TYR 26 2HE TYR 26 -3.249 -14.147 -10.461 199 HE2 TYR 26 1HE TYR 26 0.797 -13.372 -9.390 200 HH TYR 26 HH TYR 26 -0.441 -15.485 -9.244 201 H GLN 27 H GLN 27 -4.423 -8.834 -11.059 202 HA GLN 27 HA GLN 27 -4.765 -10.883 -12.995 203 HB2 GLN 27 2HB GLN 27 -6.494 -10.621 -11.329 204 HB3 GLN 27 1HB GLN 27 -6.790 -8.962 -11.805 205 HG2 GLN 27 2HG GLN 27 -8.566 -10.484 -12.585 206 HG3 GLN 27 1HG GLN 27 -7.760 -9.707 -13.922 207 HE21 GLN 27 1HE2 GLN 27 -8.342 -11.205 -15.324 208 HE22 GLN 27 2HE2 GLN 27 -7.755 -12.787 -15.494 209 H ALA 28 H ALA 28 -4.609 -7.378 -13.257 210 HA ALA 28 HA ALA 28 -5.571 -7.061 -15.821 211 HB1 ALA 28 1HB ALA 28 -5.059 -5.225 -14.264 212 HB2 ALA 28 2HB ALA 28 -4.249 -4.985 -15.815 213 HB3 ALA 28 3HB ALA 28 -3.340 -5.579 -14.426 214 H MET 29 H MET 29 -2.387 -7.994 -14.639 215 HA MET 29 HA MET 29 -1.253 -8.143 -17.183 216 HB2 MET 29 2HB MET 29 -0.449 -9.091 -14.493 217 HB3 MET 29 1HB MET 29 0.437 -9.632 -15.900 218 HG2 MET 29 2HG MET 29 0.865 -7.196 -16.462 219 HG3 MET 29 1HG MET 29 0.096 -6.771 -14.948 220 HE1 MET 29 3HE MET 29 3.910 -6.180 -14.637 221 HE2 MET 29 1HE MET 29 2.313 -5.423 -14.687 222 HE3 MET 29 2HE MET 29 2.989 -6.127 -16.141 223 H ILE 30 H ILE 30 -3.071 -10.449 -15.281 224 HA ILE 30 HA ILE 30 -2.366 -12.694 -16.937 225 HB ILE 30 HB ILE 30 -4.887 -12.432 -15.267 226 HG12 ILE 30 2HG1 ILE 30 -2.161 -13.490 -14.429 227 HG13 ILE 30 1HG1 ILE 30 -2.968 -12.050 -13.829 228 HG21 ILE 30 1HG2 ILE 30 -4.808 -14.894 -15.234 229 HG22 ILE 30 2HG2 ILE 30 -3.369 -14.852 -16.252 230 HG23 ILE 30 3HG2 ILE 30 -4.908 -14.277 -16.888 231 HD11 ILE 30 3HD1 ILE 30 -4.689 -13.400 -12.852 232 HD12 ILE 30 1HD1 ILE 30 -3.077 -13.921 -12.330 233 HD13 ILE 30 2HD1 ILE 30 -3.955 -14.854 -13.538 234 H ILE 31 H ILE 31 -4.955 -10.333 -16.933 235 HA ILE 31 HA ILE 31 -6.626 -11.388 -18.899 236 HB ILE 31 HB ILE 31 -5.982 -8.477 -18.289 237 HG12 ILE 31 2HG1 ILE 31 -7.008 -9.782 -16.403 238 HG13 ILE 31 1HG1 ILE 31 -7.978 -8.424 -16.960 239 HG21 ILE 31 1HG2 ILE 31 -6.933 -8.725 -20.496 240 HG22 ILE 31 2HG2 ILE 31 -8.115 -7.982 -19.367 241 HG23 ILE 31 3HG2 ILE 31 -8.219 -9.709 -19.773 242 HD11 ILE 31 3HD1 ILE 31 -9.385 -9.965 -18.232 243 HD12 ILE 31 1HD1 ILE 31 -9.377 -10.344 -16.513 244 HD13 ILE 31 2HD1 ILE 31 -8.429 -11.325 -17.636 245 H THR 32 H THR 32 -3.756 -9.392 -19.127 246 HA THR 32 HA THR 32 -4.023 -9.181 -22.000 247 HB THR 32 HB THR 32 -2.140 -7.564 -21.792 248 HG1 THR 32 1HG THR 32 -2.496 -7.533 -19.024 249 HG21 THR 32 3HG2 THR 32 -4.453 -7.051 -19.880 250 HG22 THR 32 1HG2 THR 32 -4.524 -6.840 -21.618 251 HG23 THR 32 2HG2 THR 32 -3.448 -5.834 -20.655 252 H LYS 33 H LYS 33 -1.773 -10.545 -19.608 253 HA LYS 33 HA LYS 33 0.002 -11.885 -19.679 254 HB2 LYS 33 2HB LYS 33 -1.175 -12.759 -22.325 255 HB3 LYS 33 1HB LYS 33 0.235 -13.517 -21.602 256 HG2 LYS 33 2HG LYS 33 -1.128 -14.105 -19.632 257 HG3 LYS 33 1HG LYS 33 -2.535 -13.401 -20.430 258 HD2 LYS 33 2HD LYS 33 -2.352 -15.009 -22.236 259 HD3 LYS 33 1HD LYS 33 -0.882 -15.676 -21.524 260 HE2 LYS 33 2HE LYS 33 -2.152 -16.355 -19.544 261 HE3 LYS 33 1HE LYS 33 -3.620 -15.691 -20.256 262 HZ1 LYS 33 3HZ LYS 33 -2.019 -17.929 -21.396 263 HZ2 LYS 33 1HZ LYS 33 -3.446 -17.295 -22.040 264 HZ3 LYS 33 2HZ LYS 33 -3.450 -18.091 -20.552 265 H SER 34 H SER 34 -0.063 -9.232 -21.093 266 HA SER 34 HA SER 34 2.273 -9.499 -22.826 267 HB2 SER 34 2HB SER 34 0.611 -7.071 -22.185 268 HB3 SER 34 1HB SER 34 1.785 -7.235 -23.484 269 HG SER 34 HG SER 34 0.189 -9.265 -23.730 270 H SER 35 H SER 35 1.444 -8.729 -19.634 271 HA SER 35 HA SER 35 2.413 -7.846 -17.838 272 HB2 SER 35 2HB SER 35 4.900 -8.171 -17.562 273 HB3 SER 35 1HB SER 35 4.016 -9.614 -18.025 274 HG SER 35 HG SER 35 4.847 -8.295 -20.219 275 H LYS 36 H LYS 36 2.438 -6.099 -20.541 276 HA LYS 36 HA LYS 36 3.235 -3.701 -19.296 277 HB2 LYS 36 2HB LYS 36 4.504 -4.631 -21.896 278 HB3 LYS 36 1HB LYS 36 4.689 -3.054 -21.163 279 HG2 LYS 36 2HG LYS 36 5.912 -4.036 -19.307 280 HG3 LYS 36 1HG LYS 36 5.704 -5.645 -20.006 281 HD2 LYS 36 2HD LYS 36 6.924 -4.885 -22.002 282 HD3 LYS 36 1HD LYS 36 7.202 -3.327 -21.222 283 HE2 LYS 36 2HE LYS 36 8.394 -4.479 -19.405 284 HE3 LYS 36 1HE LYS 36 8.121 -6.014 -20.218 285 HZ1 LYS 36 3HZ LYS 36 9.719 -3.747 -21.269 286 HZ2 LYS 36 1HZ LYS 36 9.374 -5.165 -22.107 287 HZ3 LYS 36 2HZ LYS 36 10.300 -5.236 -20.690 288 H GLY 37 H GLY 37 2.345 -2.094 -20.513 289 HA2 GLY 37 2HA GLY 37 1.157 -1.843 -22.862 290 HA3 GLY 37 1HA GLY 37 -0.012 -2.869 -22.022 291 H ASP 38 H ASP 38 -1.589 -1.164 -22.021 292 HA ASP 38 HA ASP 38 -0.758 0.931 -20.173 293 HB2 ASP 38 2HB ASP 38 -1.633 1.657 -22.465 294 HB3 ASP 38 1HB ASP 38 -3.190 1.009 -21.927 295 H PHE 39 H PHE 39 -1.276 0.512 -18.257 296 HA PHE 39 HA PHE 39 -3.841 -0.799 -17.692 297 HB2 PHE 39 2HB PHE 39 -1.300 -0.840 -16.026 298 HB3 PHE 39 1HB PHE 39 -2.807 -1.644 -15.617 299 HD1 PHE 39 1HD PHE 39 -3.632 -3.427 -17.315 300 HD2 PHE 39 2HD PHE 39 0.390 -2.033 -17.149 301 HE1 PHE 39 1HE PHE 39 -2.866 -5.454 -18.474 302 HE2 PHE 39 2HE PHE 39 1.139 -4.040 -18.307 303 HZ PHE 39 HZ PHE 39 -0.484 -5.759 -18.975 304 H LEU 40 H LEU 40 -5.208 0.390 -16.472 305 HA LEU 40 HA LEU 40 -4.073 2.850 -15.334 306 HB2 LEU 40 2HB LEU 40 -6.875 2.583 -16.472 307 HB3 LEU 40 1HB LEU 40 -6.108 3.961 -15.722 308 HG LEU 40 HG LEU 40 -5.198 2.765 -18.327 309 HD11 LEU 40 1HD1 LEU 40 -6.816 5.241 -17.766 310 HD12 LEU 40 2HD1 LEU 40 -7.381 3.772 -18.570 311 HD13 LEU 40 3HD1 LEU 40 -6.148 4.776 -19.327 312 HD21 LEU 40 3HD2 LEU 40 -3.407 3.850 -17.122 313 HD22 LEU 40 1HD2 LEU 40 -4.406 5.287 -16.871 314 HD23 LEU 40 2HD2 LEU 40 -3.895 4.831 -18.499 315 H ILE 41 H ILE 41 -4.290 3.079 -13.291 316 HA ILE 41 HA ILE 41 -6.224 1.365 -11.933 317 HB ILE 41 HB ILE 41 -3.625 2.472 -10.826 318 HG12 ILE 41 2HG1 ILE 41 -4.351 -0.243 -11.998 319 HG13 ILE 41 1HG1 ILE 41 -3.068 0.839 -12.414 320 HG21 ILE 41 1HG2 ILE 41 -5.620 0.542 -9.641 321 HG22 ILE 41 2HG2 ILE 41 -5.359 2.200 -9.130 322 HG23 ILE 41 3HG2 ILE 41 -4.078 1.000 -8.892 323 HD11 ILE 41 3HD1 ILE 41 -1.782 0.247 -10.514 324 HD12 ILE 41 1HD1 ILE 41 -2.479 -1.226 -11.235 325 HD13 ILE 41 2HD1 ILE 41 -3.204 -0.573 -9.794 326 H ARG 42 H ARG 42 -7.618 2.244 -10.587 327 HA ARG 42 HA ARG 42 -8.217 5.014 -10.807 328 HB2 ARG 42 2HB ARG 42 -9.813 3.086 -10.349 329 HB3 ARG 42 1HB ARG 42 -9.239 3.134 -8.695 330 HG2 ARG 42 2HG ARG 42 -11.321 4.344 -8.776 331 HG3 ARG 42 1HG ARG 42 -10.022 5.493 -8.568 332 HD2 ARG 42 2HD ARG 42 -10.290 6.437 -10.561 333 HD3 ARG 42 1HD ARG 42 -10.842 4.941 -11.394 334 HE ARG 42 HE ARG 42 -12.680 6.020 -9.498 335 HH11 ARG 42 1HH1 ARG 42 -11.518 6.420 -12.840 336 HH12 ARG 42 2HH1 ARG 42 -12.897 7.277 -13.337 337 HH21 ARG 42 1HH2 ARG 42 -14.550 7.218 -10.228 338 HH22 ARG 42 2HH2 ARG 42 -14.668 7.725 -11.834 339 H THR 43 H THR 43 -7.574 6.586 -9.623 340 HA THR 43 HA THR 43 -6.275 6.138 -7.046 341 HB THR 43 HB THR 43 -4.541 6.397 -8.895 342 HG1 THR 43 1HG THR 43 -3.410 7.216 -7.382 343 HG21 THR 43 3HG2 THR 43 -5.718 9.168 -9.069 344 HG22 THR 43 1HG2 THR 43 -5.715 7.952 -10.343 345 HG23 THR 43 2HG2 THR 43 -4.197 8.685 -9.801 346 H LYS 44 H LYS 44 -6.464 8.044 -5.699 347 HA LYS 44 HA LYS 44 -8.399 9.865 -6.840 348 HB2 LYS 44 2HB LYS 44 -8.915 10.578 -4.402 349 HB3 LYS 44 1HB LYS 44 -9.577 9.071 -4.986 350 HG2 LYS 44 2HG LYS 44 -7.052 9.195 -3.348 351 HG3 LYS 44 1HG LYS 44 -8.650 9.132 -2.608 352 HD2 LYS 44 2HD LYS 44 -9.104 7.027 -3.823 353 HD3 LYS 44 1HD LYS 44 -7.478 7.082 -4.502 354 HE2 LYS 44 2HE LYS 44 -6.531 6.918 -2.261 355 HE3 LYS 44 1HE LYS 44 -8.149 6.932 -1.565 356 HZ1 LYS 44 3HZ LYS 44 -8.626 4.874 -2.730 357 HZ2 LYS 44 1HZ LYS 44 -7.310 4.674 -1.716 358 HZ3 LYS 44 2HZ LYS 44 -7.074 4.819 -3.369 359 H LYS 45 H LYS 45 -7.742 11.539 -7.522 360 HA LYS 45 HA LYS 45 -5.392 12.868 -6.380 361 HB2 LYS 45 2HB LYS 45 -4.885 11.638 -8.604 362 HB3 LYS 45 1HB LYS 45 -6.153 12.611 -9.286 363 HG2 LYS 45 2HG LYS 45 -4.895 14.593 -8.972 364 HG3 LYS 45 1HG LYS 45 -3.651 13.697 -8.093 365 HD2 LYS 45 2HD LYS 45 -4.517 12.989 -10.814 366 HD3 LYS 45 1HD LYS 45 -3.164 14.144 -10.587 367 HE2 LYS 45 2HE LYS 45 -2.064 12.247 -9.302 368 HE3 LYS 45 1HE LYS 45 -3.388 11.205 -9.824 369 HZ1 LYS 45 3HZ LYS 45 -1.537 10.914 -11.377 370 HZ2 LYS 45 1HZ LYS 45 -1.443 12.589 -11.598 371 HZ3 LYS 45 2HZ LYS 45 -2.767 11.725 -12.127 372 H ASP 46 H ASP 46 -5.751 15.017 -6.050 373 HA ASP 46 HA ASP 46 -6.855 17.003 -5.789 374 HB2 ASP 46 2HB ASP 46 -6.636 17.094 -8.303 375 HB3 ASP 46 1HB ASP 46 -8.151 16.230 -8.455 376 H GLY 47 H GLY 47 -7.814 14.540 -4.731 377 HA2 GLY 47 2HA GLY 47 -9.508 13.823 -3.327 378 HA3 GLY 47 1HA GLY 47 -10.284 15.372 -3.602 379 H LYS 48 H LYS 48 -9.586 13.545 -6.417 380 HA LYS 48 HA LYS 48 -12.373 12.603 -6.613 381 HB2 LYS 48 2HB LYS 48 -10.681 13.955 -8.720 382 HB3 LYS 48 1HB LYS 48 -12.334 13.381 -8.949 383 HG2 LYS 48 2HG LYS 48 -13.205 15.018 -7.493 384 HG3 LYS 48 1HG LYS 48 -11.605 15.420 -6.882 385 HD2 LYS 48 2HD LYS 48 -11.017 16.286 -9.106 386 HD3 LYS 48 1HD LYS 48 -12.667 15.962 -9.649 387 HE2 LYS 48 2HE LYS 48 -13.550 17.487 -7.989 388 HE3 LYS 48 1HE LYS 48 -11.943 17.704 -7.309 389 HZ1 LYS 48 3HZ LYS 48 -12.727 18.510 -10.051 390 HZ2 LYS 48 1HZ LYS 48 -11.230 18.786 -9.285 391 HZ3 LYS 48 2HZ LYS 48 -12.616 19.530 -8.712 392 H GLN 49 H GLN 49 -12.554 10.579 -7.842 393 HA GLN 49 HA GLN 49 -10.059 9.191 -7.951 394 HB2 GLN 49 2HB GLN 49 -12.891 8.226 -8.343 395 HB3 GLN 49 1HB GLN 49 -11.462 7.210 -8.322 396 HG2 GLN 49 2HG GLN 49 -11.037 7.859 -5.997 397 HG3 GLN 49 1HG GLN 49 -12.501 8.843 -6.017 398 HE21 GLN 49 1HE2 GLN 49 -11.214 5.577 -5.905 399 HE22 GLN 49 2HE2 GLN 49 -12.717 4.850 -5.568 400 H VAL 50 H VAL 50 -9.041 8.823 -9.671 401 HA VAL 50 HA VAL 50 -10.289 9.081 -12.301 402 HB VAL 50 HB VAL 50 -8.269 10.305 -13.121 403 HG11 VAL 50 1HG1 VAL 50 -8.874 12.507 -12.226 404 HG12 VAL 50 2HG1 VAL 50 -9.794 11.728 -10.938 405 HG13 VAL 50 3HG1 VAL 50 -10.303 11.553 -12.620 406 HG21 VAL 50 3HG2 VAL 50 -6.789 11.416 -11.496 407 HG22 VAL 50 1HG2 VAL 50 -6.711 9.658 -11.340 408 HG23 VAL 50 2HG2 VAL 50 -7.631 10.599 -10.183 409 H TRP 51 H TRP 51 -8.659 8.285 -13.980 410 HA TRP 51 HA TRP 51 -7.496 5.835 -12.941 411 HB2 TRP 51 2HB TRP 51 -8.021 6.744 -15.782 412 HB3 TRP 51 1HB TRP 51 -7.379 5.199 -15.381 413 HD1 TRP 51 HD TRP 51 -10.368 6.787 -16.232 414 HE1 TRP 51 1HE TRP 51 -12.476 5.316 -15.708 415 HE3 TRP 51 3HE TRP 51 -8.193 3.447 -13.107 416 HZ2 TRP 51 2HZ TRP 51 -13.062 3.048 -14.160 417 HZ3 TRP 51 3HZ TRP 51 -9.569 1.651 -12.134 418 HH2 TRP 51 HH TRP 51 -11.948 1.456 -12.645 419 H GLU 52 H GLU 52 -5.364 5.695 -12.642 420 HA GLU 52 HA GLU 52 -3.604 7.599 -14.019 421 HB2 GLU 52 2HB GLU 52 -3.598 7.959 -11.623 422 HB3 GLU 52 1HB GLU 52 -3.294 6.252 -11.322 423 HG2 GLU 52 2HG GLU 52 -1.256 7.498 -10.998 424 HG3 GLU 52 1HG GLU 52 -1.103 6.494 -12.428 425 H ALA 53 H ALA 53 -1.747 6.777 -14.885 426 HA ALA 53 HA ALA 53 -1.884 4.119 -15.891 427 HB1 ALA 53 1HB ALA 53 0.408 6.064 -15.887 428 HB2 ALA 53 2HB ALA 53 -0.822 5.928 -17.138 429 HB3 ALA 53 3HB ALA 53 0.314 4.602 -16.857 430 H ALA 54 H ALA 54 -1.081 2.298 -15.117 431 HA ALA 54 HA ALA 54 -0.023 2.061 -12.544 432 HB1 ALA 54 1HB ALA 54 0.234 0.158 -14.873 433 HB2 ALA 54 2HB ALA 54 -1.112 0.209 -13.738 434 HB3 ALA 54 3HB ALA 54 0.502 -0.247 -13.179 435 H SER 55 H SER 55 2.185 1.305 -11.997 436 HA SER 55 HA SER 55 4.066 2.855 -13.573 437 HB2 SER 55 2HB SER 55 4.155 1.961 -10.679 438 HB3 SER 55 1HB SER 55 5.333 2.999 -11.484 439 HG SER 55 HG SER 55 3.636 4.474 -11.863 440 H LYS 56 H LYS 56 5.955 1.834 -14.151 441 HA LYS 56 HA LYS 56 5.724 -0.909 -14.585 442 HB2 LYS 56 2HB LYS 56 8.072 0.940 -14.931 443 HB3 LYS 56 1HB LYS 56 8.078 -0.748 -15.452 444 HG2 LYS 56 2HG LYS 56 6.231 -0.343 -16.951 445 HG3 LYS 56 1HG LYS 56 6.078 1.311 -16.368 446 HD2 LYS 56 2HD LYS 56 8.273 1.841 -17.281 447 HD3 LYS 56 1HD LYS 56 8.462 0.171 -17.811 448 HE2 LYS 56 2HE LYS 56 7.757 1.689 -19.645 449 HE3 LYS 56 1HE LYS 56 6.618 0.383 -19.354 450 HZ1 LYS 56 3HZ LYS 56 5.519 2.537 -19.696 451 HZ2 LYS 56 1HZ LYS 56 6.242 3.166 -18.295 452 HZ3 LYS 56 2HZ LYS 56 5.179 1.885 -18.203 453 H THR 57 H THR 57 7.222 0.871 -12.030 454 HA THR 57 HA THR 57 8.693 -1.146 -10.823 455 HB THR 57 HB THR 57 8.127 0.159 -8.712 456 HG1 THR 57 1HG THR 57 6.970 2.122 -9.091 457 HG21 THR 57 3HG2 THR 57 9.087 1.745 -11.104 458 HG22 THR 57 1HG2 THR 57 10.091 0.704 -10.094 459 HG23 THR 57 2HG2 THR 57 9.373 2.164 -9.414 460 H ALA 58 H ALA 58 5.342 -0.152 -10.264 461 HA ALA 58 HA ALA 58 4.654 -2.265 -8.503 462 HB1 ALA 58 1HB ALA 58 2.820 -0.577 -10.209 463 HB2 ALA 58 2HB ALA 58 3.404 -0.143 -8.601 464 HB3 ALA 58 3HB ALA 58 2.342 -1.538 -8.809 465 H LEU 59 H LEU 59 4.434 -1.900 -11.986 466 HA LEU 59 HA LEU 59 2.995 -4.213 -12.496 467 HB2 LEU 59 2HB LEU 59 4.969 -2.619 -14.107 468 HB3 LEU 59 1HB LEU 59 4.095 -4.074 -14.758 469 HG LEU 59 HG LEU 59 2.814 -1.500 -13.797 470 HD11 LEU 59 1HD1 LEU 59 4.213 -1.032 -15.777 471 HD12 LEU 59 2HD1 LEU 59 2.504 -1.015 -16.192 472 HD13 LEU 59 3HD1 LEU 59 3.482 -2.411 -16.605 473 HD21 LEU 59 3HD2 LEU 59 0.884 -2.326 -14.933 474 HD22 LEU 59 1HD2 LEU 59 1.432 -3.611 -13.833 475 HD23 LEU 59 2HD2 LEU 59 1.781 -3.689 -15.558 476 H LYS 60 H LYS 60 6.547 -3.714 -12.182 477 HA LYS 60 HA LYS 60 7.336 -6.350 -12.707 478 HB2 LYS 60 2HB LYS 60 8.593 -4.182 -11.085 479 HB3 LYS 60 1HB LYS 60 9.164 -5.804 -10.805 480 HG2 LYS 60 2HG LYS 60 10.683 -4.706 -12.310 481 HG3 LYS 60 1HG LYS 60 9.832 -5.938 -13.211 482 HD2 LYS 60 2HD LYS 60 9.056 -3.021 -13.262 483 HD3 LYS 60 1HD LYS 60 10.247 -3.700 -14.359 484 HE2 LYS 60 2HE LYS 60 7.372 -4.581 -14.114 485 HE3 LYS 60 1HE LYS 60 8.015 -3.501 -15.349 486 HZ1 LYS 60 3HZ LYS 60 7.803 -5.735 -16.176 487 HZ2 LYS 60 1HZ LYS 60 8.770 -6.360 -14.969 488 HZ3 LYS 60 2HZ LYS 60 9.430 -5.333 -16.130 489 H LYS 61 H LYS 61 6.201 -4.999 -9.628 490 HA LYS 61 HA LYS 61 6.644 -7.417 -8.190 491 HB2 LYS 61 2HB LYS 61 4.958 -5.005 -7.514 492 HB3 LYS 61 1HB LYS 61 5.012 -6.413 -6.477 493 HG2 LYS 61 2HG LYS 61 6.493 -4.710 -5.626 494 HG3 LYS 61 1HG LYS 61 7.443 -6.076 -6.194 495 HD2 LYS 61 2HD LYS 61 7.945 -4.857 -8.246 496 HD3 LYS 61 1HD LYS 61 6.974 -3.498 -7.677 497 HE2 LYS 61 2HE LYS 61 9.467 -4.582 -6.367 498 HE3 LYS 61 1HE LYS 61 9.354 -3.108 -7.320 499 HZ1 LYS 61 3HZ LYS 61 7.820 -2.205 -5.655 500 HZ2 LYS 61 1HZ LYS 61 9.296 -2.616 -4.968 501 HZ3 LYS 61 2HZ LYS 61 7.971 -3.604 -4.724 502 H SER 62 H SER 62 3.923 -6.190 -9.964 503 HA SER 62 HA SER 62 2.048 -8.132 -9.100 504 HB2 SER 62 2HB SER 62 2.149 -6.521 -11.659 505 HB3 SER 62 1HB SER 62 0.734 -7.366 -11.013 506 HG SER 62 HG SER 62 2.044 -5.073 -10.079 507 H TRP 63 H TRP 63 4.342 -7.985 -11.856 508 HA TRP 63 HA TRP 63 3.438 -10.433 -12.924 509 HB2 TRP 63 2HB TRP 63 4.432 -8.615 -14.274 510 HB3 TRP 63 1HB TRP 63 5.970 -8.887 -13.464 511 HD1 TRP 63 HD TRP 63 7.453 -10.658 -14.398 512 HE1 TRP 63 1HE TRP 63 7.268 -12.409 -16.359 513 HE3 TRP 63 3HE TRP 63 2.522 -10.163 -15.439 514 HZ2 TRP 63 2HZ TRP 63 5.253 -13.400 -18.049 515 HZ3 TRP 63 3HZ TRP 63 1.512 -11.543 -17.218 516 HH2 TRP 63 HH TRP 63 2.857 -13.122 -18.494 517 H LYS 64 H LYS 64 5.859 -9.481 -10.611 518 HA LYS 64 HA LYS 64 7.368 -11.857 -10.662 519 HB2 LYS 64 2HB LYS 64 8.102 -9.774 -9.526 520 HB3 LYS 64 1HB LYS 64 6.858 -10.025 -8.310 521 HG2 LYS 64 2HG LYS 64 7.930 -12.103 -7.632 522 HG3 LYS 64 1HG LYS 64 9.184 -11.860 -8.848 523 HD2 LYS 64 2HD LYS 64 9.784 -9.751 -7.764 524 HD3 LYS 64 1HD LYS 64 8.578 -10.061 -6.514 525 HE2 LYS 64 2HE LYS 64 9.760 -12.132 -5.901 526 HE3 LYS 64 1HE LYS 64 10.965 -11.798 -7.139 527 HZ1 LYS 64 3HZ LYS 64 10.389 -10.110 -4.786 528 HZ2 LYS 64 1HZ LYS 64 11.551 -9.782 -5.963 529 HZ3 LYS 64 2HZ LYS 64 11.727 -11.126 -4.966 530 H ARG 65 H ARG 65 4.473 -10.865 -9.026 531 HA ARG 65 HA ARG 65 4.066 -13.066 -7.292 532 HB2 ARG 65 2HB ARG 65 2.940 -10.811 -7.231 533 HB3 ARG 65 1HB ARG 65 2.054 -11.293 -8.652 534 HG2 ARG 65 2HG ARG 65 0.623 -11.550 -6.768 535 HG3 ARG 65 1HG ARG 65 1.071 -13.161 -7.309 536 HD2 ARG 65 2HD ARG 65 2.816 -13.220 -5.616 537 HD3 ARG 65 1HD ARG 65 2.278 -11.608 -5.097 538 HE ARG 65 HE ARG 65 0.047 -13.187 -5.030 539 HH11 ARG 65 1HH1 ARG 65 3.134 -13.100 -3.315 540 HH12 ARG 65 2HH1 ARG 65 2.569 -13.937 -1.955 541 HH21 ARG 65 1HH2 ARG 65 -0.742 -14.361 -3.137 542 HH22 ARG 65 2HH2 ARG 65 0.333 -14.680 -1.857 543 H TYR 66 H TYR 66 3.242 -12.347 -10.614 544 HA TYR 66 HA TYR 66 1.556 -14.526 -11.365 545 HB2 TYR 66 2HB TYR 66 2.040 -12.319 -12.552 546 HB3 TYR 66 1HB TYR 66 3.578 -13.016 -13.020 547 HD1 TYR 66 1HD TYR 66 3.400 -15.294 -14.301 548 HD2 TYR 66 2HD TYR 66 0.246 -12.493 -13.926 549 HE1 TYR 66 1HE TYR 66 2.370 -16.224 -16.276 550 HE2 TYR 66 2HE TYR 66 -0.823 -13.398 -15.903 551 HH TYR 66 HH TYR 66 0.039 -16.365 -17.269 552 H GLU 67 H GLU 67 5.040 -13.990 -11.653 553 HA GLU 67 HA GLU 67 5.820 -16.560 -12.680 554 HB2 GLU 67 2HB GLU 67 7.428 -14.701 -10.957 555 HB3 GLU 67 1HB GLU 67 8.034 -15.950 -12.040 556 HG2 GLU 67 2HG GLU 67 6.463 -13.604 -12.751 557 HG3 GLU 67 1HG GLU 67 8.228 -13.675 -12.959 558 H GLN 68 H GLN 68 5.503 -15.393 -9.389 559 HA GLN 68 HA GLN 68 6.559 -17.553 -8.147 560 HB2 GLN 68 2HB GLN 68 6.057 -15.451 -7.151 561 HB3 GLN 68 1HB GLN 68 4.352 -15.647 -7.502 562 HG2 GLN 68 2HG GLN 68 4.788 -15.948 -5.322 563 HG3 GLN 68 1HG GLN 68 4.262 -17.480 -6.080 564 HE21 GLN 68 1HE2 GLN 68 5.192 -18.790 -4.426 565 HE22 GLN 68 2HE2 GLN 68 6.897 -18.997 -4.256 566 H GLU 69 H GLU 69 3.242 -17.004 -9.377 567 HA GLU 69 HA GLU 69 2.284 -19.548 -8.459 568 HB2 GLU 69 2HB GLU 69 1.093 -17.634 -10.463 569 HB3 GLU 69 1HB GLU 69 0.292 -19.080 -9.866 570 HG2 GLU 69 2HG GLU 69 1.107 -16.682 -8.240 571 HG3 GLU 69 1HG GLU 69 -0.524 -17.108 -8.752 572 H MET 70 H MET 70 3.512 -18.303 -11.494 573 HA MET 70 HA MET 70 3.045 -20.542 -13.153 574 HB2 MET 70 2HB MET 70 5.297 -18.538 -13.181 575 HB3 MET 70 1HB MET 70 5.055 -19.733 -14.443 576 HG2 MET 70 2HG MET 70 3.079 -17.613 -13.661 577 HG3 MET 70 1HG MET 70 4.203 -17.504 -15.013 578 HE1 MET 70 3HE MET 70 2.935 -20.365 -17.360 579 HE2 MET 70 1HE MET 70 4.208 -20.472 -16.148 580 HE3 MET 70 2HE MET 70 4.087 -19.045 -17.178 581 H LEU 71 H LEU 71 5.722 -19.707 -11.076 582 HA LEU 71 HA LEU 71 7.288 -21.991 -11.560 583 HB2 LEU 71 2HB LEU 71 8.288 -20.016 -10.911 584 HB3 LEU 71 1HB LEU 71 7.289 -19.765 -9.515 585 HG LEU 71 HG LEU 71 8.464 -21.814 -8.533 586 HD11 LEU 71 1HD1 LEU 71 10.591 -22.469 -9.533 587 HD12 LEU 71 2HD1 LEU 71 10.297 -21.391 -10.894 588 HD13 LEU 71 3HD1 LEU 71 9.248 -22.785 -10.628 589 HD21 LEU 71 3HD2 LEU 71 9.071 -19.555 -7.866 590 HD22 LEU 71 1HD2 LEU 71 10.163 -19.426 -9.242 591 HD23 LEU 71 2HD2 LEU 71 10.509 -20.579 -7.955 592 H LYS 72 H LYS 72 4.701 -21.211 -9.367 593 HA LYS 72 HA LYS 72 4.941 -23.336 -7.527 594 HB2 LYS 72 2HB LYS 72 3.428 -21.487 -7.100 595 HB3 LYS 72 1HB LYS 72 2.512 -21.855 -8.549 596 HG2 LYS 72 2HG LYS 72 1.811 -23.983 -7.538 597 HG3 LYS 72 1HG LYS 72 2.685 -23.546 -6.067 598 HD2 LYS 72 2HD LYS 72 1.285 -21.594 -5.781 599 HD3 LYS 72 1HD LYS 72 0.451 -21.936 -7.297 600 HE2 LYS 72 2HE LYS 72 -0.903 -22.659 -5.398 601 HE3 LYS 72 1HE LYS 72 -0.383 -24.041 -6.351 602 HZ1 LYS 72 3HZ LYS 72 -0.179 -24.416 -3.964 603 HZ2 LYS 72 1HZ LYS 72 0.895 -23.133 -3.831 604 HZ3 LYS 72 2HZ LYS 72 1.319 -24.503 -4.726 605 H ASN 73 H ASN 73 3.555 -23.084 -10.714 606 HA ASN 73 HA ASN 73 2.583 -25.778 -10.608 607 HB2 ASN 73 2HB ASN 73 1.229 -24.170 -11.847 608 HB3 ASN 73 1HB ASN 73 2.594 -23.799 -12.893 609 HD21 ASN 73 1HD2 ASN 73 0.155 -26.176 -12.102 610 HD22 ASN 73 2HD2 ASN 73 0.298 -27.077 -13.567 611 H GLU 74 H GLU 74 4.134 -27.107 -10.386 612 HA GLU 74 HA GLU 74 6.651 -27.047 -11.684 613 HB2 GLU 74 2HB GLU 74 5.228 -29.232 -10.158 614 HB3 GLU 74 1HB GLU 74 6.934 -29.242 -10.588 615 HG2 GLU 74 2HG GLU 74 7.392 -27.403 -9.156 616 HG3 GLU 74 1HG GLU 74 5.681 -27.088 -8.913 617 H LYS 75 H LYS 75 6.936 -27.527 -13.695 618 HA LYS 75 HA LYS 75 5.707 -29.824 -14.964 619 HB2 LYS 75 2HB LYS 75 4.946 -28.433 -16.935 620 HB3 LYS 75 1HB LYS 75 4.001 -28.226 -15.470 621 HG2 LYS 75 2HG LYS 75 5.201 -26.158 -14.978 622 HG3 LYS 75 1HG LYS 75 6.172 -26.383 -16.430 623 HD2 LYS 75 2HD LYS 75 4.236 -26.095 -17.827 624 HD3 LYS 75 1HD LYS 75 3.177 -26.095 -16.413 625 HE2 LYS 75 2HE LYS 75 5.319 -24.054 -16.991 626 HE3 LYS 75 1HE LYS 75 3.588 -23.818 -17.251 627 HZ1 LYS 75 3HZ LYS 75 4.866 -24.322 -14.581 628 HZ2 LYS 75 1HZ LYS 75 3.227 -24.161 -14.903 629 HZ3 LYS 75 2HZ LYS 75 4.231 -22.852 -15.120 630 H VAL 76 H VAL 76 7.810 -26.999 -15.292 631 HA VAL 76 HA VAL 76 9.294 -28.151 -17.476 632 HB VAL 76 HB VAL 76 9.916 -25.718 -15.766 633 HG11 VAL 76 1HG1 VAL 76 11.915 -26.574 -16.853 634 HG12 VAL 76 2HG1 VAL 76 11.420 -25.049 -17.588 635 HG13 VAL 76 3HG1 VAL 76 11.081 -26.576 -18.407 636 HG21 VAL 76 3HG2 VAL 76 8.584 -25.910 -18.472 637 HG22 VAL 76 1HG2 VAL 76 9.071 -24.411 -17.683 638 HG23 VAL 76 2HG2 VAL 76 7.828 -25.415 -16.955 639 H ALA 77 H ALA 77 9.833 -27.489 -14.061 640 HA ALA 77 HA ALA 77 11.831 -29.602 -13.935 641 HB1 ALA 77 1HB ALA 77 13.092 -27.517 -14.287 642 HB2 ALA 77 2HB ALA 77 13.329 -28.109 -12.646 643 HB3 ALA 77 3HB ALA 77 12.223 -26.771 -12.947 644 H ALA 78 H ALA 78 12.500 -29.052 -11.249 645 HA ALA 78 HA ALA 78 11.858 -29.061 -9.120 646 HB1 ALA 78 1HB ALA 78 9.676 -28.277 -8.381 647 HB2 ALA 78 2HB ALA 78 9.070 -28.390 -10.038 648 HB3 ALA 78 3HB ALA 78 10.321 -27.212 -9.635 649 H LYS 79 H LYS 79 9.405 -30.097 -7.955 650 HA LYS 79 HA LYS 79 10.329 -32.821 -8.308 651 HB2 LYS 79 2HB LYS 79 10.521 -31.802 -6.089 652 HB3 LYS 79 1HB LYS 79 8.780 -31.591 -6.041 653 HG2 LYS 79 2HG LYS 79 9.440 -33.510 -4.719 654 HG3 LYS 79 1HG LYS 79 8.496 -34.025 -6.114 655 HD2 LYS 79 2HD LYS 79 10.507 -34.673 -7.289 656 HD3 LYS 79 1HD LYS 79 11.507 -34.056 -5.972 657 HE2 LYS 79 2HE LYS 79 9.533 -36.328 -5.786 658 HE3 LYS 79 1HE LYS 79 11.285 -36.489 -5.890 659 HZ1 LYS 79 3HZ LYS 79 9.772 -35.224 -3.653 660 HZ2 LYS 79 1HZ LYS 79 11.449 -35.253 -3.793 661 HZ3 LYS 79 2HZ LYS 79 10.607 -36.682 -3.621 662 H MET 80 H MET 80 7.156 -31.249 -7.652 663 HA MET 80 HA MET 80 5.957 -33.720 -8.578 664 HB2 MET 80 2HB MET 80 4.739 -31.440 -7.063 665 HB3 MET 80 1HB MET 80 3.720 -32.564 -7.931 666 HG2 MET 80 2HG MET 80 3.841 -33.177 -5.607 667 HG3 MET 80 1HG MET 80 4.615 -34.409 -6.590 668 HE1 MET 80 3HE MET 80 6.105 -30.918 -5.533 669 HE2 MET 80 1HE MET 80 6.897 -31.348 -4.020 670 HE3 MET 80 2HE MET 80 5.138 -31.400 -4.138 671 H LEU 81 H LEU 81 6.403 -33.617 -10.707 672 HA LEU 81 HA LEU 81 5.228 -31.616 -12.397 673 HB2 LEU 81 2HB LEU 81 5.941 -34.486 -13.058 674 HB3 LEU 81 1HB LEU 81 5.633 -33.216 -14.224 675 HG LEU 81 HG LEU 81 7.985 -33.395 -12.342 676 HD11 LEU 81 1HD1 LEU 81 8.095 -34.964 -14.184 677 HD12 LEU 81 2HD1 LEU 81 9.285 -33.683 -14.386 678 HD13 LEU 81 3HD1 LEU 81 7.799 -33.661 -15.337 679 HD21 LEU 81 3HD2 LEU 81 8.840 -31.422 -13.533 680 HD22 LEU 81 1HD2 LEU 81 7.336 -31.064 -12.686 681 HD23 LEU 81 2HD2 LEU 81 7.324 -31.318 -14.428 682 H GLU 82 H GLU 82 4.406 -34.642 -11.022 683 HA GLU 82 HA GLU 82 2.610 -35.694 -10.472 684 HB2 GLU 82 2HB GLU 82 2.058 -33.705 -9.271 685 HB3 GLU 82 1HB GLU 82 1.306 -33.010 -10.698 686 HG2 GLU 82 2HG GLU 82 -0.402 -34.713 -10.674 687 HG3 GLU 82 1HG GLU 82 0.385 -35.497 -9.307 688 H LYS 83 H LYS 83 2.282 -37.164 -11.871 689 HA LYS 83 HA LYS 83 0.250 -36.659 -13.914 690 HB2 LYS 83 2HB LYS 83 2.281 -37.949 -14.631 691 HB3 LYS 83 1HB LYS 83 1.918 -39.141 -13.391 692 HG2 LYS 83 2HG LYS 83 -0.177 -39.680 -14.527 693 HG3 LYS 83 1HG LYS 83 0.207 -38.497 -15.778 694 HD2 LYS 83 2HD LYS 83 2.222 -39.756 -16.353 695 HD3 LYS 83 1HD LYS 83 1.856 -40.930 -15.087 696 HE2 LYS 83 2HE LYS 83 0.129 -40.327 -17.483 697 HE3 LYS 83 1HE LYS 83 1.179 -41.732 -17.315 698 HZ1 LYS 83 3HZ LYS 83 -1.073 -42.303 -16.794 699 HZ2 LYS 83 1HZ LYS 83 -1.190 -41.113 -15.600 700 HZ3 LYS 83 2HZ LYS 83 -0.154 -42.426 -15.414 701 H ASP 84 H ASP 84 -1.531 -36.502 -12.669 702 HA ASP 84 HA ASP 84 -1.908 -38.388 -10.483 703 HB2 ASP 84 2HB ASP 84 -2.212 -36.024 -9.987 704 HB3 ASP 84 1HB ASP 84 -3.446 -35.899 -11.231 705 H ALA 85 H ALA 85 -4.021 -36.992 -12.930 706 HA ALA 85 HA ALA 85 -5.857 -39.169 -12.696 707 HB1 ALA 85 1HB ALA 85 -6.640 -36.888 -13.104 708 HB2 ALA 85 2HB ALA 85 -7.150 -37.980 -14.393 709 HB3 ALA 85 3HB ALA 85 -5.797 -36.876 -14.653 710 H THR 86 H THR 86 -6.232 -40.791 -14.134 711 HA THR 86 HA THR 86 -4.109 -41.430 -15.930 712 HB THR 86 HB THR 86 -5.592 -43.483 -16.258 713 HG1 THR 86 1HG THR 86 -7.092 -43.566 -14.293 714 HG21 THR 86 3HG2 THR 86 -3.676 -43.484 -14.709 715 HG22 THR 86 1HG2 THR 86 -5.015 -44.432 -14.063 716 HG23 THR 86 2HG2 THR 86 -4.702 -42.811 -13.442 717 H GLU 87 H GLU 87 -4.523 -41.863 -18.182 718 HA GLU 87 HA GLU 87 -6.511 -40.077 -19.264 719 HB2 GLU 87 2HB GLU 87 -4.152 -40.211 -20.182 720 HB3 GLU 87 1HB GLU 87 -4.540 -41.828 -20.750 721 HG2 GLU 87 2HG GLU 87 -4.731 -40.221 -22.553 722 HG3 GLU 87 1HG GLU 87 -6.314 -40.898 -22.157 723 H VAL 88 H VAL 88 -8.437 -41.002 -18.975 724 HA VAL 88 HA VAL 88 -8.804 -43.787 -19.767 725 HB VAL 88 HB VAL 88 -10.704 -41.959 -18.266 726 HG11 VAL 88 1HG1 VAL 88 -10.813 -44.924 -18.764 727 HG12 VAL 88 2HG1 VAL 88 -11.867 -43.716 -19.495 728 HG13 VAL 88 3HG1 VAL 88 -11.939 -44.020 -17.757 729 HG21 VAL 88 3HG2 VAL 88 -10.122 -43.286 -16.290 730 HG22 VAL 88 1HG2 VAL 88 -8.716 -42.441 -16.939 731 HG23 VAL 88 2HG2 VAL 88 -8.926 -44.167 -17.235 732 H GLY 89 H GLY 89 -9.570 -44.166 -21.700 733 HA2 GLY 89 2HA GLY 89 -11.754 -43.383 -22.938 734 HA3 GLY 89 1HA GLY 89 -10.714 -41.995 -23.242 735 H VAL 90 H VAL 90 -10.398 -45.527 -23.271 736 HA VAL 90 HA VAL 90 -8.650 -45.350 -25.533 737 HB VAL 90 HB VAL 90 -8.300 -47.145 -23.855 738 HG11 VAL 90 1HG1 VAL 90 -10.910 -48.279 -24.818 739 HG12 VAL 90 2HG1 VAL 90 -10.579 -47.633 -23.213 740 HG13 VAL 90 3HG1 VAL 90 -9.772 -49.104 -23.759 741 HG21 VAL 90 3HG2 VAL 90 -8.990 -48.193 -26.596 742 HG22 VAL 90 1HG2 VAL 90 -7.999 -49.036 -25.405 743 HG23 VAL 90 2HG2 VAL 90 -7.444 -47.508 -26.092 744 H LYS 91 H LYS 91 -9.150 -45.540 -27.577 745 HA LYS 91 HA LYS 91 -10.322 -45.385 -29.453 746 HB2 LYS 91 2HB LYS 91 -10.804 -47.756 -29.088 747 HB3 LYS 91 1HB LYS 91 -12.237 -47.318 -28.161 748 HG2 LYS 91 2HG LYS 91 -13.203 -46.254 -30.126 749 HG3 LYS 91 1HG LYS 91 -11.766 -46.668 -31.063 750 HD2 LYS 91 2HD LYS 91 -12.166 -48.987 -30.616 751 HD3 LYS 91 1HD LYS 91 -13.648 -48.569 -29.738 752 HE2 LYS 91 2HE LYS 91 -14.546 -47.538 -31.801 753 HE3 LYS 91 1HE LYS 91 -13.088 -48.015 -32.662 754 HZ1 LYS 91 3HZ LYS 91 -15.037 -49.855 -31.405 755 HZ2 LYS 91 1HZ LYS 91 -13.645 -50.333 -32.222 756 HZ3 LYS 91 2HZ LYS 91 -14.898 -49.572 -33.053 757 H ALA 92 H ALA 92 -10.833 -43.309 -29.391 758 HA ALA 92 HA ALA 92 -13.530 -42.681 -28.438 759 HB1 ALA 92 1HB ALA 92 -11.786 -41.304 -27.394 760 HB2 ALA 92 2HB ALA 92 -12.830 -40.324 -28.423 761 HB3 ALA 92 3HB ALA 92 -11.226 -40.797 -28.988 762 H ALA 93 H ALA 93 -14.506 -43.554 -30.205 763 HA ALA 93 HA ALA 93 -15.425 -43.666 -32.240 764 HB1 ALA 93 1HB ALA 93 -15.494 -41.638 -33.667 765 HB2 ALA 93 2HB ALA 93 -14.273 -40.887 -32.642 766 HB3 ALA 93 3HB ALA 93 -15.866 -41.245 -31.985 767 H LEU 94 H LEU 94 -14.710 -43.370 -34.728 768 HA LEU 94 HA LEU 94 -11.874 -43.879 -34.843 769 HB2 LEU 94 2HB LEU 94 -12.099 -45.699 -36.515 770 HB3 LEU 94 1HB LEU 94 -12.723 -46.129 -34.950 771 HG LEU 94 HG LEU 94 -14.462 -45.359 -37.316 772 HD11 LEU 94 1HD1 LEU 94 -13.199 -47.407 -37.773 773 HD12 LEU 94 2HD1 LEU 94 -14.905 -47.756 -37.516 774 HD13 LEU 94 3HD1 LEU 94 -13.737 -48.084 -36.234 775 HD21 LEU 94 3HD2 LEU 94 -15.126 -46.720 -34.700 776 HD22 LEU 94 1HD2 LEU 94 -16.258 -46.385 -36.009 777 HD23 LEU 94 2HD2 LEU 94 -15.525 -45.052 -35.111 778 H GLU 95 H GLU 95 -11.719 -41.803 -35.413 779 HA GLU 95 HA GLU 95 -12.585 -41.187 -38.136 780 HB2 GLU 95 2HB GLU 95 -11.704 -39.309 -35.940 781 HB3 GLU 95 1HB GLU 95 -12.292 -38.852 -37.529 782 HG2 GLU 95 2HG GLU 95 -14.479 -39.792 -36.986 783 HG3 GLU 95 1HG GLU 95 -13.884 -40.240 -35.390 784 H GLU 96 H GLU 96 -10.936 -42.036 -39.269 785 HA GLU 96 HA GLU 96 -8.244 -41.414 -38.410 786 HB2 GLU 96 2HB GLU 96 -7.560 -43.062 -40.200 787 HB3 GLU 96 1HB GLU 96 -8.473 -43.729 -38.853 788 HG2 GLU 96 2HG GLU 96 -10.463 -43.816 -40.183 789 HG3 GLU 96 1HG GLU 96 -9.667 -42.973 -41.507 790 H ALA 97 H ALA 97 -8.014 -39.322 -38.950 791 HA ALA 97 HA ALA 97 -8.453 -38.518 -41.683 792 HB1 ALA 97 1HB ALA 97 -7.256 -36.957 -39.382 793 HB2 ALA 97 2HB ALA 97 -8.944 -36.901 -39.903 794 HB3 ALA 97 3HB ALA 97 -7.677 -36.303 -40.964 795 H LYS 98 H LYS 98 -7.079 -39.833 -42.765 796 HA LYS 98 HA LYS 98 -4.225 -39.267 -42.392 797 HB2 LYS 98 2HB LYS 98 -5.497 -41.752 -43.570 798 HB3 LYS 98 1HB LYS 98 -3.774 -41.461 -43.407 799 HG2 LYS 98 2HG LYS 98 -4.007 -41.437 -40.968 800 HG3 LYS 98 1HG LYS 98 -5.735 -41.746 -41.136 801 HD2 LYS 98 2HD LYS 98 -5.229 -43.858 -42.275 802 HD3 LYS 98 1HD LYS 98 -3.501 -43.562 -42.047 803 HE2 LYS 98 2HE LYS 98 -3.857 -43.521 -39.612 804 HE3 LYS 98 1HE LYS 98 -5.561 -43.876 -39.866 805 HZ1 LYS 98 3HZ LYS 98 -4.346 -45.864 -39.308 806 HZ2 LYS 98 1HZ LYS 98 -3.302 -45.661 -40.610 807 HZ3 LYS 98 2HZ LYS 98 -4.934 -45.987 -40.870 808 H LYS 99 H LYS 99 -3.692 -37.822 -43.827 809 HA LYS 99 HA LYS 99 -5.104 -37.729 -46.313 810 HB2 LYS 99 2HB LYS 99 -3.096 -35.887 -45.068 811 HB3 LYS 99 1HB LYS 99 -3.767 -35.637 -46.677 812 HG2 LYS 99 2HG LYS 99 -6.004 -35.582 -45.739 813 HG3 LYS 99 1HG LYS 99 -5.333 -35.828 -44.131 814 HD2 LYS 99 2HD LYS 99 -4.159 -33.712 -44.280 815 HD3 LYS 99 1HD LYS 99 -4.758 -33.486 -45.930 816 HE2 LYS 99 2HE LYS 99 -7.019 -33.520 -45.150 817 HE3 LYS 99 1HE LYS 99 -6.483 -33.815 -43.505 818 HZ1 LYS 99 3HZ LYS 99 -5.897 -31.352 -45.077 819 HZ2 LYS 99 1HZ LYS 99 -5.434 -31.643 -43.469 820 HZ3 LYS 99 2HZ LYS 99 -7.064 -31.502 -43.870 821 H VAL 100 H VAL 100 -4.415 -38.829 -47.981 822 HA VAL 100 HA VAL 100 -1.821 -39.974 -48.088 823 HB VAL 100 HB VAL 100 -3.856 -39.730 -50.324 824 HG11 VAL 100 1HG1 VAL 100 -1.514 -41.606 -49.992 825 HG12 VAL 100 2HG1 VAL 100 -1.624 -40.264 -51.132 826 HG13 VAL 100 3HG1 VAL 100 -2.690 -41.660 -51.307 827 HG21 VAL 100 3HG2 VAL 100 -4.823 -40.884 -48.400 828 HG22 VAL 100 1HG2 VAL 100 -3.446 -41.984 -48.359 829 HG23 VAL 100 2HG2 VAL 100 -4.550 -42.009 -49.733 830 H GLN 101 H GLN 101 -0.279 -38.520 -48.160 831 HA GLN 101 HA GLN 101 -0.304 -36.625 -50.381 832 HB2 GLN 101 2HB GLN 101 0.795 -34.946 -48.916 833 HB3 GLN 101 1HB GLN 101 -0.817 -35.358 -48.363 834 HG2 GLN 101 2HG GLN 101 0.190 -36.873 -46.691 835 HG3 GLN 101 1HG GLN 101 1.784 -36.345 -47.216 836 HE21 GLN 101 1HE2 GLN 101 0.544 -36.155 -44.624 837 HE22 GLN 101 2HE2 GLN 101 0.534 -34.492 -44.185 838 H ILE 102 H ILE 102 1.493 -36.576 -51.533 839 HA ILE 102 HA ILE 102 3.671 -38.276 -50.611 840 HB ILE 102 HB ILE 102 4.459 -38.266 -52.981 841 HG12 ILE 102 2HG1 ILE 102 1.839 -36.846 -53.546 842 HG13 ILE 102 1HG1 ILE 102 3.433 -36.116 -53.687 843 HG21 ILE 102 1HG2 ILE 102 2.711 -39.751 -53.859 844 HG22 ILE 102 2HG2 ILE 102 1.628 -39.210 -52.581 845 HG23 ILE 102 3HG2 ILE 102 3.095 -40.098 -52.172 846 HD11 ILE 102 3HD1 ILE 102 2.544 -36.727 -55.861 847 HD12 ILE 102 1HD1 ILE 102 2.355 -38.398 -55.327 848 HD13 ILE 102 2HD1 ILE 102 3.969 -37.699 -55.488 849 H GLU 103 H GLU 103 5.560 -37.418 -50.070 850 HA GLU 103 HA GLU 103 5.837 -34.588 -50.632 851 HB2 GLU 103 2HB GLU 103 7.573 -34.525 -48.832 852 HB3 GLU 103 1HB GLU 103 5.963 -34.938 -48.274 853 HG2 GLU 103 2HG GLU 103 6.615 -37.282 -48.131 854 HG3 GLU 103 1HG GLU 103 8.227 -36.870 -48.729 855 H LEU 104 H LEU 104 6.592 -34.494 -52.597 856 HA LEU 104 HA LEU 104 8.963 -36.021 -53.243 857 HB2 LEU 104 2HB LEU 104 7.270 -34.221 -54.975 858 HB3 LEU 104 1HB LEU 104 8.635 -35.159 -55.527 859 HG LEU 104 HG LEU 104 6.026 -36.271 -54.492 860 HD11 LEU 104 1HD1 LEU 104 5.808 -35.246 -56.679 861 HD12 LEU 104 2HD1 LEU 104 5.703 -37.003 -56.808 862 HD13 LEU 104 3HD1 LEU 104 7.187 -36.170 -57.270 863 HD21 LEU 104 3HD2 LEU 104 7.889 -37.752 -53.948 864 HD22 LEU 104 1HD2 LEU 104 8.446 -37.683 -55.621 865 HD23 LEU 104 2HD2 LEU 104 6.902 -38.441 -55.234 866 H ASP 105 H ASP 105 10.538 -35.034 -52.131 867 HA ASP 105 HA ASP 105 10.945 -32.173 -52.331 868 HB2 ASP 105 2HB ASP 105 11.614 -33.436 -50.286 869 HB3 ASP 105 1HB ASP 105 12.774 -34.341 -51.250 870 H THR 106 H THR 106 11.752 -35.028 -53.908 871 HA THR 106 HA THR 106 12.912 -33.577 -56.084 872 HB THR 106 HB THR 106 14.888 -34.240 -54.822 873 HG1 THR 106 1HG THR 106 15.850 -34.750 -56.525 874 HG21 THR 106 3HG2 THR 106 13.860 -37.075 -55.034 875 HG22 THR 106 1HG2 THR 106 13.993 -36.122 -53.553 876 HG23 THR 106 2HG2 THR 106 15.448 -36.614 -54.421 877 H SER 107 H SER 107 12.712 -34.880 -58.058 878 HA SER 107 HA SER 107 10.417 -36.561 -58.060 879 HB2 SER 107 2HB SER 107 12.459 -36.032 -60.238 880 HB3 SER 107 1HB SER 107 10.854 -36.735 -60.466 881 HG SER 107 HG SER 107 9.926 -34.842 -59.944 882 H LEU 108 H LEU 108 13.740 -36.997 -57.632 883 HA LEU 108 HA LEU 108 15.143 -38.703 -57.315 884 HB2 LEU 108 2HB LEU 108 13.174 -39.388 -55.755 885 HB3 LEU 108 1HB LEU 108 12.718 -40.519 -56.994 886 HG LEU 108 HG LEU 108 13.858 -41.637 -55.157 887 HD11 LEU 108 1HD1 LEU 108 15.648 -42.825 -56.294 888 HD12 LEU 108 2HD1 LEU 108 15.589 -41.632 -57.597 889 HD13 LEU 108 3HD1 LEU 108 14.196 -42.667 -57.286 890 HD21 LEU 108 3HD2 LEU 108 16.213 -39.873 -55.761 891 HD22 LEU 108 1HD2 LEU 108 16.190 -41.210 -54.612 892 HD23 LEU 108 2HD2 LEU 108 15.180 -39.792 -54.329 893 H SER 109 H SER 109 15.226 -38.075 -59.700 894 HA SER 109 HA SER 109 15.128 -40.568 -61.228 895 HB2 SER 109 2HB SER 109 14.694 -39.121 -63.223 896 HB3 SER 109 1HB SER 109 13.373 -39.142 -62.053 897 HG SER 109 HG SER 109 14.085 -37.037 -62.912 898 H TYR 110 H TYR 110 17.060 -38.628 -59.686 899 HA TYR 110 HA TYR 110 19.004 -38.077 -61.735 900 HB2 TYR 110 2HB TYR 110 20.341 -37.062 -59.903 901 HB3 TYR 110 1HB TYR 110 18.725 -36.384 -60.011 902 HD1 TYR 110 1HD TYR 110 16.983 -37.255 -58.314 903 HD2 TYR 110 2HD TYR 110 21.160 -37.910 -57.880 904 HE1 TYR 110 1HE TYR 110 16.657 -37.683 -55.928 905 HE2 TYR 110 2HE TYR 110 20.838 -38.351 -55.485 906 HH TYR 110 HH TYR 110 19.169 -37.692 -53.772 907 H ILE 111 H ILE 111 20.381 -39.524 -62.410 908 HA ILE 111 HA ILE 111 21.713 -41.195 -60.538 909 HB ILE 111 HB ILE 111 19.879 -42.647 -61.009 910 HG12 ILE 111 2HG1 ILE 111 22.218 -43.541 -62.698 911 HG13 ILE 111 1HG1 ILE 111 22.139 -43.650 -60.942 912 HG21 ILE 111 1HG2 ILE 111 18.960 -41.661 -62.996 913 HG22 ILE 111 2HG2 ILE 111 19.228 -43.384 -63.264 914 HG23 ILE 111 3HG2 ILE 111 20.345 -42.203 -63.947 915 HD11 ILE 111 3HD1 ILE 111 20.270 -45.128 -61.109 916 HD12 ILE 111 1HD1 ILE 111 21.661 -45.776 -61.986 917 HD13 ILE 111 2HD1 ILE 111 20.316 -45.029 -62.877 Start of MODEL 18 1 H1 GLY -1 1HT GLY -1 -8.580 -4.359 -29.639 2 H2 GLY -1 2HT GLY -1 -8.282 -4.913 -31.207 3 H3 GLY -1 3HT GLY -1 -7.967 -3.291 -30.776 4 HA2 GLY -1 1HA GLY -1 -6.567 -5.621 -29.651 5 HA3 GLY -1 2HA GLY -1 -5.916 -4.526 -30.870 6 H SER 0 H SER 0 -4.578 -4.857 -28.550 7 HA SER 0 HA SER 0 -3.560 -3.787 -26.900 8 HB2 SER 0 2HB SER 0 -5.012 -1.323 -27.900 9 HB3 SER 0 1HB SER 0 -3.651 -1.320 -26.774 10 HG SER 0 HG SER 0 -3.633 -1.365 -29.407 11 H MET 1 H MET 1 -4.153 -4.579 -25.066 12 HA MET 1 HA MET 1 -6.832 -4.225 -24.068 13 HB2 MET 1 2HB MET 1 -4.484 -5.808 -23.086 14 HB3 MET 1 1HB MET 1 -6.004 -5.719 -22.208 15 HG2 MET 1 2HG MET 1 -5.629 -6.790 -24.994 16 HG3 MET 1 1HG MET 1 -5.784 -7.767 -23.535 17 HE1 MET 1 3HE MET 1 -7.595 -8.260 -26.050 18 HE2 MET 1 1HE MET 1 -9.198 -8.427 -25.327 19 HE3 MET 1 2HE MET 1 -7.794 -9.159 -24.550 20 H THR 2 H THR 2 -7.262 -2.379 -23.101 21 HA THR 2 HA THR 2 -5.306 -1.233 -21.266 22 HB THR 2 HB THR 2 -8.040 -0.197 -22.082 23 HG1 THR 2 1HG THR 2 -5.649 -0.236 -23.408 24 HG21 THR 2 3HG2 THR 2 -7.150 0.729 -19.988 25 HG22 THR 2 1HG2 THR 2 -7.184 1.953 -21.257 26 HG23 THR 2 2HG2 THR 2 -5.661 1.184 -20.816 27 H VAL 3 H VAL 3 -5.476 -1.925 -19.200 28 HA VAL 3 HA VAL 3 -8.054 -3.069 -18.363 29 HB VAL 3 HB VAL 3 -5.412 -3.455 -16.980 30 HG11 VAL 3 1HG1 VAL 3 -7.296 -3.954 -15.611 31 HG12 VAL 3 2HG1 VAL 3 -6.442 -5.433 -16.149 32 HG13 VAL 3 3HG1 VAL 3 -7.954 -4.984 -16.908 33 HG21 VAL 3 3HG2 VAL 3 -6.614 -5.316 -19.019 34 HG22 VAL 3 1HG2 VAL 3 -5.256 -5.633 -17.941 35 HG23 VAL 3 2HG2 VAL 3 -5.108 -4.382 -19.193 36 H TYR 4 H TYR 4 -9.065 -2.251 -16.569 37 HA TYR 4 HA TYR 4 -7.783 0.038 -15.289 38 HB2 TYR 4 2HB TYR 4 -10.704 -0.681 -15.561 39 HB3 TYR 4 1HB TYR 4 -10.081 0.754 -14.754 40 HD1 TYR 4 2HD TYR 4 -10.434 -0.920 -18.032 41 HD2 TYR 4 1HD TYR 4 -9.399 2.663 -16.007 42 HE1 TYR 4 2HE TYR 4 -10.457 0.272 -20.159 43 HE2 TYR 4 1HE TYR 4 -9.420 3.879 -18.131 44 HH TYR 4 HH TYR 4 -10.745 2.510 -20.944 45 H ILE 5 H ILE 5 -7.496 0.041 -13.135 46 HA ILE 5 HA ILE 5 -8.306 -2.385 -11.618 47 HB ILE 5 HB ILE 5 -5.920 -0.630 -11.016 48 HG12 ILE 5 2HG1 ILE 5 -4.437 -2.366 -11.598 49 HG13 ILE 5 1HG1 ILE 5 -5.654 -3.479 -12.116 50 HG21 ILE 5 1HG2 ILE 5 -6.818 -1.666 -9.066 51 HG22 ILE 5 2HG2 ILE 5 -5.245 -2.378 -9.441 52 HG23 ILE 5 3HG2 ILE 5 -6.731 -3.250 -9.820 53 HD11 ILE 5 3HD1 ILE 5 -4.736 -0.915 -13.465 54 HD12 ILE 5 1HD1 ILE 5 -6.137 -1.837 -14.002 55 HD13 ILE 5 2HD1 ILE 5 -4.535 -2.566 -14.050 56 H CYS 6 H CYS 6 -9.666 -1.907 -9.996 57 HA CYS 6 HA CYS 6 -9.145 0.531 -8.520 58 HB2 CYS 6 2HB CYS 6 -11.271 0.888 -9.683 59 HB3 CYS 6 1HB CYS 6 -11.892 -0.617 -9.006 60 HG CYS 6 HG CYS 6 -11.758 2.404 -7.654 61 HA PRO 7 HA PRO 7 -8.418 -2.898 -5.649 62 HB2 PRO 7 2HB PRO 7 -7.292 -0.650 -4.083 63 HB3 PRO 7 1HB PRO 7 -6.559 -2.201 -4.503 64 HG2 PRO 7 2HG PRO 7 -5.761 0.034 -5.701 65 HG3 PRO 7 1HG PRO 7 -5.915 -1.478 -6.609 66 HD2 PRO 7 2HD PRO 7 -7.762 0.873 -6.524 67 HD3 PRO 7 1HD PRO 7 -7.236 -0.124 -7.909 68 H GLU 8 H GLU 8 -10.574 -0.368 -5.534 69 HA GLU 8 HA GLU 8 -11.353 -0.950 -2.757 70 HB2 GLU 8 2HB GLU 8 -12.385 1.295 -4.476 71 HB3 GLU 8 1HB GLU 8 -12.666 1.058 -2.763 72 HG2 GLU 8 2HG GLU 8 -10.160 1.274 -2.490 73 HG3 GLU 8 1HG GLU 8 -10.236 1.760 -4.203 74 H THR 9 H THR 9 -13.078 0.004 -5.690 75 HA THR 9 HA THR 9 -15.236 -1.737 -4.830 76 HB THR 9 HB THR 9 -15.905 0.545 -4.923 77 HG1 THR 9 1HG THR 9 -16.948 -1.203 -6.785 78 HG21 THR 9 3HG2 THR 9 -14.171 1.420 -6.366 79 HG22 THR 9 1HG2 THR 9 -15.755 1.920 -6.967 80 HG23 THR 9 2HG2 THR 9 -14.878 0.606 -7.760 81 H GLY 10 H GLY 10 -12.718 -2.032 -6.835 82 HA2 GLY 10 2HA GLY 10 -14.395 -3.389 -8.753 83 HA3 GLY 10 1HA GLY 10 -12.766 -3.119 -9.200 84 H ASP 11 H ASP 11 -12.885 -5.462 -9.615 85 HA ASP 11 HA ASP 11 -12.434 -7.168 -7.293 86 HB2 ASP 11 2HB ASP 11 -14.895 -7.143 -7.572 87 HB3 ASP 11 1HB ASP 11 -14.704 -7.629 -9.249 88 H ASP 12 H ASP 12 -11.194 -8.945 -7.841 89 HA ASP 12 HA ASP 12 -9.782 -8.759 -10.337 90 HB2 ASP 12 2HB ASP 12 -8.412 -10.614 -9.572 91 HB3 ASP 12 1HB ASP 12 -8.607 -9.439 -8.282 92 H GLY 13 H GLY 13 -12.688 -10.302 -9.612 93 HA2 GLY 13 2HA GLY 13 -12.279 -12.434 -11.550 94 HA3 GLY 13 1HA GLY 13 -13.679 -12.191 -10.514 95 H ASN 14 H ASN 14 -12.796 -9.296 -11.797 96 HA ASN 14 HA ASN 14 -15.027 -9.304 -13.638 97 HB2 ASN 14 2HB ASN 14 -13.146 -7.119 -12.770 98 HB3 ASN 14 1HB ASN 14 -14.411 -6.890 -13.964 99 HD21 ASN 14 1HD2 ASN 14 -14.030 -5.590 -11.428 100 HD22 ASN 14 2HD2 ASN 14 -15.436 -5.893 -10.481 101 H ASP 15 H ASP 15 -14.673 -7.994 -15.681 102 HA ASP 15 HA ASP 15 -12.848 -9.300 -17.454 103 HB2 ASP 15 2HB ASP 15 -15.062 -8.526 -18.167 104 HB3 ASP 15 1HB ASP 15 -14.615 -6.864 -17.817 105 H GLY 16 H GLY 16 -12.698 -6.546 -15.458 106 HA2 GLY 16 2HA GLY 16 -11.045 -5.073 -15.036 107 HA3 GLY 16 1HA GLY 16 -10.061 -5.883 -16.259 108 H SER 17 H SER 17 -13.216 -4.483 -16.690 109 HA SER 17 HA SER 17 -12.168 -2.707 -18.709 110 HB2 SER 17 2HB SER 17 -14.590 -2.313 -19.137 111 HB3 SER 17 1HB SER 17 -14.154 -4.021 -19.254 112 HG SER 17 HG SER 17 -16.011 -3.791 -18.096 113 H GLU 18 H GLU 18 -13.550 -0.426 -18.568 114 HA GLU 18 HA GLU 18 -12.638 0.768 -16.229 115 HB2 GLU 18 2HB GLU 18 -12.844 1.992 -18.343 116 HB3 GLU 18 1HB GLU 18 -14.587 1.784 -18.317 117 HG2 GLU 18 2HG GLU 18 -14.704 3.121 -16.277 118 HG3 GLU 18 1HG GLU 18 -12.942 3.267 -16.366 119 H LEU 19 H LEU 19 -15.702 -0.553 -17.291 120 HA LEU 19 HA LEU 19 -17.263 0.477 -15.144 121 HB2 LEU 19 2HB LEU 19 -17.831 -1.681 -17.168 122 HB3 LEU 19 1HB LEU 19 -18.984 -1.117 -15.982 123 HG LEU 19 HG LEU 19 -19.512 -0.174 -18.030 124 HD11 LEU 19 1HD1 LEU 19 -19.844 1.306 -16.180 125 HD12 LEU 19 2HD1 LEU 19 -19.404 2.236 -17.613 126 HD13 LEU 19 3HD1 LEU 19 -18.208 1.944 -16.356 127 HD21 LEU 19 3HD2 LEU 19 -17.434 -0.386 -19.260 128 HD22 LEU 19 1HD2 LEU 19 -16.689 0.866 -18.268 129 HD23 LEU 19 2HD2 LEU 19 -18.004 1.281 -19.365 130 H LYS 20 H LYS 20 -15.333 -2.348 -15.703 131 HA LYS 20 HA LYS 20 -15.937 -3.406 -12.969 132 HB2 LYS 20 2HB LYS 20 -15.297 -5.129 -15.351 133 HB3 LYS 20 1HB LYS 20 -15.816 -5.578 -13.754 134 HG2 LYS 20 2HG LYS 20 -18.057 -4.823 -14.107 135 HG3 LYS 20 1HG LYS 20 -17.633 -4.167 -15.694 136 HD2 LYS 20 2HD LYS 20 -17.094 -6.394 -16.486 137 HD3 LYS 20 1HD LYS 20 -17.440 -7.055 -14.889 138 HE2 LYS 20 2HE LYS 20 -19.754 -6.353 -15.098 139 HE3 LYS 20 1HE LYS 20 -19.420 -5.660 -16.682 140 HZ1 LYS 20 3HZ LYS 20 -18.886 -7.844 -17.500 141 HZ2 LYS 20 1HZ LYS 20 -20.426 -7.847 -16.840 142 HZ3 LYS 20 2HZ LYS 20 -19.148 -8.554 -15.997 143 HA PRO 21 HA PRO 21 -11.573 -2.625 -13.630 144 HB2 PRO 21 2HB PRO 21 -11.162 -1.448 -11.203 145 HB3 PRO 21 1HB PRO 21 -11.620 -0.545 -12.650 146 HG2 PRO 21 2HG PRO 21 -13.307 -1.426 -10.356 147 HG3 PRO 21 1HG PRO 21 -13.380 0.068 -11.303 148 HD2 PRO 21 2HD PRO 21 -15.064 -2.053 -11.637 149 HD3 PRO 21 1HD PRO 21 -14.672 -0.886 -12.914 150 H LEU 22 H LEU 22 -9.927 -3.739 -12.683 151 HA LEU 22 HA LEU 22 -10.703 -6.078 -11.167 152 HB2 LEU 22 2HB LEU 22 -8.022 -5.140 -12.142 153 HB3 LEU 22 1HB LEU 22 -8.357 -6.709 -11.436 154 HG LEU 22 HG LEU 22 -9.539 -5.674 -13.989 155 HD11 LEU 22 1HD1 LEU 22 -8.096 -7.384 -15.021 156 HD12 LEU 22 2HD1 LEU 22 -7.327 -7.594 -13.443 157 HD13 LEU 22 3HD1 LEU 22 -7.226 -6.047 -14.253 158 HD21 LEU 22 3HD2 LEU 22 -9.700 -8.382 -12.682 159 HD22 LEU 22 1HD2 LEU 22 -10.293 -7.985 -14.292 160 HD23 LEU 22 2HD2 LEU 22 -11.024 -7.232 -12.874 161 H ARG 23 H ARG 23 -9.633 -6.651 -9.177 162 HA ARG 23 HA ARG 23 -9.245 -4.219 -7.626 163 HB2 ARG 23 2HB ARG 23 -9.687 -5.540 -5.626 164 HB3 ARG 23 1HB ARG 23 -10.814 -5.951 -6.853 165 HG2 ARG 23 2HG ARG 23 -9.881 -7.996 -7.298 166 HG3 ARG 23 1HG ARG 23 -8.376 -7.586 -6.484 167 HD2 ARG 23 2HD ARG 23 -9.801 -9.120 -5.192 168 HD3 ARG 23 1HD ARG 23 -9.441 -7.625 -4.341 169 HE ARG 23 HE ARG 23 -11.775 -6.981 -5.282 170 HH11 ARG 23 1HH1 ARG 23 -10.818 -10.207 -4.113 171 HH12 ARG 23 2HH1 ARG 23 -12.340 -10.570 -3.470 172 HH21 ARG 23 1HH2 ARG 23 -13.880 -7.499 -4.333 173 HH22 ARG 23 2HH2 ARG 23 -14.110 -9.004 -3.589 174 H THR 24 H THR 24 -7.353 -6.435 -9.265 175 HA THR 24 HA THR 24 -5.055 -5.698 -7.663 176 HB THR 24 HB THR 24 -4.068 -7.946 -8.257 177 HG1 THR 24 1HG THR 24 -5.828 -9.577 -8.543 178 HG21 THR 24 3HG2 THR 24 -5.191 -9.160 -6.435 179 HG22 THR 24 1HG2 THR 24 -6.490 -7.971 -6.446 180 HG23 THR 24 2HG2 THR 24 -4.856 -7.487 -5.998 181 H LEU 25 H LEU 25 -3.205 -5.329 -8.768 182 HA LEU 25 HA LEU 25 -3.461 -4.665 -11.546 183 HB2 LEU 25 2HB LEU 25 -2.137 -3.309 -9.969 184 HB3 LEU 25 1HB LEU 25 -1.080 -4.669 -9.685 185 HG LEU 25 HG LEU 25 -0.240 -4.529 -11.970 186 HD11 LEU 25 1HD1 LEU 25 -2.268 -3.742 -13.082 187 HD12 LEU 25 2HD1 LEU 25 -0.908 -2.679 -13.427 188 HD13 LEU 25 3HD1 LEU 25 -2.132 -2.190 -12.261 189 HD21 LEU 25 3HD2 LEU 25 0.893 -2.368 -11.773 190 HD22 LEU 25 1HD2 LEU 25 0.830 -3.215 -10.225 191 HD23 LEU 25 2HD2 LEU 25 -0.282 -1.879 -10.550 192 H TYR 26 H TYR 26 -2.328 -7.220 -9.579 193 HA TYR 26 HA TYR 26 -0.819 -8.728 -11.353 194 HB2 TYR 26 2HB TYR 26 -0.905 -9.293 -8.998 195 HB3 TYR 26 1HB TYR 26 -2.637 -9.588 -9.084 196 HD1 TYR 26 1HD TYR 26 0.144 -10.721 -11.266 197 HD2 TYR 26 2HD TYR 26 -2.929 -11.852 -8.574 198 HE1 TYR 26 1HE TYR 26 0.626 -13.018 -11.727 199 HE2 TYR 26 2HE TYR 26 -2.488 -14.215 -9.062 200 HH TYR 26 HH TYR 26 -1.493 -15.559 -10.782 201 H GLN 27 H GLN 27 -4.373 -8.738 -10.852 202 HA GLN 27 HA GLN 27 -4.807 -10.729 -12.801 203 HB2 GLN 27 2HB GLN 27 -6.489 -10.351 -11.101 204 HB3 GLN 27 1HB GLN 27 -6.713 -8.692 -11.614 205 HG2 GLN 27 2HG GLN 27 -8.559 -10.191 -12.315 206 HG3 GLN 27 1HG GLN 27 -7.801 -9.435 -13.680 207 HE21 GLN 27 1HE2 GLN 27 -8.434 -10.920 -15.051 208 HE22 GLN 27 2HE2 GLN 27 -7.845 -12.504 -15.203 209 H ALA 28 H ALA 28 -4.435 -7.243 -13.060 210 HA ALA 28 HA ALA 28 -5.453 -6.921 -15.602 211 HB1 ALA 28 1HB ALA 28 -4.909 -5.083 -14.048 212 HB2 ALA 28 2HB ALA 28 -4.139 -4.843 -15.610 213 HB3 ALA 28 3HB ALA 28 -3.200 -5.434 -14.238 214 H MET 29 H MET 29 -2.255 -7.910 -14.441 215 HA MET 29 HA MET 29 -1.235 -8.114 -17.033 216 HB2 MET 29 2HB MET 29 -0.284 -9.021 -14.374 217 HB3 MET 29 1HB MET 29 0.493 -9.600 -15.832 218 HG2 MET 29 2HG MET 29 0.893 -7.182 -16.467 219 HG3 MET 29 1HG MET 29 0.285 -6.732 -14.886 220 HE1 MET 29 3HE MET 29 4.134 -6.224 -14.829 221 HE2 MET 29 1HE MET 29 2.557 -5.441 -14.716 222 HE3 MET 29 2HE MET 29 3.105 -6.099 -16.258 223 H ILE 30 H ILE 30 -2.992 -10.292 -14.995 224 HA ILE 30 HA ILE 30 -2.475 -12.601 -16.605 225 HB ILE 30 HB ILE 30 -4.842 -12.082 -14.769 226 HG12 ILE 30 2HG1 ILE 30 -2.196 -13.470 -14.250 227 HG13 ILE 30 1HG1 ILE 30 -2.720 -11.934 -13.579 228 HG21 ILE 30 1HG2 ILE 30 -5.089 -14.533 -14.738 229 HG22 ILE 30 2HG2 ILE 30 -3.757 -14.675 -15.887 230 HG23 ILE 30 3HG2 ILE 30 -5.268 -13.903 -16.377 231 HD11 ILE 30 3HD1 ILE 30 -4.495 -13.068 -12.363 232 HD12 ILE 30 1HD1 ILE 30 -2.905 -13.732 -11.977 233 HD13 ILE 30 2HD1 ILE 30 -3.979 -14.608 -13.066 234 H ILE 31 H ILE 31 -4.914 -10.080 -16.745 235 HA ILE 31 HA ILE 31 -6.510 -11.205 -18.750 236 HB ILE 31 HB ILE 31 -5.935 -8.263 -18.208 237 HG12 ILE 31 2HG1 ILE 31 -6.950 -9.493 -16.271 238 HG13 ILE 31 1HG1 ILE 31 -7.967 -8.217 -16.932 239 HG21 ILE 31 1HG2 ILE 31 -6.866 -8.656 -20.422 240 HG22 ILE 31 2HG2 ILE 31 -8.064 -7.886 -19.335 241 HG23 ILE 31 3HG2 ILE 31 -8.121 -9.637 -19.641 242 HD11 ILE 31 3HD1 ILE 31 -9.291 -10.158 -16.397 243 HD12 ILE 31 1HD1 ILE 31 -8.274 -11.170 -17.432 244 HD13 ILE 31 2HD1 ILE 31 -9.268 -9.892 -18.138 245 H THR 32 H THR 32 -3.580 -9.212 -18.895 246 HA THR 32 HA THR 32 -3.755 -8.968 -21.760 247 HB THR 32 HB THR 32 -1.765 -7.480 -21.441 248 HG1 THR 32 1HG THR 32 -2.149 -7.437 -18.715 249 HG21 THR 32 3HG2 THR 32 -4.065 -6.844 -19.537 250 HG22 THR 32 1HG2 THR 32 -4.094 -6.590 -21.283 251 HG23 THR 32 2HG2 THR 32 -2.957 -5.710 -20.276 252 H LYS 33 H LYS 33 -1.530 -10.340 -19.348 253 HA LYS 33 HA LYS 33 0.106 -11.847 -19.347 254 HB2 LYS 33 2HB LYS 33 -0.905 -12.644 -22.077 255 HB3 LYS 33 1HB LYS 33 0.251 -13.564 -21.122 256 HG2 LYS 33 2HG LYS 33 -1.448 -13.909 -19.402 257 HG3 LYS 33 1HG LYS 33 -2.603 -12.979 -20.356 258 HD2 LYS 33 2HD LYS 33 -1.280 -15.567 -21.166 259 HD3 LYS 33 1HD LYS 33 -2.957 -15.379 -20.661 260 HE2 LYS 33 2HE LYS 33 -1.654 -14.235 -23.139 261 HE3 LYS 33 1HE LYS 33 -2.842 -15.522 -23.064 262 HZ1 LYS 33 3HZ LYS 33 -3.831 -13.437 -23.713 263 HZ2 LYS 33 1HZ LYS 33 -3.347 -12.694 -22.284 264 HZ3 LYS 33 2HZ LYS 33 -4.487 -13.947 -22.261 265 H SER 34 H SER 34 0.099 -9.238 -21.006 266 HA SER 34 HA SER 34 2.428 -9.681 -22.673 267 HB2 SER 34 2HB SER 34 0.786 -7.194 -22.205 268 HB3 SER 34 1HB SER 34 2.051 -7.369 -23.420 269 HG SER 34 HG SER 34 0.592 -8.135 -24.639 270 H SER 35 H SER 35 1.866 -8.869 -19.474 271 HA SER 35 HA SER 35 3.166 -8.201 -17.733 272 HB2 SER 35 2HB SER 35 4.843 -9.765 -18.789 273 HB3 SER 35 1HB SER 35 5.492 -8.408 -19.695 274 HG SER 35 HG SER 35 5.949 -9.185 -17.135 275 H LYS 36 H LYS 36 2.367 -6.255 -20.158 276 HA LYS 36 HA LYS 36 2.890 -3.879 -18.923 277 HB2 LYS 36 2HB LYS 36 5.187 -4.210 -19.855 278 HB3 LYS 36 1HB LYS 36 4.486 -4.422 -21.455 279 HG2 LYS 36 2HG LYS 36 3.583 -2.164 -21.360 280 HG3 LYS 36 1HG LYS 36 4.306 -1.933 -19.773 281 HD2 LYS 36 2HD LYS 36 6.538 -2.227 -20.746 282 HD3 LYS 36 1HD LYS 36 5.806 -2.489 -22.333 283 HE2 LYS 36 2HE LYS 36 4.849 -0.232 -22.244 284 HE3 LYS 36 1HE LYS 36 5.610 0.021 -20.677 285 HZ1 LYS 36 3HZ LYS 36 6.868 1.013 -22.461 286 HZ2 LYS 36 1HZ LYS 36 7.052 -0.489 -23.222 287 HZ3 LYS 36 2HZ LYS 36 7.771 -0.209 -21.724 288 H GLY 37 H GLY 37 1.675 -2.362 -19.980 289 HA2 GLY 37 2HA GLY 37 0.600 -2.328 -22.467 290 HA3 GLY 37 1HA GLY 37 -0.514 -3.298 -21.483 291 H ASP 38 H ASP 38 -1.985 -1.411 -21.807 292 HA ASP 38 HA ASP 38 -1.139 0.721 -20.027 293 HB2 ASP 38 2HB ASP 38 -3.564 0.599 -21.838 294 HB3 ASP 38 1HB ASP 38 -3.229 1.922 -20.730 295 H PHE 39 H PHE 39 -1.462 0.519 -18.047 296 HA PHE 39 HA PHE 39 -3.841 -0.905 -17.120 297 HB2 PHE 39 2HB PHE 39 -1.120 -0.723 -15.798 298 HB3 PHE 39 1HB PHE 39 -2.522 -1.561 -15.151 299 HD1 PHE 39 1HD PHE 39 -3.527 -3.329 -16.835 300 HD2 PHE 39 2HD PHE 39 0.490 -2.003 -16.848 301 HE1 PHE 39 1HE PHE 39 -2.848 -5.405 -17.967 302 HE2 PHE 39 2HE PHE 39 1.175 -4.057 -17.978 303 HZ PHE 39 HZ PHE 39 -0.488 -5.768 -18.543 304 H LEU 40 H LEU 40 -5.174 0.514 -16.347 305 HA LEU 40 HA LEU 40 -4.039 2.947 -15.159 306 HB2 LEU 40 2HB LEU 40 -6.782 2.714 -16.439 307 HB3 LEU 40 1HB LEU 40 -5.967 4.090 -15.734 308 HG LEU 40 HG LEU 40 -4.961 2.701 -18.206 309 HD11 LEU 40 1HD1 LEU 40 -6.573 5.238 -17.955 310 HD12 LEU 40 2HD1 LEU 40 -7.123 3.714 -18.657 311 HD13 LEU 40 3HD1 LEU 40 -5.833 4.628 -19.433 312 HD21 LEU 40 3HD2 LEU 40 -3.237 3.874 -16.951 313 HD22 LEU 40 1HD2 LEU 40 -4.235 5.327 -16.904 314 HD23 LEU 40 2HD2 LEU 40 -3.604 4.739 -18.443 315 H ILE 41 H ILE 41 -4.387 3.246 -13.132 316 HA ILE 41 HA ILE 41 -6.410 1.583 -11.835 317 HB ILE 41 HB ILE 41 -3.909 2.790 -10.618 318 HG12 ILE 41 2HG1 ILE 41 -4.471 0.051 -11.794 319 HG13 ILE 41 1HG1 ILE 41 -3.187 1.162 -12.092 320 HG21 ILE 41 1HG2 ILE 41 -5.929 0.855 -9.497 321 HG22 ILE 41 2HG2 ILE 41 -5.709 2.534 -9.018 322 HG23 ILE 41 3HG2 ILE 41 -4.437 1.346 -8.681 323 HD11 ILE 41 3HD1 ILE 41 -2.078 0.623 -10.048 324 HD12 ILE 41 1HD1 ILE 41 -2.601 -0.874 -10.858 325 HD13 ILE 41 2HD1 ILE 41 -3.518 -0.278 -9.503 326 H ARG 42 H ARG 42 -7.978 2.546 -10.638 327 HA ARG 42 HA ARG 42 -8.461 5.278 -10.981 328 HB2 ARG 42 2HB ARG 42 -10.215 3.491 -10.591 329 HB3 ARG 42 1HB ARG 42 -9.704 3.461 -8.902 330 HG2 ARG 42 2HG ARG 42 -11.537 4.941 -8.905 331 HG3 ARG 42 1HG ARG 42 -10.119 5.968 -8.929 332 HD2 ARG 42 2HD ARG 42 -11.312 6.960 -10.656 333 HD3 ARG 42 1HD ARG 42 -10.390 5.803 -11.500 334 HE ARG 42 HE ARG 42 -12.530 4.340 -11.007 335 HH11 ARG 42 1HH1 ARG 42 -12.162 7.602 -12.415 336 HH12 ARG 42 2HH1 ARG 42 -13.554 7.468 -13.386 337 HH21 ARG 42 1HH2 ARG 42 -14.451 4.217 -12.392 338 HH22 ARG 42 2HH2 ARG 42 -14.868 5.525 -13.379 339 H THR 43 H THR 43 -7.727 6.891 -9.843 340 HA THR 43 HA THR 43 -6.879 6.457 -7.096 341 HB THR 43 HB THR 43 -4.880 6.541 -8.638 342 HG1 THR 43 1HG THR 43 -3.761 7.879 -7.336 343 HG21 THR 43 3HG2 THR 43 -5.815 9.363 -9.131 344 HG22 THR 43 1HG2 THR 43 -5.731 8.065 -10.322 345 HG23 THR 43 2HG2 THR 43 -4.246 8.713 -9.615 346 H LYS 44 H LYS 44 -7.091 8.398 -5.864 347 HA LYS 44 HA LYS 44 -8.915 10.264 -7.160 348 HB2 LYS 44 2HB LYS 44 -9.909 10.847 -4.979 349 HB3 LYS 44 1HB LYS 44 -10.095 9.144 -5.309 350 HG2 LYS 44 2HG LYS 44 -8.100 10.372 -3.390 351 HG3 LYS 44 1HG LYS 44 -9.624 9.611 -2.946 352 HD2 LYS 44 2HD LYS 44 -8.770 7.485 -3.922 353 HD3 LYS 44 1HD LYS 44 -7.244 8.314 -4.232 354 HE2 LYS 44 2HE LYS 44 -6.997 8.757 -1.845 355 HE3 LYS 44 1HE LYS 44 -8.499 7.886 -1.535 356 HZ1 LYS 44 3HZ LYS 44 -7.477 5.906 -2.494 357 HZ2 LYS 44 1HZ LYS 44 -6.615 6.460 -1.147 358 HZ3 LYS 44 2HZ LYS 44 -6.035 6.742 -2.716 359 H LYS 45 H LYS 45 -8.120 12.004 -7.703 360 HA LYS 45 HA LYS 45 -5.962 13.175 -6.144 361 HB2 LYS 45 2HB LYS 45 -5.067 11.833 -8.117 362 HB3 LYS 45 1HB LYS 45 -6.059 12.829 -9.124 363 HG2 LYS 45 2HG LYS 45 -4.758 14.721 -8.775 364 HG3 LYS 45 1HG LYS 45 -3.896 13.978 -7.418 365 HD2 LYS 45 2HD LYS 45 -3.903 12.843 -10.165 366 HD3 LYS 45 1HD LYS 45 -2.630 13.987 -9.649 367 HE2 LYS 45 2HE LYS 45 -2.097 12.339 -7.821 368 HE3 LYS 45 1HE LYS 45 -3.293 11.245 -8.486 369 HZ1 LYS 45 3HZ LYS 45 -0.992 10.763 -9.147 370 HZ2 LYS 45 1HZ LYS 45 -0.913 12.210 -9.963 371 HZ3 LYS 45 2HZ LYS 45 -1.953 10.985 -10.489 372 H ASP 46 H ASP 46 -6.298 15.297 -5.846 373 HA ASP 46 HA ASP 46 -7.271 17.378 -5.874 374 HB2 ASP 46 2HB ASP 46 -6.329 17.446 -8.186 375 HB3 ASP 46 1HB ASP 46 -7.771 16.662 -8.802 376 H GLY 47 H GLY 47 -8.718 15.054 -5.137 377 HA2 GLY 47 2HA GLY 47 -10.774 14.541 -4.267 378 HA3 GLY 47 1HA GLY 47 -11.340 16.118 -4.782 379 H LYS 48 H LYS 48 -9.973 14.137 -7.225 380 HA LYS 48 HA LYS 48 -12.656 13.353 -8.134 381 HB2 LYS 48 2HB LYS 48 -10.371 14.420 -9.804 382 HB3 LYS 48 1HB LYS 48 -11.926 13.884 -10.417 383 HG2 LYS 48 2HG LYS 48 -13.043 15.708 -9.287 384 HG3 LYS 48 1HG LYS 48 -11.527 16.201 -8.534 385 HD2 LYS 48 2HD LYS 48 -10.590 16.652 -10.763 386 HD3 LYS 48 1HD LYS 48 -12.126 16.193 -11.493 387 HE2 LYS 48 2HE LYS 48 -11.916 18.630 -11.302 388 HE3 LYS 48 1HE LYS 48 -13.247 18.008 -10.326 389 HZ1 LYS 48 3HZ LYS 48 -11.930 19.669 -9.129 390 HZ2 LYS 48 1HZ LYS 48 -10.547 18.714 -9.261 391 HZ3 LYS 48 2HZ LYS 48 -11.869 18.184 -8.366 392 H GLN 49 H GLN 49 -12.754 11.252 -8.858 393 HA GLN 49 HA GLN 49 -10.299 9.762 -8.656 394 HB2 GLN 49 2HB GLN 49 -11.672 7.737 -9.042 395 HB3 GLN 49 1HB GLN 49 -12.112 8.599 -7.637 396 HG2 GLN 49 2HG GLN 49 -14.041 9.581 -8.847 397 HG3 GLN 49 1HG GLN 49 -13.578 8.646 -10.271 398 HE21 GLN 49 1HE2 GLN 49 -13.269 7.426 -7.019 399 HE22 GLN 49 2HE2 GLN 49 -14.489 6.228 -7.134 400 H VAL 50 H VAL 50 -9.062 9.243 -10.156 401 HA VAL 50 HA VAL 50 -9.974 9.485 -12.937 402 HB VAL 50 HB VAL 50 -7.842 10.566 -13.544 403 HG11 VAL 50 1HG1 VAL 50 -8.246 12.788 -12.573 404 HG12 VAL 50 2HG1 VAL 50 -9.321 12.059 -11.384 405 HG13 VAL 50 3HG1 VAL 50 -9.743 12.014 -13.096 406 HG21 VAL 50 3HG2 VAL 50 -6.330 11.457 -11.814 407 HG22 VAL 50 1HG2 VAL 50 -6.432 9.700 -11.731 408 HG23 VAL 50 2HG2 VAL 50 -7.312 10.685 -10.570 409 H TRP 51 H TRP 51 -8.218 8.549 -14.399 410 HA TRP 51 HA TRP 51 -7.357 6.043 -13.243 411 HB2 TRP 51 2HB TRP 51 -7.813 6.950 -16.079 412 HB3 TRP 51 1HB TRP 51 -7.170 5.394 -15.739 413 HD1 TRP 51 HD TRP 51 -10.193 6.968 -16.491 414 HE1 TRP 51 1HE TRP 51 -12.266 5.514 -15.827 415 HE3 TRP 51 3HE TRP 51 -7.866 3.710 -13.417 416 HZ2 TRP 51 2HZ TRP 51 -12.755 3.287 -14.155 417 HZ3 TRP 51 3HZ TRP 51 -9.172 1.937 -12.325 418 HH2 TRP 51 HH TRP 51 -11.567 1.731 -12.691 419 H GLU 52 H GLU 52 -5.316 5.833 -12.749 420 HA GLU 52 HA GLU 52 -3.339 7.651 -13.959 421 HB2 GLU 52 2HB GLU 52 -3.781 7.906 -11.519 422 HB3 GLU 52 1HB GLU 52 -3.305 6.233 -11.283 423 HG2 GLU 52 2HG GLU 52 -1.487 7.660 -10.650 424 HG3 GLU 52 1HG GLU 52 -1.065 6.805 -12.139 425 H ALA 53 H ALA 53 -1.459 6.671 -14.701 426 HA ALA 53 HA ALA 53 -1.756 3.930 -15.449 427 HB1 ALA 53 1HB ALA 53 0.607 5.749 -15.856 428 HB2 ALA 53 2HB ALA 53 -0.748 5.571 -16.972 429 HB3 ALA 53 3HB ALA 53 0.325 4.206 -16.656 430 H ALA 54 H ALA 54 -0.802 2.210 -14.707 431 HA ALA 54 HA ALA 54 0.301 2.144 -12.108 432 HB1 ALA 54 1HB ALA 54 0.416 0.047 -14.272 433 HB2 ALA 54 2HB ALA 54 -0.885 0.240 -13.097 434 HB3 ALA 54 3HB ALA 54 0.733 -0.217 -12.559 435 H SER 55 H SER 55 2.495 1.369 -11.560 436 HA SER 55 HA SER 55 4.387 2.778 -13.265 437 HB2 SER 55 2HB SER 55 4.244 3.471 -10.882 438 HB3 SER 55 1HB SER 55 4.633 1.828 -10.392 439 HG SER 55 HG SER 55 6.614 2.515 -10.472 440 H LYS 56 H LYS 56 6.211 1.746 -13.976 441 HA LYS 56 HA LYS 56 5.981 -0.963 -14.619 442 HB2 LYS 56 2HB LYS 56 7.235 0.653 -15.966 443 HB3 LYS 56 1HB LYS 56 8.390 0.843 -14.662 444 HG2 LYS 56 2HG LYS 56 9.202 -1.391 -14.976 445 HG3 LYS 56 1HG LYS 56 7.924 -1.739 -16.145 446 HD2 LYS 56 2HD LYS 56 10.070 -1.257 -17.263 447 HD3 LYS 56 1HD LYS 56 8.829 -0.073 -17.666 448 HE2 LYS 56 2HE LYS 56 9.773 1.480 -16.035 449 HE3 LYS 56 1HE LYS 56 11.015 0.305 -15.610 450 HZ1 LYS 56 3HZ LYS 56 11.857 0.472 -17.886 451 HZ2 LYS 56 1HZ LYS 56 11.819 1.986 -17.150 452 HZ3 LYS 56 2HZ LYS 56 10.642 1.563 -18.273 453 H THR 57 H THR 57 7.463 0.642 -11.918 454 HA THR 57 HA THR 57 8.965 -1.520 -10.952 455 HB THR 57 HB THR 57 8.835 -0.263 -8.773 456 HG1 THR 57 1HG THR 57 7.521 1.331 -8.558 457 HG21 THR 57 3HG2 THR 57 9.527 1.366 -11.226 458 HG22 THR 57 1HG2 THR 57 10.598 0.228 -10.411 459 HG23 THR 57 2HG2 THR 57 10.088 1.703 -9.589 460 H ALA 58 H ALA 58 5.722 -0.357 -10.179 461 HA ALA 58 HA ALA 58 5.058 -2.413 -8.317 462 HB1 ALA 58 1HB ALA 58 3.213 -0.605 -9.885 463 HB2 ALA 58 2HB ALA 58 3.921 -0.234 -8.313 464 HB3 ALA 58 3HB ALA 58 2.769 -1.559 -8.470 465 H LEU 59 H LEU 59 4.605 -1.979 -11.765 466 HA LEU 59 HA LEU 59 3.001 -4.185 -12.256 467 HB2 LEU 59 2HB LEU 59 4.964 -2.624 -13.874 468 HB3 LEU 59 1HB LEU 59 4.101 -4.050 -14.576 469 HG LEU 59 HG LEU 59 2.857 -1.511 -13.500 470 HD11 LEU 59 1HD1 LEU 59 4.194 -1.053 -15.518 471 HD12 LEU 59 2HD1 LEU 59 2.475 -0.974 -15.873 472 HD13 LEU 59 3HD1 LEU 59 3.397 -2.396 -16.345 473 HD21 LEU 59 3HD2 LEU 59 0.866 -2.315 -14.588 474 HD22 LEU 59 1HD2 LEU 59 1.430 -3.547 -13.455 475 HD23 LEU 59 2HD2 LEU 59 1.724 -3.729 -15.186 476 H LYS 60 H LYS 60 6.534 -3.907 -12.006 477 HA LYS 60 HA LYS 60 7.029 -6.574 -12.720 478 HB2 LYS 60 2HB LYS 60 8.694 -4.686 -11.076 479 HB3 LYS 60 1HB LYS 60 9.244 -6.293 -11.534 480 HG2 LYS 60 2HG LYS 60 8.949 -5.683 -13.903 481 HG3 LYS 60 1HG LYS 60 8.490 -4.058 -13.393 482 HD2 LYS 60 2HD LYS 60 10.675 -3.763 -12.361 483 HD3 LYS 60 1HD LYS 60 11.124 -5.405 -12.839 484 HE2 LYS 60 2HE LYS 60 10.833 -4.807 -15.178 485 HE3 LYS 60 1HE LYS 60 10.381 -3.166 -14.719 486 HZ1 LYS 60 3HZ LYS 60 12.646 -3.221 -15.394 487 HZ2 LYS 60 1HZ LYS 60 13.032 -4.456 -14.302 488 HZ3 LYS 60 2HZ LYS 60 12.611 -2.909 -13.764 489 H LYS 61 H LYS 61 6.157 -5.205 -9.633 490 HA LYS 61 HA LYS 61 6.567 -7.672 -8.236 491 HB2 LYS 61 2HB LYS 61 5.173 -5.127 -7.478 492 HB3 LYS 61 1HB LYS 61 4.971 -6.564 -6.492 493 HG2 LYS 61 2HG LYS 61 6.695 -5.118 -5.580 494 HG3 LYS 61 1HG LYS 61 7.371 -6.649 -6.112 495 HD2 LYS 61 2HD LYS 61 8.158 -5.563 -8.164 496 HD3 LYS 61 1HD LYS 61 7.494 -4.030 -7.594 497 HE2 LYS 61 2HE LYS 61 8.939 -4.126 -5.639 498 HE3 LYS 61 1HE LYS 61 9.588 -5.666 -6.196 499 HZ1 LYS 61 3HZ LYS 61 11.039 -3.848 -6.724 500 HZ2 LYS 61 1HZ LYS 61 9.824 -3.076 -7.607 501 HZ3 LYS 61 2HZ LYS 61 10.455 -4.559 -8.140 502 H SER 62 H SER 62 4.007 -6.314 -10.032 503 HA SER 62 HA SER 62 2.017 -8.149 -9.148 504 HB2 SER 62 2HB SER 62 2.144 -6.462 -11.662 505 HB3 SER 62 1HB SER 62 0.700 -7.242 -11.007 506 HG SER 62 HG SER 62 2.232 -5.155 -9.839 507 H TRP 63 H TRP 63 4.297 -7.995 -11.911 508 HA TRP 63 HA TRP 63 3.386 -10.415 -13.031 509 HB2 TRP 63 2HB TRP 63 4.519 -8.644 -14.341 510 HB3 TRP 63 1HB TRP 63 5.998 -8.945 -13.432 511 HD1 TRP 63 HD TRP 63 7.481 -10.784 -14.229 512 HE1 TRP 63 1HE TRP 63 7.405 -12.541 -16.183 513 HE3 TRP 63 3HE TRP 63 2.667 -10.117 -15.680 514 HZ2 TRP 63 2HZ TRP 63 5.467 -13.481 -18.062 515 HZ3 TRP 63 3HZ TRP 63 1.747 -11.475 -17.529 516 HH2 TRP 63 HH TRP 63 3.135 -13.109 -18.692 517 H LYS 64 H LYS 64 5.691 -9.516 -10.615 518 HA LYS 64 HA LYS 64 7.243 -11.782 -10.419 519 HB2 LYS 64 2HB LYS 64 7.646 -9.773 -9.101 520 HB3 LYS 64 1HB LYS 64 6.162 -10.045 -8.203 521 HG2 LYS 64 2HG LYS 64 7.103 -12.110 -7.294 522 HG3 LYS 64 1HG LYS 64 8.601 -11.794 -8.175 523 HD2 LYS 64 2HD LYS 64 8.884 -9.722 -6.973 524 HD3 LYS 64 1HD LYS 64 7.374 -10.001 -6.098 525 HE2 LYS 64 2HE LYS 64 8.301 -12.051 -5.164 526 HE3 LYS 64 1HE LYS 64 9.824 -11.756 -6.007 527 HZ1 LYS 64 3HZ LYS 64 8.632 -10.022 -3.906 528 HZ2 LYS 64 1HZ LYS 64 10.041 -9.694 -4.745 529 HZ3 LYS 64 2HZ LYS 64 9.974 -11.031 -3.721 530 H ARG 65 H ARG 65 3.972 -11.163 -9.303 531 HA ARG 65 HA ARG 65 3.544 -13.504 -7.722 532 HB2 ARG 65 2HB ARG 65 1.955 -11.351 -8.057 533 HB3 ARG 65 1HB ARG 65 1.509 -12.226 -9.451 534 HG2 ARG 65 2HG ARG 65 -0.096 -12.751 -7.845 535 HG3 ARG 65 1HG ARG 65 0.885 -14.181 -8.148 536 HD2 ARG 65 2HD ARG 65 2.225 -13.454 -6.074 537 HD3 ARG 65 1HD ARG 65 0.854 -12.317 -5.909 538 HE ARG 65 HE ARG 65 -0.287 -14.731 -6.252 539 HH11 ARG 65 1HH1 ARG 65 1.895 -13.353 -3.808 540 HH12 ARG 65 2HH1 ARG 65 1.290 -14.318 -2.531 541 HH21 ARG 65 1HH2 ARG 65 -1.133 -15.992 -4.478 542 HH22 ARG 65 2HH2 ARG 65 -0.470 -15.834 -2.912 543 H TYR 66 H TYR 66 3.077 -12.648 -11.080 544 HA TYR 66 HA TYR 66 1.741 -14.922 -12.096 545 HB2 TYR 66 2HB TYR 66 2.286 -12.539 -13.067 546 HB3 TYR 66 1HB TYR 66 3.751 -13.322 -13.623 547 HD1 TYR 66 1HD TYR 66 3.366 -15.508 -15.075 548 HD2 TYR 66 2HD TYR 66 0.438 -12.545 -14.322 549 HE1 TYR 66 1HE TYR 66 2.154 -16.225 -17.055 550 HE2 TYR 66 2HE TYR 66 -0.786 -13.226 -16.273 551 HH TYR 66 HH TYR 66 -0.155 -16.127 -17.928 552 H GLU 67 H GLU 67 5.134 -14.056 -11.751 553 HA GLU 67 HA GLU 67 6.305 -16.358 -12.907 554 HB2 GLU 67 2HB GLU 67 7.336 -14.588 -10.695 555 HB3 GLU 67 1HB GLU 67 8.294 -15.716 -11.645 556 HG2 GLU 67 2HG GLU 67 6.755 -13.443 -12.716 557 HG3 GLU 67 1HG GLU 67 8.478 -13.337 -12.342 558 H GLN 68 H GLN 68 5.629 -15.483 -9.622 559 HA GLN 68 HA GLN 68 6.537 -17.887 -8.478 560 HB2 GLN 68 2HB GLN 68 4.711 -15.776 -7.409 561 HB3 GLN 68 1HB GLN 68 5.165 -17.156 -6.435 562 HG2 GLN 68 2HG GLN 68 7.060 -15.148 -7.652 563 HG3 GLN 68 1HG GLN 68 6.542 -15.183 -5.970 564 HE21 GLN 68 1HE2 GLN 68 8.664 -15.413 -5.239 565 HE22 GLN 68 2HE2 GLN 68 9.531 -16.890 -5.400 566 H GLU 69 H GLU 69 3.197 -16.945 -9.232 567 HA GLU 69 HA GLU 69 2.252 -19.453 -8.299 568 HB2 GLU 69 2HB GLU 69 0.818 -17.266 -9.778 569 HB3 GLU 69 1HB GLU 69 0.040 -18.767 -9.296 570 HG2 GLU 69 2HG GLU 69 0.678 -18.253 -6.949 571 HG3 GLU 69 1HG GLU 69 1.255 -16.685 -7.497 572 H MET 70 H MET 70 2.925 -18.213 -11.527 573 HA MET 70 HA MET 70 1.797 -20.562 -12.701 574 HB2 MET 70 2HB MET 70 3.433 -18.384 -13.947 575 HB3 MET 70 1HB MET 70 2.838 -19.768 -14.849 576 HG2 MET 70 2HG MET 70 1.175 -17.706 -13.421 577 HG3 MET 70 1HG MET 70 1.406 -17.848 -15.161 578 HE1 MET 70 3HE MET 70 -0.363 -21.333 -15.849 579 HE2 MET 70 1HE MET 70 1.312 -21.176 -15.317 580 HE3 MET 70 2HE MET 70 0.659 -20.066 -16.522 581 H LEU 71 H LEU 71 5.108 -19.696 -11.780 582 HA LEU 71 HA LEU 71 6.201 -21.861 -13.229 583 HB2 LEU 71 2HB LEU 71 7.437 -19.809 -12.631 584 HB3 LEU 71 1HB LEU 71 7.317 -20.240 -10.941 585 HG LEU 71 HG LEU 71 8.666 -22.187 -11.340 586 HD11 LEU 71 1HD1 LEU 71 9.892 -22.397 -13.509 587 HD12 LEU 71 2HD1 LEU 71 8.913 -21.083 -14.156 588 HD13 LEU 71 3HD1 LEU 71 8.153 -22.608 -13.704 589 HD21 LEU 71 3HD2 LEU 71 9.699 -20.107 -10.634 590 HD22 LEU 71 1HD2 LEU 71 9.900 -19.616 -12.311 591 HD23 LEU 71 2HD2 LEU 71 10.798 -21.001 -11.688 592 H LYS 72 H LYS 72 4.929 -21.364 -10.044 593 HA LYS 72 HA LYS 72 5.653 -23.953 -9.064 594 HB2 LYS 72 2HB LYS 72 5.269 -22.127 -7.494 595 HB3 LYS 72 1HB LYS 72 3.646 -21.899 -8.098 596 HG2 LYS 72 2HG LYS 72 2.943 -23.993 -7.094 597 HG3 LYS 72 1HG LYS 72 4.602 -24.335 -6.583 598 HD2 LYS 72 2HD LYS 72 4.617 -22.407 -5.130 599 HD3 LYS 72 1HD LYS 72 3.057 -21.881 -5.743 600 HE2 LYS 72 2HE LYS 72 2.905 -22.894 -3.503 601 HE3 LYS 72 1HE LYS 72 1.965 -23.777 -4.690 602 HZ1 LYS 72 3HZ LYS 72 3.201 -25.130 -3.124 603 HZ2 LYS 72 1HZ LYS 72 4.679 -24.664 -3.717 604 HZ3 LYS 72 2HZ LYS 72 3.546 -25.563 -4.644 605 H ASN 73 H ASN 73 2.694 -22.428 -10.264 606 HA ASN 73 HA ASN 73 0.773 -23.097 -11.153 607 HB2 ASN 73 2HB ASN 73 2.408 -23.896 -12.934 608 HB3 ASN 73 1HB ASN 73 2.295 -25.494 -12.192 609 HD21 ASN 73 1HD2 ASN 73 1.481 -26.346 -14.174 610 HD22 ASN 73 2HD2 ASN 73 -0.153 -26.050 -14.656 611 H GLU 74 H GLU 74 1.477 -24.073 -8.503 612 HA GLU 74 HA GLU 74 0.123 -26.599 -8.315 613 HB2 GLU 74 2HB GLU 74 1.980 -25.953 -6.747 614 HB3 GLU 74 1HB GLU 74 0.891 -24.753 -6.066 615 HG2 GLU 74 2HG GLU 74 -0.647 -26.541 -5.396 616 HG3 GLU 74 1HG GLU 74 0.481 -27.736 -6.039 617 H LYS 75 H LYS 75 -1.632 -25.934 -9.339 618 HA LYS 75 HA LYS 75 -3.776 -24.850 -7.638 619 HB2 LYS 75 2HB LYS 75 -3.397 -24.302 -10.618 620 HB3 LYS 75 1HB LYS 75 -4.781 -23.802 -9.667 621 HG2 LYS 75 2HG LYS 75 -3.397 -22.285 -8.379 622 HG3 LYS 75 1HG LYS 75 -1.954 -22.842 -9.226 623 HD2 LYS 75 2HD LYS 75 -2.885 -21.992 -11.344 624 HD3 LYS 75 1HD LYS 75 -4.315 -21.426 -10.483 625 HE2 LYS 75 2HE LYS 75 -1.486 -20.490 -9.949 626 HE3 LYS 75 1HE LYS 75 -2.668 -19.625 -10.925 627 HZ1 LYS 75 3HZ LYS 75 -2.497 -18.801 -8.610 628 HZ2 LYS 75 1HZ LYS 75 -3.044 -20.278 -8.040 629 HZ3 LYS 75 2HZ LYS 75 -4.031 -19.295 -9.004 630 H VAL 76 H VAL 76 -2.920 -26.374 -10.670 631 HA VAL 76 HA VAL 76 -5.011 -28.375 -10.429 632 HB VAL 76 HB VAL 76 -2.849 -28.006 -12.541 633 HG11 VAL 76 1HG1 VAL 76 -3.712 -30.282 -12.487 634 HG12 VAL 76 2HG1 VAL 76 -4.216 -29.446 -13.954 635 HG13 VAL 76 3HG1 VAL 76 -5.360 -29.665 -12.626 636 HG21 VAL 76 3HG2 VAL 76 -5.733 -27.128 -12.590 637 HG22 VAL 76 1HG2 VAL 76 -4.608 -27.030 -13.942 638 HG23 VAL 76 2HG2 VAL 76 -4.324 -26.076 -12.485 639 H ALA 77 H ALA 77 -1.466 -28.094 -10.596 640 HA ALA 77 HA ALA 77 0.234 -29.158 -9.627 641 HB1 ALA 77 1HB ALA 77 -0.086 -30.434 -7.591 642 HB2 ALA 77 2HB ALA 77 -1.813 -30.564 -7.935 643 HB3 ALA 77 3HB ALA 77 -1.112 -28.989 -7.560 644 H ALA 78 H ALA 78 -1.443 -30.382 -11.810 645 HA ALA 78 HA ALA 78 -1.047 -33.211 -11.547 646 HB1 ALA 78 1HB ALA 78 -1.818 -33.370 -13.864 647 HB2 ALA 78 2HB ALA 78 -1.715 -31.619 -14.028 648 HB3 ALA 78 3HB ALA 78 -2.886 -32.335 -12.918 649 H LYS 79 H LYS 79 0.315 -30.962 -13.997 650 HA LYS 79 HA LYS 79 2.855 -32.341 -13.644 651 HB2 LYS 79 2HB LYS 79 1.493 -31.882 -16.289 652 HB3 LYS 79 1HB LYS 79 3.211 -32.208 -16.152 653 HG2 LYS 79 2HG LYS 79 1.006 -34.047 -15.222 654 HG3 LYS 79 1HG LYS 79 1.922 -34.218 -16.722 655 HD2 LYS 79 2HD LYS 79 3.999 -34.444 -15.413 656 HD3 LYS 79 1HD LYS 79 3.065 -34.299 -13.925 657 HE2 LYS 79 2HE LYS 79 1.837 -36.328 -14.505 658 HE3 LYS 79 1HE LYS 79 2.778 -36.472 -15.990 659 HZ1 LYS 79 3HZ LYS 79 3.651 -37.879 -14.230 660 HZ2 LYS 79 1HZ LYS 79 3.874 -36.535 -13.240 661 HZ3 LYS 79 2HZ LYS 79 4.781 -36.690 -14.645 662 H MET 80 H MET 80 4.007 -30.879 -12.766 663 HA MET 80 HA MET 80 5.258 -28.898 -14.249 664 HB2 MET 80 2HB MET 80 3.091 -27.637 -13.863 665 HB3 MET 80 1HB MET 80 3.401 -27.741 -12.137 666 HG2 MET 80 2HG MET 80 4.099 -25.564 -12.944 667 HG3 MET 80 1HG MET 80 5.509 -26.503 -12.468 668 HE1 MET 80 3HE MET 80 6.806 -24.361 -15.485 669 HE2 MET 80 1HE MET 80 7.049 -24.784 -13.791 670 HE3 MET 80 2HE MET 80 5.619 -23.872 -14.274 671 H LEU 81 H LEU 81 4.098 -29.127 -10.891 672 HA LEU 81 HA LEU 81 6.711 -30.012 -10.016 673 HB2 LEU 81 2HB LEU 81 5.253 -27.639 -8.850 674 HB3 LEU 81 1HB LEU 81 6.545 -28.480 -8.037 675 HG LEU 81 HG LEU 81 6.791 -26.908 -10.603 676 HD11 LEU 81 1HD1 LEU 81 7.852 -26.383 -7.827 677 HD12 LEU 81 2HD1 LEU 81 6.440 -25.616 -8.513 678 HD13 LEU 81 3HD1 LEU 81 8.033 -25.323 -9.233 679 HD21 LEU 81 3HD2 LEU 81 8.887 -28.334 -8.952 680 HD22 LEU 81 1HD2 LEU 81 9.193 -27.296 -10.346 681 HD23 LEU 81 2HD2 LEU 81 8.329 -28.813 -10.559 682 H GLU 82 H GLU 82 6.604 -30.800 -7.807 683 HA GLU 82 HA GLU 82 4.067 -31.297 -6.621 684 HB2 GLU 82 2HB GLU 82 4.349 -33.751 -6.613 685 HB3 GLU 82 1HB GLU 82 4.077 -33.114 -8.227 686 HG2 GLU 82 2HG GLU 82 6.400 -33.350 -8.773 687 HG3 GLU 82 1HG GLU 82 6.776 -33.805 -7.112 688 H LYS 83 H LYS 83 4.396 -32.361 -4.569 689 HA LYS 83 HA LYS 83 5.387 -32.623 -2.569 690 HB2 LYS 83 2HB LYS 83 7.780 -33.269 -4.296 691 HB3 LYS 83 1HB LYS 83 7.718 -33.536 -2.560 692 HG2 LYS 83 2HG LYS 83 5.892 -35.116 -2.833 693 HG3 LYS 83 1HG LYS 83 5.847 -34.780 -4.563 694 HD2 LYS 83 2HD LYS 83 8.075 -35.688 -4.828 695 HD3 LYS 83 1HD LYS 83 8.203 -35.958 -3.088 696 HE2 LYS 83 2HE LYS 83 7.661 -38.023 -4.328 697 HE3 LYS 83 1HE LYS 83 6.398 -37.586 -3.187 698 HZ1 LYS 83 3HZ LYS 83 6.309 -36.991 -6.107 699 HZ2 LYS 83 1HZ LYS 83 5.100 -36.697 -4.982 700 HZ3 LYS 83 2HZ LYS 83 5.516 -38.277 -5.362 701 H ASP 84 H ASP 84 5.514 -29.968 -3.981 702 HA ASP 84 HA ASP 84 7.842 -28.697 -2.864 703 HB2 ASP 84 2HB ASP 84 6.755 -27.730 -4.872 704 HB3 ASP 84 1HB ASP 84 5.284 -27.454 -3.949 705 H ALA 85 H ALA 85 4.529 -29.214 -2.030 706 HA ALA 85 HA ALA 85 4.956 -28.036 0.606 707 HB1 ALA 85 1HB ALA 85 2.458 -29.181 -0.673 708 HB2 ALA 85 2HB ALA 85 2.845 -27.467 -0.529 709 HB3 ALA 85 3HB ALA 85 2.535 -28.427 0.919 710 H THR 86 H THR 86 6.154 -29.463 1.722 711 HA THR 86 HA THR 86 5.639 -32.318 1.463 712 HB THR 86 HB THR 86 7.700 -32.514 2.889 713 HG1 THR 86 1HG THR 86 7.274 -29.924 3.198 714 HG21 THR 86 3HG2 THR 86 9.237 -31.902 1.079 715 HG22 THR 86 1HG2 THR 86 7.949 -30.983 0.298 716 HG23 THR 86 2HG2 THR 86 7.808 -32.735 0.460 717 H GLU 87 H GLU 87 5.208 -33.652 3.205 718 HA GLU 87 HA GLU 87 3.742 -32.438 5.361 719 HB2 GLU 87 2HB GLU 87 3.036 -34.549 4.133 720 HB3 GLU 87 1HB GLU 87 4.403 -35.357 4.861 721 HG2 GLU 87 2HG GLU 87 2.112 -34.155 6.423 722 HG3 GLU 87 1HG GLU 87 2.184 -35.834 5.921 723 H VAL 88 H VAL 88 4.912 -31.562 6.888 724 HA VAL 88 HA VAL 88 7.082 -33.119 8.105 725 HB VAL 88 HB VAL 88 7.094 -30.101 7.725 726 HG11 VAL 88 1HG1 VAL 88 9.374 -30.175 8.644 727 HG12 VAL 88 2HG1 VAL 88 9.192 -31.902 8.935 728 HG13 VAL 88 3HG1 VAL 88 8.175 -30.750 9.804 729 HG21 VAL 88 3HG2 VAL 88 8.813 -32.206 6.405 730 HG22 VAL 88 1HG2 VAL 88 9.026 -30.464 6.236 731 HG23 VAL 88 2HG2 VAL 88 7.567 -31.239 5.619 732 H GLY 89 H GLY 89 6.746 -33.427 10.237 733 HA2 GLY 89 2HA GLY 89 5.982 -31.695 12.159 734 HA3 GLY 89 1HA GLY 89 4.455 -32.245 11.478 735 H VAL 90 H VAL 90 4.422 -32.960 13.892 736 HA VAL 90 HA VAL 90 4.843 -35.771 13.892 737 HB VAL 90 HB VAL 90 7.105 -35.032 14.527 738 HG11 VAL 90 1HG1 VAL 90 6.602 -32.892 15.483 739 HG12 VAL 90 2HG1 VAL 90 7.528 -33.865 16.627 740 HG13 VAL 90 3HG1 VAL 90 5.789 -33.661 16.846 741 HG21 VAL 90 3HG2 VAL 90 5.585 -36.266 16.829 742 HG22 VAL 90 1HG2 VAL 90 7.338 -36.305 16.637 743 HG23 VAL 90 2HG2 VAL 90 6.305 -37.127 15.471 744 H LYS 91 H LYS 91 3.582 -36.779 15.329 745 HA LYS 91 HA LYS 91 1.635 -35.209 16.843 746 HB2 LYS 91 2HB LYS 91 0.817 -36.798 15.207 747 HB3 LYS 91 1HB LYS 91 1.766 -38.072 15.940 748 HG2 LYS 91 2HG LYS 91 0.398 -37.978 17.938 749 HG3 LYS 91 1HG LYS 91 -0.530 -36.635 17.250 750 HD2 LYS 91 2HD LYS 91 -1.224 -37.960 15.448 751 HD3 LYS 91 1HD LYS 91 -0.242 -39.330 15.972 752 HE2 LYS 91 2HE LYS 91 -1.605 -39.467 18.037 753 HE3 LYS 91 1HE LYS 91 -2.595 -38.131 17.460 754 HZ1 LYS 91 3HZ LYS 91 -2.319 -40.781 16.148 755 HZ2 LYS 91 1HZ LYS 91 -3.253 -39.508 15.568 756 HZ3 LYS 91 2HZ LYS 91 -3.659 -40.260 17.021 757 H ALA 92 H ALA 92 1.671 -35.300 19.064 758 HA ALA 92 HA ALA 92 3.825 -36.388 20.488 759 HB1 ALA 92 1HB ALA 92 1.082 -35.657 21.540 760 HB2 ALA 92 2HB ALA 92 2.468 -34.567 21.420 761 HB3 ALA 92 3HB ALA 92 2.517 -35.936 22.520 762 H ALA 93 H ALA 93 4.206 -38.335 21.277 763 HA ALA 93 HA ALA 93 2.395 -40.436 20.566 764 HB1 ALA 93 1HB ALA 93 4.790 -40.723 20.206 765 HB2 ALA 93 2HB ALA 93 4.156 -41.957 21.296 766 HB3 ALA 93 3HB ALA 93 5.069 -40.592 21.939 767 H LEU 94 H LEU 94 0.670 -40.092 21.858 768 HA LEU 94 HA LEU 94 1.018 -40.460 24.720 769 HB2 LEU 94 2HB LEU 94 -1.333 -39.981 24.990 770 HB3 LEU 94 1HB LEU 94 -0.644 -38.768 23.945 771 HG LEU 94 HG LEU 94 -2.419 -41.067 23.075 772 HD11 LEU 94 1HD1 LEU 94 -3.618 -39.414 24.345 773 HD12 LEU 94 2HD1 LEU 94 -4.071 -39.318 22.641 774 HD13 LEU 94 3HD1 LEU 94 -2.973 -38.127 23.331 775 HD21 LEU 94 3HD2 LEU 94 -0.913 -40.471 21.244 776 HD22 LEU 94 1HD2 LEU 94 -1.307 -38.759 21.454 777 HD23 LEU 94 2HD2 LEU 94 -2.539 -39.889 20.904 778 H GLU 95 H GLU 95 0.188 -42.251 25.836 779 HA GLU 95 HA GLU 95 -0.326 -44.554 24.101 780 HB2 GLU 95 2HB GLU 95 1.361 -44.385 26.585 781 HB3 GLU 95 1HB GLU 95 0.919 -45.895 25.797 782 HG2 GLU 95 2HG GLU 95 2.122 -45.324 23.840 783 HG3 GLU 95 1HG GLU 95 2.389 -43.677 24.402 784 H GLU 96 H GLU 96 -1.819 -45.986 24.741 785 HA GLU 96 HA GLU 96 -3.710 -45.092 26.753 786 HB2 GLU 96 2HB GLU 96 -3.831 -47.527 24.962 787 HB3 GLU 96 1HB GLU 96 -5.159 -46.800 25.847 788 HG2 GLU 96 2HG GLU 96 -3.682 -45.581 23.538 789 HG3 GLU 96 1HG GLU 96 -5.287 -46.298 23.482 790 H ALA 97 H ALA 97 -3.553 -45.858 28.795 791 HA ALA 97 HA ALA 97 -2.629 -48.574 29.188 792 HB1 ALA 97 1HB ALA 97 -1.060 -47.951 30.953 793 HB2 ALA 97 2HB ALA 97 -1.410 -46.247 30.680 794 HB3 ALA 97 3HB ALA 97 -0.611 -47.193 29.426 795 H LYS 98 H LYS 98 -4.607 -49.185 29.775 796 HA LYS 98 HA LYS 98 -5.326 -48.967 32.477 797 HB2 LYS 98 2HB LYS 98 -6.319 -46.810 31.787 798 HB3 LYS 98 1HB LYS 98 -7.186 -47.617 30.489 799 HG2 LYS 98 2HG LYS 98 -8.440 -48.923 32.146 800 HG3 LYS 98 1HG LYS 98 -7.576 -48.090 33.433 801 HD2 LYS 98 2HD LYS 98 -8.539 -45.971 32.748 802 HD3 LYS 98 1HD LYS 98 -9.338 -46.750 31.382 803 HE2 LYS 98 2HE LYS 98 -10.619 -48.145 32.914 804 HE3 LYS 98 1HE LYS 98 -9.826 -47.378 34.288 805 HZ1 LYS 98 3HZ LYS 98 -10.826 -45.274 33.620 806 HZ2 LYS 98 1HZ LYS 98 -12.011 -46.454 33.867 807 HZ3 LYS 98 2HZ LYS 98 -11.543 -45.996 32.303 808 H LYS 99 H LYS 99 -6.139 -50.917 32.913 809 HA LYS 99 HA LYS 99 -7.084 -52.539 30.667 810 HB2 LYS 99 2HB LYS 99 -6.718 -54.466 32.119 811 HB3 LYS 99 1HB LYS 99 -5.271 -53.468 32.066 812 HG2 LYS 99 2HG LYS 99 -5.790 -52.538 34.240 813 HG3 LYS 99 1HG LYS 99 -7.307 -53.434 34.298 814 HD2 LYS 99 2HD LYS 99 -5.632 -54.539 35.652 815 HD3 LYS 99 1HD LYS 99 -6.007 -55.541 34.252 816 HE2 LYS 99 2HE LYS 99 -3.997 -54.746 33.135 817 HE3 LYS 99 1HE LYS 99 -3.632 -53.693 34.501 818 HZ1 LYS 99 3HZ LYS 99 -3.722 -56.664 34.545 819 HZ2 LYS 99 1HZ LYS 99 -3.433 -55.681 35.893 820 HZ3 LYS 99 2HZ LYS 99 -2.348 -55.686 34.611 821 H VAL 100 H VAL 100 -9.061 -53.710 30.864 822 HA VAL 100 HA VAL 100 -10.830 -52.614 32.872 823 HB VAL 100 HB VAL 100 -12.730 -53.632 31.540 824 HG11 VAL 100 1HG1 VAL 100 -12.151 -51.285 31.263 825 HG12 VAL 100 2HG1 VAL 100 -12.664 -51.975 29.722 826 HG13 VAL 100 3HG1 VAL 100 -10.949 -51.712 30.045 827 HG21 VAL 100 3HG2 VAL 100 -12.305 -54.336 29.214 828 HG22 VAL 100 1HG2 VAL 100 -11.477 -55.389 30.362 829 HG23 VAL 100 2HG2 VAL 100 -10.573 -54.159 29.479 830 H GLN 101 H GLN 101 -10.380 -53.656 34.642 831 HA GLN 101 HA GLN 101 -10.237 -56.565 34.550 832 HB2 GLN 101 2HB GLN 101 -8.338 -55.386 35.592 833 HB3 GLN 101 1HB GLN 101 -9.438 -54.683 36.769 834 HG2 GLN 101 2HG GLN 101 -9.958 -56.921 37.614 835 HG3 GLN 101 1HG GLN 101 -8.833 -57.615 36.447 836 HE21 GLN 101 1HE2 GLN 101 -9.158 -55.778 39.371 837 HE22 GLN 101 2HE2 GLN 101 -7.500 -55.891 39.837 838 H ILE 102 H ILE 102 -12.279 -57.169 34.530 839 HA ILE 102 HA ILE 102 -13.884 -56.400 36.843 840 HB ILE 102 HB ILE 102 -14.897 -55.691 34.706 841 HG12 ILE 102 2HG1 ILE 102 -16.462 -56.374 36.551 842 HG13 ILE 102 1HG1 ILE 102 -17.174 -56.501 34.957 843 HG21 ILE 102 1HG2 ILE 102 -14.871 -58.551 33.852 844 HG22 ILE 102 2HG2 ILE 102 -13.972 -57.205 33.159 845 HG23 ILE 102 3HG2 ILE 102 -15.727 -57.256 33.018 846 HD11 ILE 102 3HD1 ILE 102 -17.838 -58.342 36.400 847 HD12 ILE 102 1HD1 ILE 102 -16.148 -58.783 36.647 848 HD13 ILE 102 2HD1 ILE 102 -16.873 -58.940 35.049 849 H GLU 103 H GLU 103 -13.676 -57.846 38.332 850 HA GLU 103 HA GLU 103 -13.290 -60.650 37.598 851 HB2 GLU 103 2HB GLU 103 -12.945 -59.252 40.249 852 HB3 GLU 103 1HB GLU 103 -12.576 -60.935 39.917 853 HG2 GLU 103 2HG GLU 103 -10.840 -60.250 38.345 854 HG3 GLU 103 1HG GLU 103 -11.216 -58.558 38.668 855 H LEU 104 H LEU 104 -14.549 -62.251 38.736 856 HA LEU 104 HA LEU 104 -16.867 -61.306 40.129 857 HB2 LEU 104 2HB LEU 104 -17.518 -61.115 37.767 858 HB3 LEU 104 1HB LEU 104 -17.123 -62.801 37.521 859 HG LEU 104 HG LEU 104 -18.947 -63.430 39.075 860 HD11 LEU 104 1HD1 LEU 104 -19.003 -61.427 40.445 861 HD12 LEU 104 2HD1 LEU 104 -20.587 -61.718 39.729 862 HD13 LEU 104 3HD1 LEU 104 -19.532 -60.473 39.062 863 HD21 LEU 104 3HD2 LEU 104 -20.780 -62.858 37.576 864 HD22 LEU 104 1HD2 LEU 104 -19.345 -63.341 36.672 865 HD23 LEU 104 2HD2 LEU 104 -19.777 -61.634 36.799 866 H ASP 105 H ASP 105 -16.340 -62.494 41.852 867 HA ASP 105 HA ASP 105 -15.709 -65.307 41.603 868 HB2 ASP 105 2HB ASP 105 -14.669 -64.031 43.416 869 HB3 ASP 105 1HB ASP 105 -16.257 -63.622 44.058 870 H THR 106 H THR 106 -18.338 -63.260 42.461 871 HA THR 106 HA THR 106 -20.421 -63.532 43.102 872 HB THR 106 HB THR 106 -20.651 -63.683 40.691 873 HG1 THR 106 1HG THR 106 -22.547 -65.546 41.133 874 HG21 THR 106 3HG2 THR 106 -19.326 -65.682 40.181 875 HG22 THR 106 1HG2 THR 106 -20.944 -65.813 39.483 876 HG23 THR 106 2HG2 THR 106 -20.546 -66.693 40.960 877 H SER 107 H SER 107 -20.463 -64.203 45.144 878 HA SER 107 HA SER 107 -20.184 -67.043 45.724 879 HB2 SER 107 2HB SER 107 -20.394 -64.683 47.602 880 HB3 SER 107 1HB SER 107 -19.939 -66.329 48.036 881 HG SER 107 HG SER 107 -18.246 -65.641 46.123 882 H LEU 108 H LEU 108 -22.502 -64.387 46.332 883 HA LEU 108 HA LEU 108 -24.626 -64.289 47.047 884 HB2 LEU 108 2HB LEU 108 -24.853 -66.930 45.589 885 HB3 LEU 108 1HB LEU 108 -26.225 -66.104 46.279 886 HG LEU 108 HG LEU 108 -26.249 -65.714 43.961 887 HD11 LEU 108 1HD1 LEU 108 -25.215 -63.243 45.298 888 HD12 LEU 108 2HD1 LEU 108 -26.882 -63.811 45.247 889 HD13 LEU 108 3HD1 LEU 108 -26.075 -63.305 43.761 890 HD21 LEU 108 3HD2 LEU 108 -24.398 -64.703 42.724 891 HD22 LEU 108 1HD2 LEU 108 -23.968 -66.265 43.418 892 HD23 LEU 108 2HD2 LEU 108 -23.406 -64.774 44.178 893 H SER 109 H SER 109 -26.489 -65.776 48.080 894 HA SER 109 HA SER 109 -25.479 -67.681 49.973 895 HB2 SER 109 2HB SER 109 -26.535 -66.401 51.881 896 HB3 SER 109 1HB SER 109 -25.093 -65.638 51.218 897 HG SER 109 HG SER 109 -27.346 -64.852 49.926 898 H TYR 110 H TYR 110 -27.052 -69.202 50.292 899 HA TYR 110 HA TYR 110 -29.472 -68.681 48.863 900 HB2 TYR 110 2HB TYR 110 -30.032 -71.111 49.184 901 HB3 TYR 110 1HB TYR 110 -28.550 -70.806 48.306 902 HD1 TYR 110 2HD TYR 110 -26.390 -71.349 49.338 903 HD2 TYR 110 1HD TYR 110 -30.036 -72.245 51.303 904 HE1 TYR 110 2HE TYR 110 -25.190 -72.901 50.844 905 HE2 TYR 110 1HE TYR 110 -28.871 -73.782 52.801 906 HH TYR 110 HH TYR 110 -26.868 -75.082 52.851 907 H ILE 111 H ILE 111 -30.626 -67.383 49.872 908 HA ILE 111 HA ILE 111 -31.375 -67.897 52.579 909 HB ILE 111 HB ILE 111 -32.688 -65.729 52.415 910 HG12 ILE 111 2HG1 ILE 111 -31.867 -64.106 50.615 911 HG13 ILE 111 1HG1 ILE 111 -31.208 -65.490 49.767 912 HG21 ILE 111 1HG2 ILE 111 -30.574 -65.853 53.518 913 HG22 ILE 111 2HG2 ILE 111 -30.708 -64.324 52.654 914 HG23 ILE 111 3HG2 ILE 111 -29.719 -65.628 51.991 915 HD11 ILE 111 3HD1 ILE 111 -33.483 -66.396 49.564 916 HD12 ILE 111 1HD1 ILE 111 -33.316 -64.813 48.801 917 HD13 ILE 111 2HD1 ILE 111 -34.100 -64.960 50.369 Start of MODEL 19 1 H1 GLY -1 1HT GLY -1 -4.131 -10.265 -26.166 2 H2 GLY -1 2HT GLY -1 -3.907 -11.567 -25.126 3 H3 GLY -1 3HT GLY -1 -2.621 -10.547 -25.488 4 HA2 GLY -1 1HA GLY -1 -5.055 -9.763 -24.007 5 HA3 GLY -1 2HA GLY -1 -3.482 -10.092 -23.287 6 H SER 0 H SER 0 -5.057 -8.048 -25.715 7 HA SER 0 HA SER 0 -3.052 -5.976 -25.184 8 HB2 SER 0 2HB SER 0 -4.912 -6.333 -27.549 9 HB3 SER 0 1HB SER 0 -3.663 -5.099 -27.382 10 HG SER 0 HG SER 0 -3.421 -7.837 -27.890 11 H MET 1 H MET 1 -5.637 -6.791 -23.795 12 HA MET 1 HA MET 1 -7.519 -4.697 -24.183 13 HB2 MET 1 2HB MET 1 -7.210 -6.593 -21.839 14 HB3 MET 1 1HB MET 1 -8.586 -5.551 -22.128 15 HG2 MET 1 2HG MET 1 -9.181 -7.781 -22.743 16 HG3 MET 1 1HG MET 1 -9.032 -6.836 -24.219 17 HE1 MET 1 3HE MET 1 -9.042 -9.151 -25.566 18 HE2 MET 1 1HE MET 1 -9.120 -10.061 -24.060 19 HE3 MET 1 2HE MET 1 -7.901 -10.459 -25.273 20 H THR 2 H THR 2 -7.826 -2.857 -23.013 21 HA THR 2 HA THR 2 -5.660 -1.880 -21.373 22 HB THR 2 HB THR 2 -8.376 -0.679 -21.980 23 HG1 THR 2 1HG THR 2 -7.140 0.562 -23.512 24 HG21 THR 2 3HG2 THR 2 -7.266 0.315 -20.028 25 HG22 THR 2 1HG2 THR 2 -7.291 1.460 -21.368 26 HG23 THR 2 2HG2 THR 2 -5.810 0.586 -20.975 27 H VAL 3 H VAL 3 -5.676 -2.183 -19.203 28 HA VAL 3 HA VAL 3 -8.138 -3.312 -18.104 29 HB VAL 3 HB VAL 3 -5.306 -3.636 -17.114 30 HG11 VAL 3 1HG1 VAL 3 -6.893 -3.804 -15.316 31 HG12 VAL 3 2HG1 VAL 3 -6.211 -5.367 -15.784 32 HG13 VAL 3 3HG1 VAL 3 -7.859 -4.955 -16.283 33 HG21 VAL 3 3HG2 VAL 3 -7.082 -5.572 -18.585 34 HG22 VAL 3 1HG2 VAL 3 -5.541 -5.948 -17.826 35 HG23 VAL 3 2HG2 VAL 3 -5.594 -4.828 -19.201 36 H TYR 4 H TYR 4 -9.253 -2.157 -16.637 37 HA TYR 4 HA TYR 4 -7.921 0.063 -15.298 38 HB2 TYR 4 2HB TYR 4 -10.854 -0.658 -15.485 39 HB3 TYR 4 1HB TYR 4 -10.186 0.798 -14.764 40 HD1 TYR 4 2HD TYR 4 -10.948 -0.920 -17.906 41 HD2 TYR 4 1HD TYR 4 -9.368 2.614 -16.165 42 HE1 TYR 4 2HE TYR 4 -11.147 0.221 -20.071 43 HE2 TYR 4 1HE TYR 4 -9.567 3.771 -18.323 44 HH TYR 4 HH TYR 4 -11.413 2.583 -20.821 45 H ILE 5 H ILE 5 -7.596 0.017 -13.147 46 HA ILE 5 HA ILE 5 -8.552 -2.339 -11.619 47 HB ILE 5 HB ILE 5 -6.106 -0.693 -10.964 48 HG12 ILE 5 2HG1 ILE 5 -4.676 -2.477 -11.523 49 HG13 ILE 5 1HG1 ILE 5 -5.905 -3.551 -12.075 50 HG21 ILE 5 1HG2 ILE 5 -7.102 -1.735 -9.048 51 HG22 ILE 5 2HG2 ILE 5 -5.550 -2.503 -9.396 52 HG23 ILE 5 3HG2 ILE 5 -7.054 -3.302 -9.842 53 HD11 ILE 5 3HD1 ILE 5 -4.884 -1.013 -13.392 54 HD12 ILE 5 1HD1 ILE 5 -6.304 -1.885 -13.954 55 HD13 ILE 5 2HD1 ILE 5 -4.722 -2.667 -13.984 56 H CYS 6 H CYS 6 -10.057 -1.708 -10.208 57 HA CYS 6 HA CYS 6 -9.474 0.630 -8.582 58 HB2 CYS 6 2HB CYS 6 -11.470 1.176 -9.956 59 HB3 CYS 6 1HB CYS 6 -12.232 -0.301 -9.393 60 HG CYS 6 HG CYS 6 -11.518 2.431 -7.396 61 HA PRO 7 HA PRO 7 -9.273 -3.086 -5.960 62 HB2 PRO 7 2HB PRO 7 -8.063 -1.066 -4.149 63 HB3 PRO 7 1HB PRO 7 -7.451 -2.657 -4.617 64 HG2 PRO 7 2HG PRO 7 -6.340 -0.441 -5.585 65 HG3 PRO 7 1HG PRO 7 -6.560 -1.870 -6.611 66 HD2 PRO 7 2HD PRO 7 -8.167 0.655 -6.512 67 HD3 PRO 7 1HD PRO 7 -7.643 -0.306 -7.915 68 H GLU 8 H GLU 8 -10.478 0.055 -5.453 69 HA GLU 8 HA GLU 8 -11.597 -0.017 -2.882 70 HB2 GLU 8 2HB GLU 8 -12.703 1.449 -5.249 71 HB3 GLU 8 1HB GLU 8 -12.885 1.844 -3.551 72 HG2 GLU 8 2HG GLU 8 -10.516 2.379 -3.430 73 HG3 GLU 8 1HG GLU 8 -10.394 1.895 -5.141 74 H THR 9 H THR 9 -13.349 -0.111 -5.966 75 HA THR 9 HA THR 9 -15.438 -1.642 -4.622 76 HB THR 9 HB THR 9 -16.126 0.655 -4.726 77 HG1 THR 9 1HG THR 9 -17.421 -1.207 -6.340 78 HG21 THR 9 3HG2 THR 9 -14.691 1.433 -6.527 79 HG22 THR 9 1HG2 THR 9 -16.372 1.872 -6.863 80 HG23 THR 9 2HG2 THR 9 -15.623 0.508 -7.704 81 H GLY 10 H GLY 10 -13.202 -1.922 -7.039 82 HA2 GLY 10 2HA GLY 10 -15.085 -3.460 -8.629 83 HA3 GLY 10 1HA GLY 10 -13.492 -3.106 -9.220 84 H ASP 11 H ASP 11 -13.368 -5.438 -9.551 85 HA ASP 11 HA ASP 11 -12.380 -6.859 -7.275 86 HB2 ASP 11 2HB ASP 11 -14.821 -7.260 -7.065 87 HB3 ASP 11 1HB ASP 11 -14.836 -7.908 -8.702 88 H ASP 12 H ASP 12 -11.179 -8.615 -7.867 89 HA ASP 12 HA ASP 12 -9.958 -8.439 -10.433 90 HB2 ASP 12 2HB ASP 12 -8.592 -10.353 -9.701 91 HB3 ASP 12 1HB ASP 12 -8.652 -9.069 -8.499 92 H GLY 13 H GLY 13 -12.730 -10.160 -9.406 93 HA2 GLY 13 2HA GLY 13 -12.488 -12.287 -11.329 94 HA3 GLY 13 1HA GLY 13 -13.885 -11.904 -10.331 95 H ASN 14 H ASN 14 -13.141 -9.062 -11.528 96 HA ASN 14 HA ASN 14 -15.235 -9.074 -13.474 97 HB2 ASN 14 2HB ASN 14 -13.345 -6.950 -12.525 98 HB3 ASN 14 1HB ASN 14 -14.463 -6.653 -13.841 99 HD21 ASN 14 1HD2 ASN 14 -14.332 -5.342 -11.289 100 HD22 ASN 14 2HD2 ASN 14 -15.843 -5.638 -10.491 101 H ASP 15 H ASP 15 -14.716 -7.630 -15.498 102 HA ASP 15 HA ASP 15 -12.895 -9.205 -17.128 103 HB2 ASP 15 2HB ASP 15 -15.174 -8.741 -17.929 104 HB3 ASP 15 1HB ASP 15 -14.851 -7.016 -17.867 105 H GLY 16 H GLY 16 -12.772 -6.316 -15.397 106 HA2 GLY 16 2HA GLY 16 -11.023 -4.846 -15.173 107 HA3 GLY 16 1HA GLY 16 -10.259 -5.594 -16.568 108 H SER 17 H SER 17 -13.441 -4.670 -17.014 109 HA SER 17 HA SER 17 -12.856 -2.596 -18.897 110 HB2 SER 17 2HB SER 17 -14.820 -4.077 -19.137 111 HB3 SER 17 1HB SER 17 -15.460 -3.501 -17.604 112 HG SER 17 HG SER 17 -16.480 -2.482 -19.281 113 H GLU 18 H GLU 18 -13.957 -0.329 -18.549 114 HA GLU 18 HA GLU 18 -12.958 0.709 -16.170 115 HB2 GLU 18 2HB GLU 18 -13.096 2.021 -18.235 116 HB3 GLU 18 1HB GLU 18 -14.852 1.942 -18.183 117 HG2 GLU 18 2HG GLU 18 -14.867 3.233 -16.135 118 HG3 GLU 18 1HG GLU 18 -13.097 3.184 -16.160 119 H LEU 19 H LEU 19 -16.045 -0.441 -17.231 120 HA LEU 19 HA LEU 19 -17.531 0.542 -14.976 121 HB2 LEU 19 2HB LEU 19 -18.265 -1.436 -17.076 122 HB3 LEU 19 1HB LEU 19 -19.360 -0.749 -15.893 123 HG LEU 19 HG LEU 19 -17.993 0.670 -18.164 124 HD11 LEU 19 1HD1 LEU 19 -20.778 0.155 -17.385 125 HD12 LEU 19 2HD1 LEU 19 -19.931 -0.606 -18.732 126 HD13 LEU 19 3HD1 LEU 19 -20.303 1.142 -18.794 127 HD21 LEU 19 3HD2 LEU 19 -17.943 2.161 -16.233 128 HD22 LEU 19 1HD2 LEU 19 -19.657 1.846 -15.936 129 HD23 LEU 19 2HD2 LEU 19 -19.157 2.695 -17.392 130 H LYS 20 H LYS 20 -15.581 -2.151 -15.693 131 HA LYS 20 HA LYS 20 -16.322 -3.525 -13.155 132 HB2 LYS 20 2HB LYS 20 -15.520 -5.018 -15.664 133 HB3 LYS 20 1HB LYS 20 -16.017 -5.639 -14.123 134 HG2 LYS 20 2HG LYS 20 -18.297 -4.877 -14.433 135 HG3 LYS 20 1HG LYS 20 -17.862 -4.229 -16.013 136 HD2 LYS 20 2HD LYS 20 -17.287 -6.411 -16.827 137 HD3 LYS 20 1HD LYS 20 -17.519 -7.116 -15.234 138 HE2 LYS 20 2HE LYS 20 -19.675 -5.854 -16.942 139 HE3 LYS 20 1HE LYS 20 -19.417 -7.576 -16.710 140 HZ1 LYS 20 3HZ LYS 20 -21.171 -6.822 -15.264 141 HZ2 LYS 20 1HZ LYS 20 -20.173 -5.646 -14.569 142 HZ3 LYS 20 2HZ LYS 20 -19.854 -7.284 -14.349 143 HA PRO 21 HA PRO 21 -11.908 -2.624 -13.677 144 HB2 PRO 21 2HB PRO 21 -11.525 -1.402 -11.290 145 HB3 PRO 21 1HB PRO 21 -12.039 -0.535 -12.738 146 HG2 PRO 21 2HG PRO 21 -13.656 -1.429 -10.395 147 HG3 PRO 21 1HG PRO 21 -13.811 0.034 -11.379 148 HD2 PRO 21 2HD PRO 21 -15.392 -2.202 -11.622 149 HD3 PRO 21 1HD PRO 21 -15.131 -1.005 -12.903 150 H LEU 22 H LEU 22 -10.245 -3.754 -12.803 151 HA LEU 22 HA LEU 22 -10.941 -6.044 -11.197 152 HB2 LEU 22 2HB LEU 22 -8.258 -5.073 -12.155 153 HB3 LEU 22 1HB LEU 22 -8.578 -6.632 -11.421 154 HG LEU 22 HG LEU 22 -9.639 -5.674 -14.066 155 HD11 LEU 22 1HD1 LEU 22 -8.199 -7.392 -14.981 156 HD12 LEU 22 2HD1 LEU 22 -7.572 -7.716 -13.369 157 HD13 LEU 22 3HD1 LEU 22 -7.292 -6.148 -14.119 158 HD21 LEU 22 3HD2 LEU 22 -9.954 -8.320 -12.666 159 HD22 LEU 22 1HD2 LEU 22 -10.457 -7.973 -14.321 160 HD23 LEU 22 2HD2 LEU 22 -11.230 -7.149 -12.968 161 H ARG 23 H ARG 23 -9.565 -6.553 -9.262 162 HA ARG 23 HA ARG 23 -9.219 -4.041 -7.859 163 HB2 ARG 23 2HB ARG 23 -9.953 -5.050 -5.803 164 HB3 ARG 23 1HB ARG 23 -11.075 -5.413 -7.063 165 HG2 ARG 23 2HG ARG 23 -10.957 -7.313 -5.887 166 HG3 ARG 23 1HG ARG 23 -9.854 -7.656 -7.224 167 HD2 ARG 23 2HD ARG 23 -7.989 -6.929 -5.702 168 HD3 ARG 23 1HD ARG 23 -9.171 -6.858 -4.414 169 HE ARG 23 HE ARG 23 -9.238 -9.380 -5.717 170 HH11 ARG 23 1HH1 ARG 23 -7.501 -7.487 -3.253 171 HH12 ARG 23 2HH1 ARG 23 -6.909 -8.844 -2.434 172 HH21 ARG 23 1HH2 ARG 23 -8.374 -11.256 -4.602 173 HH22 ARG 23 2HH2 ARG 23 -7.423 -11.031 -3.214 174 H THR 24 H THR 24 -7.469 -6.500 -9.190 175 HA THR 24 HA THR 24 -5.173 -5.795 -7.567 176 HB THR 24 HB THR 24 -4.258 -8.107 -8.139 177 HG1 THR 24 1HG THR 24 -5.948 -9.714 -8.397 178 HG21 THR 24 3HG2 THR 24 -5.295 -9.213 -6.233 179 HG22 THR 24 1HG2 THR 24 -6.634 -8.093 -6.285 180 HG23 THR 24 2HG2 THR 24 -5.021 -7.512 -5.846 181 H LEU 25 H LEU 25 -3.275 -5.535 -8.710 182 HA LEU 25 HA LEU 25 -3.551 -5.029 -11.518 183 HB2 LEU 25 2HB LEU 25 -2.138 -3.637 -10.041 184 HB3 LEU 25 1HB LEU 25 -1.105 -5.015 -9.744 185 HG LEU 25 HG LEU 25 -0.368 -5.006 -12.067 186 HD11 LEU 25 1HD1 LEU 25 -2.408 -4.136 -13.136 187 HD12 LEU 25 2HD1 LEU 25 -1.009 -3.164 -13.580 188 HD13 LEU 25 3HD1 LEU 25 -2.147 -2.568 -12.384 189 HD21 LEU 25 3HD2 LEU 25 0.842 -2.865 -12.017 190 HD22 LEU 25 1HD2 LEU 25 0.852 -3.686 -10.447 191 HD23 LEU 25 2HD2 LEU 25 -0.233 -2.325 -10.730 192 H TYR 26 H TYR 26 -2.587 -7.610 -9.511 193 HA TYR 26 HA TYR 26 -1.084 -9.240 -11.157 194 HB2 TYR 26 2HB TYR 26 -1.512 -9.745 -8.811 195 HB3 TYR 26 1HB TYR 26 -3.214 -10.019 -9.164 196 HD1 TYR 26 1HD TYR 26 0.169 -11.266 -9.785 197 HD2 TYR 26 2HD TYR 26 -3.959 -12.161 -9.931 198 HE1 TYR 26 1HE TYR 26 0.717 -13.563 -10.242 199 HE2 TYR 26 2HE TYR 26 -3.446 -14.505 -10.378 200 HH TYR 26 HH TYR 26 -1.572 -15.820 -11.366 201 H GLN 27 H GLN 27 -4.676 -9.136 -10.877 202 HA GLN 27 HA GLN 27 -5.100 -11.081 -12.866 203 HB2 GLN 27 2HB GLN 27 -6.883 -10.558 -11.316 204 HB3 GLN 27 1HB GLN 27 -6.954 -8.895 -11.858 205 HG2 GLN 27 2HG GLN 27 -8.840 -10.164 -12.749 206 HG3 GLN 27 1HG GLN 27 -7.814 -9.648 -14.052 207 HE21 GLN 27 1HE2 GLN 27 -8.521 -11.195 -15.419 208 HE22 GLN 27 2HE2 GLN 27 -8.133 -12.849 -15.323 209 H ALA 28 H ALA 28 -4.678 -7.607 -13.055 210 HA ALA 28 HA ALA 28 -5.331 -7.201 -15.717 211 HB1 ALA 28 1HB ALA 28 -4.905 -5.423 -14.031 212 HB2 ALA 28 2HB ALA 28 -3.994 -5.177 -15.521 213 HB3 ALA 28 3HB ALA 28 -3.195 -5.823 -14.087 214 H MET 29 H MET 29 -2.310 -8.245 -14.192 215 HA MET 29 HA MET 29 -0.820 -8.417 -16.539 216 HB2 MET 29 2HB MET 29 -0.520 -9.543 -13.802 217 HB3 MET 29 1HB MET 29 0.552 -10.048 -15.093 218 HG2 MET 29 2HG MET 29 0.153 -7.167 -14.256 219 HG3 MET 29 1HG MET 29 1.518 -8.158 -13.733 220 HE1 MET 29 3HE MET 29 3.126 -6.534 -14.385 221 HE2 MET 29 1HE MET 29 1.797 -5.456 -14.786 222 HE3 MET 29 2HE MET 29 3.155 -5.640 -15.895 223 H ILE 30 H ILE 30 -3.029 -10.655 -15.025 224 HA ILE 30 HA ILE 30 -2.203 -12.903 -16.604 225 HB ILE 30 HB ILE 30 -4.910 -12.449 -15.334 226 HG12 ILE 30 2HG1 ILE 30 -2.449 -13.821 -14.192 227 HG13 ILE 30 1HG1 ILE 30 -3.177 -12.322 -13.639 228 HG21 ILE 30 1HG2 ILE 30 -5.105 -14.900 -15.414 229 HG22 ILE 30 2HG2 ILE 30 -3.540 -14.983 -16.227 230 HG23 ILE 30 3HG2 ILE 30 -4.906 -14.213 -17.035 231 HD11 ILE 30 3HD1 ILE 30 -5.166 -13.509 -12.987 232 HD12 ILE 30 1HD1 ILE 30 -3.719 -14.193 -12.235 233 HD13 ILE 30 2HD1 ILE 30 -4.474 -15.010 -13.605 234 H ILE 31 H ILE 31 -4.648 -10.452 -16.961 235 HA ILE 31 HA ILE 31 -5.836 -11.596 -19.233 236 HB ILE 31 HB ILE 31 -5.940 -8.707 -18.328 237 HG12 ILE 31 2HG1 ILE 31 -7.738 -11.058 -17.713 238 HG13 ILE 31 1HG1 ILE 31 -6.662 -10.256 -16.577 239 HG21 ILE 31 1HG2 ILE 31 -6.658 -9.135 -20.647 240 HG22 ILE 31 2HG2 ILE 31 -8.032 -8.699 -19.588 241 HG23 ILE 31 3HG2 ILE 31 -7.737 -10.393 -19.994 242 HD11 ILE 31 3HD1 ILE 31 -7.953 -8.197 -16.849 243 HD12 ILE 31 1HD1 ILE 31 -8.948 -9.540 -16.250 244 HD13 ILE 31 2HD1 ILE 31 -9.029 -9.063 -17.949 245 H THR 32 H THR 32 -3.313 -9.108 -18.788 246 HA THR 32 HA THR 32 -3.208 -8.628 -21.618 247 HB THR 32 HB THR 32 -1.432 -7.007 -21.013 248 HG1 THR 32 1HG THR 32 -1.964 -7.489 -18.291 249 HG21 THR 32 3HG2 THR 32 -3.895 -6.789 -19.218 250 HG22 THR 32 1HG2 THR 32 -3.822 -6.290 -20.903 251 HG23 THR 32 2HG2 THR 32 -2.845 -5.466 -19.698 252 H LYS 33 H LYS 33 -1.251 -10.176 -19.065 253 HA LYS 33 HA LYS 33 0.423 -11.539 -18.978 254 HB2 LYS 33 2HB LYS 33 -1.132 -12.826 -20.513 255 HB3 LYS 33 1HB LYS 33 -0.153 -12.245 -21.856 256 HG2 LYS 33 2HG LYS 33 1.818 -13.249 -20.728 257 HG3 LYS 33 1HG LYS 33 0.695 -13.976 -19.582 258 HD2 LYS 33 2HD LYS 33 0.694 -14.431 -22.566 259 HD3 LYS 33 1HD LYS 33 1.311 -15.566 -21.367 260 HE2 LYS 33 2HE LYS 33 -0.958 -15.739 -20.415 261 HE3 LYS 33 1HE LYS 33 -1.541 -14.618 -21.644 262 HZ1 LYS 33 3HZ LYS 33 -0.343 -17.276 -22.147 263 HZ2 LYS 33 1HZ LYS 33 -0.845 -16.210 -23.349 264 HZ3 LYS 33 2HZ LYS 33 -1.963 -16.895 -22.292 265 H SER 34 H SER 34 0.732 -8.792 -20.172 266 HA SER 34 HA SER 34 3.173 -9.353 -21.786 267 HB2 SER 34 2HB SER 34 1.306 -8.553 -23.166 268 HB3 SER 34 1HB SER 34 1.234 -7.080 -22.210 269 HG SER 34 HG SER 34 2.572 -7.472 -24.342 270 H SER 35 H SER 35 1.916 -7.540 -19.142 271 HA SER 35 HA SER 35 2.793 -6.123 -17.653 272 HB2 SER 35 2HB SER 35 5.464 -7.138 -18.663 273 HB3 SER 35 1HB SER 35 5.177 -6.324 -17.121 274 HG SER 35 HG SER 35 3.554 -8.139 -16.868 275 H LYS 36 H LYS 36 2.894 -5.415 -20.726 276 HA LYS 36 HA LYS 36 4.178 -2.785 -20.420 277 HB2 LYS 36 2HB LYS 36 4.412 -4.702 -22.738 278 HB3 LYS 36 1HB LYS 36 4.783 -2.996 -22.886 279 HG2 LYS 36 2HG LYS 36 6.140 -4.844 -20.936 280 HG3 LYS 36 1HG LYS 36 6.768 -4.484 -22.542 281 HD2 LYS 36 2HD LYS 36 6.815 -2.072 -21.942 282 HD3 LYS 36 1HD LYS 36 6.270 -2.492 -20.320 283 HE2 LYS 36 2HE LYS 36 8.293 -3.788 -19.951 284 HE3 LYS 36 1HE LYS 36 8.821 -3.470 -21.602 285 HZ1 LYS 36 3HZ LYS 36 8.438 -1.392 -19.499 286 HZ2 LYS 36 1HZ LYS 36 8.999 -1.120 -21.071 287 HZ3 LYS 36 2HZ LYS 36 9.913 -2.029 -20.006 288 H GLY 37 H GLY 37 1.370 -4.124 -20.565 289 HA2 GLY 37 2HA GLY 37 0.176 -2.689 -22.775 290 HA3 GLY 37 1HA GLY 37 -0.674 -3.662 -21.573 291 H ASP 38 H ASP 38 -2.046 -1.607 -21.880 292 HA ASP 38 HA ASP 38 -1.022 0.528 -20.178 293 HB2 ASP 38 2HB ASP 38 -2.056 1.104 -22.381 294 HB3 ASP 38 1HB ASP 38 -3.563 0.406 -21.811 295 H PHE 39 H PHE 39 -1.347 0.310 -18.122 296 HA PHE 39 HA PHE 39 -3.700 -1.127 -17.141 297 HB2 PHE 39 2HB PHE 39 -1.000 -0.700 -15.841 298 HB3 PHE 39 1HB PHE 39 -2.344 -1.604 -15.163 299 HD1 PHE 39 1HD PHE 39 -3.021 -3.705 -16.231 300 HD2 PHE 39 2HD PHE 39 0.518 -1.685 -17.347 301 HE1 PHE 39 1HE PHE 39 -2.165 -5.777 -17.264 302 HE2 PHE 39 2HE PHE 39 1.388 -3.726 -18.381 303 HZ PHE 39 HZ PHE 39 0.044 -5.784 -18.338 304 H LEU 40 H LEU 40 -5.097 0.215 -16.234 305 HA LEU 40 HA LEU 40 -4.014 2.739 -15.191 306 HB2 LEU 40 2HB LEU 40 -6.784 2.393 -16.378 307 HB3 LEU 40 1HB LEU 40 -5.997 3.797 -15.709 308 HG LEU 40 HG LEU 40 -5.008 2.430 -18.202 309 HD11 LEU 40 1HD1 LEU 40 -6.706 4.905 -17.912 310 HD12 LEU 40 2HD1 LEU 40 -7.227 3.358 -18.578 311 HD13 LEU 40 3HD1 LEU 40 -5.993 4.305 -19.412 312 HD21 LEU 40 3HD2 LEU 40 -3.300 3.676 -17.008 313 HD22 LEU 40 1HD2 LEU 40 -4.344 5.101 -16.942 314 HD23 LEU 40 2HD2 LEU 40 -3.744 4.502 -18.491 315 H ILE 41 H ILE 41 -4.271 3.038 -13.142 316 HA ILE 41 HA ILE 41 -6.339 1.510 -11.732 317 HB ILE 41 HB ILE 41 -3.680 2.503 -10.639 318 HG12 ILE 41 2HG1 ILE 41 -4.536 -0.230 -11.665 319 HG13 ILE 41 1HG1 ILE 41 -3.263 0.808 -12.226 320 HG21 ILE 41 1HG2 ILE 41 -5.803 0.712 -9.454 321 HG22 ILE 41 2HG2 ILE 41 -5.461 2.367 -8.982 322 HG23 ILE 41 3HG2 ILE 41 -4.256 1.105 -8.679 323 HD11 ILE 41 3HD1 ILE 41 -1.886 0.288 -10.380 324 HD12 ILE 41 1HD1 ILE 41 -2.647 -1.201 -10.988 325 HD13 ILE 41 2HD1 ILE 41 -3.272 -0.473 -9.529 326 H ARG 42 H ARG 42 -7.800 2.712 -10.556 327 HA ARG 42 HA ARG 42 -7.913 5.409 -11.089 328 HB2 ARG 42 2HB ARG 42 -9.766 3.783 -10.655 329 HB3 ARG 42 1HB ARG 42 -9.418 4.003 -8.940 330 HG2 ARG 42 2HG ARG 42 -9.933 6.264 -9.013 331 HG3 ARG 42 1HG ARG 42 -9.929 6.290 -10.780 332 HD2 ARG 42 2HD ARG 42 -12.115 6.266 -10.262 333 HD3 ARG 42 1HD ARG 42 -11.722 4.622 -10.658 334 HE ARG 42 HE ARG 42 -11.479 4.700 -7.912 335 HH11 ARG 42 1HH1 ARG 42 -14.140 5.287 -10.214 336 HH12 ARG 42 2HH1 ARG 42 -15.346 4.936 -9.089 337 HH21 ARG 42 1HH2 ARG 42 -13.089 4.220 -6.438 338 HH22 ARG 42 2HH2 ARG 42 -14.754 4.293 -6.835 339 H THR 43 H THR 43 -7.139 7.064 -10.157 340 HA THR 43 HA THR 43 -5.969 6.884 -7.477 341 HB THR 43 HB THR 43 -4.327 7.057 -9.440 342 HG1 THR 43 1HG THR 43 -3.055 8.430 -8.435 343 HG21 THR 43 3HG2 THR 43 -5.599 9.771 -9.686 344 HG22 THR 43 1HG2 THR 43 -5.594 8.501 -10.900 345 HG23 THR 43 2HG2 THR 43 -4.087 9.328 -10.462 346 H LYS 44 H LYS 44 -6.206 8.853 -6.267 347 HA LYS 44 HA LYS 44 -8.346 10.540 -7.321 348 HB2 LYS 44 2HB LYS 44 -7.564 10.066 -4.436 349 HB3 LYS 44 1HB LYS 44 -8.738 11.259 -4.951 350 HG2 LYS 44 2HG LYS 44 -9.939 9.373 -4.133 351 HG3 LYS 44 1HG LYS 44 -10.107 9.380 -5.882 352 HD2 LYS 44 2HD LYS 44 -8.353 7.683 -6.060 353 HD3 LYS 44 1HD LYS 44 -8.173 7.684 -4.309 354 HE2 LYS 44 2HE LYS 44 -10.665 6.931 -5.828 355 HE3 LYS 44 1HE LYS 44 -9.533 5.806 -5.086 356 HZ1 LYS 44 3HZ LYS 44 -11.381 6.081 -3.672 357 HZ2 LYS 44 1HZ LYS 44 -11.261 7.773 -3.650 358 HZ3 LYS 44 2HZ LYS 44 -10.070 6.834 -2.928 359 H LYS 45 H LYS 45 -7.810 12.377 -7.967 360 HA LYS 45 HA LYS 45 -5.446 13.704 -6.844 361 HB2 LYS 45 2HB LYS 45 -6.571 13.731 -9.625 362 HB3 LYS 45 1HB LYS 45 -5.313 14.834 -9.208 363 HG2 LYS 45 2HG LYS 45 -3.912 12.812 -8.639 364 HG3 LYS 45 1HG LYS 45 -5.204 11.851 -9.366 365 HD2 LYS 45 2HD LYS 45 -3.644 12.250 -11.142 366 HD3 LYS 45 1HD LYS 45 -5.039 13.345 -11.312 367 HE2 LYS 45 2HE LYS 45 -2.926 14.494 -11.771 368 HE3 LYS 45 1HE LYS 45 -3.800 15.204 -10.429 369 HZ1 LYS 45 3HZ LYS 45 -2.291 14.042 -8.896 370 HZ2 LYS 45 1HZ LYS 45 -1.434 15.007 -9.984 371 HZ3 LYS 45 2HZ LYS 45 -1.481 13.353 -10.209 372 H ASP 46 H ASP 46 -6.208 15.167 -5.502 373 HA ASP 46 HA ASP 46 -7.339 16.864 -4.601 374 HB2 ASP 46 2HB ASP 46 -7.780 17.585 -7.494 375 HB3 ASP 46 1HB ASP 46 -8.308 18.611 -6.162 376 H GLY 47 H GLY 47 -8.692 14.423 -4.859 377 HA2 GLY 47 2HA GLY 47 -10.754 13.801 -3.983 378 HA3 GLY 47 1HA GLY 47 -11.363 15.410 -4.324 379 H LYS 48 H LYS 48 -9.843 14.371 -7.054 380 HA LYS 48 HA LYS 48 -12.381 13.432 -8.174 381 HB2 LYS 48 2HB LYS 48 -9.925 14.483 -9.578 382 HB3 LYS 48 1HB LYS 48 -11.423 14.008 -10.349 383 HG2 LYS 48 2HG LYS 48 -11.060 16.302 -8.442 384 HG3 LYS 48 1HG LYS 48 -11.216 16.423 -10.194 385 HD2 LYS 48 2HD LYS 48 -13.470 15.426 -10.017 386 HD3 LYS 48 1HD LYS 48 -13.290 15.395 -8.262 387 HE2 LYS 48 2HE LYS 48 -13.241 17.845 -10.014 388 HE3 LYS 48 1HE LYS 48 -14.571 17.331 -8.975 389 HZ1 LYS 48 3HZ LYS 48 -13.299 19.042 -7.913 390 HZ2 LYS 48 1HZ LYS 48 -11.861 18.177 -8.077 391 HZ3 LYS 48 2HZ LYS 48 -13.093 17.616 -7.057 392 H GLN 49 H GLN 49 -12.471 11.403 -8.928 393 HA GLN 49 HA GLN 49 -10.001 9.962 -8.842 394 HB2 GLN 49 2HB GLN 49 -11.455 7.883 -9.227 395 HB3 GLN 49 1HB GLN 49 -11.466 8.585 -7.648 396 HG2 GLN 49 2HG GLN 49 -13.681 7.908 -8.186 397 HG3 GLN 49 1HG GLN 49 -13.650 9.662 -8.251 398 HE21 GLN 49 1HE2 GLN 49 -14.097 10.657 -10.184 399 HE22 GLN 49 2HE2 GLN 49 -14.627 9.812 -11.585 400 H VAL 50 H VAL 50 -8.833 9.462 -10.388 401 HA VAL 50 HA VAL 50 -9.969 9.398 -13.083 402 HB VAL 50 HB VAL 50 -8.002 10.593 -13.994 403 HG11 VAL 50 1HG1 VAL 50 -8.475 12.859 -13.184 404 HG12 VAL 50 2HG1 VAL 50 -9.383 12.181 -11.840 405 HG13 VAL 50 3HG1 VAL 50 -9.958 11.951 -13.494 406 HG21 VAL 50 3HG2 VAL 50 -6.435 11.775 -12.517 407 HG22 VAL 50 1HG2 VAL 50 -6.359 10.029 -12.287 408 HG23 VAL 50 2HG2 VAL 50 -7.209 11.038 -11.117 409 H TRP 51 H TRP 51 -8.218 8.414 -14.596 410 HA TRP 51 HA TRP 51 -7.296 6.057 -13.210 411 HB2 TRP 51 2HB TRP 51 -7.654 6.682 -16.134 412 HB3 TRP 51 1HB TRP 51 -7.063 5.168 -15.579 413 HD1 TRP 51 HD TRP 51 -10.013 6.807 -16.512 414 HE1 TRP 51 1HE TRP 51 -12.143 5.455 -15.834 415 HE3 TRP 51 3HE TRP 51 -7.865 3.635 -13.250 416 HZ2 TRP 51 2HZ TRP 51 -12.764 3.313 -14.097 417 HZ3 TRP 51 3HZ TRP 51 -9.257 1.942 -12.107 418 HH2 TRP 51 HH TRP 51 -11.652 1.795 -12.520 419 H GLU 52 H GLU 52 -5.259 5.688 -12.794 420 HA GLU 52 HA GLU 52 -3.197 7.459 -13.907 421 HB2 GLU 52 2HB GLU 52 -3.673 7.652 -11.498 422 HB3 GLU 52 1HB GLU 52 -3.363 5.942 -11.306 423 HG2 GLU 52 2HG GLU 52 -1.031 6.326 -11.992 424 HG3 GLU 52 1HG GLU 52 -1.369 8.060 -12.078 425 H ALA 53 H ALA 53 -1.607 6.415 -14.986 426 HA ALA 53 HA ALA 53 -1.832 3.653 -15.562 427 HB1 ALA 53 1HB ALA 53 0.475 5.528 -16.073 428 HB2 ALA 53 2HB ALA 53 -0.887 5.259 -17.160 429 HB3 ALA 53 3HB ALA 53 0.242 3.945 -16.816 430 H ALA 54 H ALA 54 -0.550 1.986 -14.946 431 HA ALA 54 HA ALA 54 0.428 2.006 -12.302 432 HB1 ALA 54 1HB ALA 54 0.909 -0.011 -14.483 433 HB2 ALA 54 2HB ALA 54 -0.467 -0.002 -13.381 434 HB3 ALA 54 3HB ALA 54 1.164 -0.279 -12.760 435 H SER 55 H SER 55 2.792 0.857 -12.046 436 HA SER 55 HA SER 55 4.624 2.627 -13.446 437 HB2 SER 55 2HB SER 55 4.213 3.497 -11.185 438 HB3 SER 55 1HB SER 55 4.628 1.926 -10.498 439 HG SER 55 HG SER 55 6.220 3.934 -11.062 440 H LYS 56 H LYS 56 6.768 1.768 -13.511 441 HA LYS 56 HA LYS 56 6.891 -0.850 -14.372 442 HB2 LYS 56 2HB LYS 56 9.333 -0.682 -14.404 443 HB3 LYS 56 1HB LYS 56 8.615 0.789 -15.009 444 HG2 LYS 56 2HG LYS 56 9.783 0.446 -12.232 445 HG3 LYS 56 1HG LYS 56 10.634 1.153 -13.598 446 HD2 LYS 56 2HD LYS 56 8.977 2.967 -13.680 447 HD3 LYS 56 1HD LYS 56 8.111 2.238 -12.326 448 HE2 LYS 56 2HE LYS 56 10.100 2.534 -10.916 449 HE3 LYS 56 1HE LYS 56 10.947 3.271 -12.272 450 HZ1 LYS 56 3HZ LYS 56 10.071 4.951 -10.786 451 HZ2 LYS 56 1HZ LYS 56 8.503 4.369 -10.962 452 HZ3 LYS 56 2HZ LYS 56 9.277 5.051 -12.270 453 H THR 57 H THR 57 7.750 0.403 -11.172 454 HA THR 57 HA THR 57 8.737 -1.967 -10.092 455 HB THR 57 HB THR 57 7.306 0.271 -8.645 456 HG1 THR 57 1HG THR 57 9.333 1.290 -8.662 457 HG21 THR 57 3HG2 THR 57 9.565 -1.575 -7.819 458 HG22 THR 57 1HG2 THR 57 7.893 -1.693 -7.263 459 HG23 THR 57 2HG2 THR 57 8.872 -0.291 -6.829 460 H ALA 58 H ALA 58 5.489 -0.581 -10.185 461 HA ALA 58 HA ALA 58 4.239 -2.524 -8.536 462 HB1 ALA 58 1HB ALA 58 3.014 -0.685 -10.590 463 HB2 ALA 58 2HB ALA 58 3.293 -0.285 -8.898 464 HB3 ALA 58 3HB ALA 58 2.142 -1.550 -9.327 465 H LEU 59 H LEU 59 4.724 -2.203 -11.997 466 HA LEU 59 HA LEU 59 3.105 -4.406 -12.690 467 HB2 LEU 59 2HB LEU 59 5.356 -3.089 -14.204 468 HB3 LEU 59 1HB LEU 59 4.154 -4.314 -14.774 469 HG LEU 59 HG LEU 59 3.433 -1.535 -13.826 470 HD11 LEU 59 1HD1 LEU 59 4.889 -1.350 -15.775 471 HD12 LEU 59 2HD1 LEU 59 3.222 -0.940 -16.190 472 HD13 LEU 59 3HD1 LEU 59 3.886 -2.509 -16.648 473 HD21 LEU 59 3HD2 LEU 59 1.350 -1.999 -14.984 474 HD22 LEU 59 1HD2 LEU 59 1.668 -3.279 -13.803 475 HD23 LEU 59 2HD2 LEU 59 1.984 -3.550 -15.514 476 H LYS 60 H LYS 60 6.531 -3.998 -11.923 477 HA LYS 60 HA LYS 60 7.240 -6.657 -12.568 478 HB2 LYS 60 2HB LYS 60 8.572 -4.784 -10.596 479 HB3 LYS 60 1HB LYS 60 9.262 -6.281 -11.186 480 HG2 LYS 60 2HG LYS 60 8.673 -3.806 -12.812 481 HG3 LYS 60 1HG LYS 60 10.259 -4.379 -12.312 482 HD2 LYS 60 2HD LYS 60 8.364 -5.801 -14.184 483 HD3 LYS 60 1HD LYS 60 9.791 -4.891 -14.664 484 HE2 LYS 60 2HE LYS 60 11.201 -6.458 -13.396 485 HE3 LYS 60 1HE LYS 60 9.762 -7.370 -12.941 486 HZ1 LYS 60 3HZ LYS 60 9.380 -7.842 -15.288 487 HZ2 LYS 60 1HZ LYS 60 10.898 -8.384 -14.794 488 HZ3 LYS 60 2HZ LYS 60 10.781 -6.984 -15.699 489 H LYS 61 H LYS 61 5.952 -5.138 -9.651 490 HA LYS 61 HA LYS 61 6.305 -7.333 -7.953 491 HB2 LYS 61 2HB LYS 61 6.004 -5.076 -7.110 492 HB3 LYS 61 1HB LYS 61 4.467 -4.924 -7.916 493 HG2 LYS 61 2HG LYS 61 4.965 -6.845 -5.637 494 HG3 LYS 61 1HG LYS 61 4.400 -5.193 -5.405 495 HD2 LYS 61 2HD LYS 61 2.478 -5.700 -6.853 496 HD3 LYS 61 1HD LYS 61 3.037 -7.361 -6.975 497 HE2 LYS 61 2HE LYS 61 2.192 -5.947 -4.436 498 HE3 LYS 61 1HE LYS 61 1.265 -7.175 -5.297 499 HZ1 LYS 61 3HZ LYS 61 2.400 -8.109 -3.397 500 HZ2 LYS 61 1HZ LYS 61 3.889 -7.590 -3.955 501 HZ3 LYS 61 2HZ LYS 61 3.062 -8.783 -4.782 502 H SER 62 H SER 62 3.566 -6.261 -9.936 503 HA SER 62 HA SER 62 1.842 -8.352 -9.140 504 HB2 SER 62 2HB SER 62 0.533 -7.621 -11.189 505 HB3 SER 62 1HB SER 62 0.841 -6.380 -9.974 506 HG SER 62 HG SER 62 2.221 -5.414 -11.262 507 H TRP 63 H TRP 63 4.120 -8.036 -11.881 508 HA TRP 63 HA TRP 63 3.276 -10.495 -12.986 509 HB2 TRP 63 2HB TRP 63 4.201 -8.692 -14.372 510 HB3 TRP 63 1HB TRP 63 5.747 -8.853 -13.545 511 HD1 TRP 63 HD TRP 63 7.340 -10.590 -14.400 512 HE1 TRP 63 1HE TRP 63 7.277 -12.403 -16.297 513 HE3 TRP 63 3HE TRP 63 2.441 -10.310 -15.550 514 HZ2 TRP 63 2HZ TRP 63 5.328 -13.522 -18.016 515 HZ3 TRP 63 3HZ TRP 63 1.498 -11.799 -17.298 516 HH2 TRP 63 HH TRP 63 2.931 -13.352 -18.509 517 H LYS 64 H LYS 64 5.684 -9.537 -10.645 518 HA LYS 64 HA LYS 64 7.280 -11.833 -10.682 519 HB2 LYS 64 2HB LYS 64 7.830 -9.776 -9.443 520 HB3 LYS 64 1HB LYS 64 6.520 -10.101 -8.324 521 HG2 LYS 64 2HG LYS 64 7.667 -12.096 -7.541 522 HG3 LYS 64 1HG LYS 64 8.975 -11.810 -8.695 523 HD2 LYS 64 2HD LYS 64 9.398 -9.644 -7.661 524 HD3 LYS 64 1HD LYS 64 8.126 -9.957 -6.484 525 HE2 LYS 64 2HE LYS 64 9.384 -11.884 -5.647 526 HE3 LYS 64 1HE LYS 64 10.644 -11.575 -6.844 527 HZ1 LYS 64 3HZ LYS 64 9.844 -9.721 -4.671 528 HZ2 LYS 64 1HZ LYS 64 11.048 -9.421 -5.805 529 HZ3 LYS 64 2HZ LYS 64 11.246 -10.651 -4.687 530 H ARG 65 H ARG 65 4.273 -11.091 -9.092 531 HA ARG 65 HA ARG 65 3.876 -13.424 -7.522 532 HB2 ARG 65 2HB ARG 65 2.518 -11.255 -7.525 533 HB3 ARG 65 1HB ARG 65 1.844 -11.805 -9.022 534 HG2 ARG 65 2HG ARG 65 0.220 -12.244 -7.373 535 HG3 ARG 65 1HG ARG 65 0.926 -13.794 -7.794 536 HD2 ARG 65 2HD ARG 65 1.734 -12.119 -5.471 537 HD3 ARG 65 1HD ARG 65 0.516 -13.394 -5.386 538 HE ARG 65 HE ARG 65 2.513 -14.807 -6.284 539 HH11 ARG 65 1HH1 ARG 65 2.718 -12.232 -3.805 540 HH12 ARG 65 2HH1 ARG 65 4.003 -12.965 -2.990 541 HH21 ARG 65 1HH2 ARG 65 4.262 -15.776 -5.127 542 HH22 ARG 65 2HH2 ARG 65 4.932 -15.026 -3.755 543 H TYR 66 H TYR 66 3.155 -12.579 -10.863 544 HA TYR 66 HA TYR 66 1.735 -14.883 -11.750 545 HB2 TYR 66 2HB TYR 66 1.994 -12.600 -12.862 546 HB3 TYR 66 1HB TYR 66 3.585 -13.139 -13.364 547 HD1 TYR 66 1HD TYR 66 3.636 -15.381 -14.727 548 HD2 TYR 66 2HD TYR 66 0.199 -12.971 -14.183 549 HE1 TYR 66 1HE TYR 66 2.638 -16.383 -16.713 550 HE2 TYR 66 2HE TYR 66 -0.814 -13.931 -16.138 551 HH TYR 66 HH TYR 66 0.405 -16.741 -17.672 552 H GLU 67 H GLU 67 5.176 -13.976 -12.018 553 HA GLU 67 HA GLU 67 6.285 -16.316 -13.141 554 HB2 GLU 67 2HB GLU 67 7.437 -14.540 -10.991 555 HB3 GLU 67 1HB GLU 67 8.344 -15.669 -11.986 556 HG2 GLU 67 2HG GLU 67 6.746 -13.432 -13.013 557 HG3 GLU 67 1HG GLU 67 8.460 -13.248 -12.633 558 H GLN 68 H GLN 68 5.888 -15.469 -9.825 559 HA GLN 68 HA GLN 68 6.817 -17.862 -8.683 560 HB2 GLN 68 2HB GLN 68 4.796 -15.898 -7.621 561 HB3 GLN 68 1HB GLN 68 5.413 -17.223 -6.656 562 HG2 GLN 68 2HG GLN 68 7.049 -14.997 -7.853 563 HG3 GLN 68 1HG GLN 68 6.545 -15.119 -6.168 564 HE21 GLN 68 1HE2 GLN 68 7.514 -16.656 -4.859 565 HE22 GLN 68 2HE2 GLN 68 8.997 -17.423 -5.256 566 H GLU 69 H GLU 69 3.489 -16.971 -9.492 567 HA GLU 69 HA GLU 69 2.329 -19.410 -8.741 568 HB2 GLU 69 2HB GLU 69 1.414 -17.247 -10.604 569 HB3 GLU 69 1HB GLU 69 0.450 -18.678 -10.268 570 HG2 GLU 69 2HG GLU 69 1.449 -16.775 -8.181 571 HG3 GLU 69 1HG GLU 69 -0.151 -16.702 -8.909 572 H MET 70 H MET 70 3.312 -18.274 -11.972 573 HA MET 70 HA MET 70 2.378 -20.649 -13.199 574 HB2 MET 70 2HB MET 70 3.425 -19.946 -15.244 575 HB3 MET 70 1HB MET 70 2.622 -18.577 -14.504 576 HG2 MET 70 2HG MET 70 4.753 -17.710 -13.738 577 HG3 MET 70 1HG MET 70 5.584 -19.126 -14.380 578 HE1 MET 70 3HE MET 70 3.928 -19.529 -17.154 579 HE2 MET 70 1HE MET 70 5.679 -19.701 -16.995 580 HE3 MET 70 2HE MET 70 5.006 -18.660 -18.244 581 H LEU 71 H LEU 71 5.508 -19.779 -11.853 582 HA LEU 71 HA LEU 71 6.823 -22.018 -12.982 583 HB2 LEU 71 2HB LEU 71 8.069 -20.101 -12.392 584 HB3 LEU 71 1HB LEU 71 7.527 -20.113 -10.738 585 HG LEU 71 HG LEU 71 8.773 -22.234 -10.431 586 HD11 LEU 71 1HD1 LEU 71 10.484 -22.843 -12.120 587 HD12 LEU 71 2HD1 LEU 71 9.813 -21.628 -13.205 588 HD13 LEU 71 3HD1 LEU 71 8.838 -23.019 -12.729 589 HD21 LEU 71 3HD2 LEU 71 9.747 -20.128 -9.748 590 HD22 LEU 71 1HD2 LEU 71 10.383 -19.868 -11.372 591 HD23 LEU 71 2HD2 LEU 71 11.006 -21.189 -10.384 592 H LYS 72 H LYS 72 5.074 -21.401 -10.030 593 HA LYS 72 HA LYS 72 5.751 -23.861 -8.745 594 HB2 LYS 72 2HB LYS 72 5.046 -21.924 -7.454 595 HB3 LYS 72 1HB LYS 72 3.515 -21.877 -8.302 596 HG2 LYS 72 2HG LYS 72 2.878 -23.996 -7.257 597 HG3 LYS 72 1HG LYS 72 4.434 -24.039 -6.418 598 HD2 LYS 72 2HD LYS 72 3.917 -22.027 -5.227 599 HD3 LYS 72 1HD LYS 72 2.441 -21.787 -6.148 600 HE2 LYS 72 2HE LYS 72 1.551 -23.878 -5.193 601 HE3 LYS 72 1HE LYS 72 3.019 -24.049 -4.235 602 HZ1 LYS 72 3HZ LYS 72 1.107 -21.794 -4.079 603 HZ2 LYS 72 1HZ LYS 72 2.502 -21.959 -3.145 604 HZ3 LYS 72 2HZ LYS 72 1.213 -23.034 -2.963 605 H ASN 73 H ASN 73 3.403 -22.825 -11.052 606 HA ASN 73 HA ASN 73 1.975 -25.402 -10.915 607 HB2 ASN 73 2HB ASN 73 1.196 -22.793 -12.250 608 HB3 ASN 73 1HB ASN 73 0.243 -24.271 -12.299 609 HD21 ASN 73 1HD2 ASN 73 -0.414 -21.634 -11.263 610 HD22 ASN 73 2HD2 ASN 73 -0.877 -21.852 -9.624 611 H GLU 74 H GLU 74 4.626 -24.655 -12.203 612 HA GLU 74 HA GLU 74 4.106 -24.841 -15.005 613 HB2 GLU 74 2HB GLU 74 5.973 -23.489 -14.287 614 HB3 GLU 74 1HB GLU 74 6.719 -24.861 -13.491 615 HG2 GLU 74 2HG GLU 74 7.862 -24.382 -15.556 616 HG3 GLU 74 1HG GLU 74 7.041 -25.932 -15.681 617 H LYS 75 H LYS 75 3.018 -26.719 -15.112 618 HA LYS 75 HA LYS 75 4.821 -29.015 -15.249 619 HB2 LYS 75 2HB LYS 75 1.789 -28.997 -15.088 620 HB3 LYS 75 1HB LYS 75 2.737 -30.436 -15.419 621 HG2 LYS 75 2HG LYS 75 3.847 -30.171 -13.228 622 HG3 LYS 75 1HG LYS 75 2.806 -28.782 -12.906 623 HD2 LYS 75 2HD LYS 75 0.841 -30.187 -13.026 624 HD3 LYS 75 1HD LYS 75 1.823 -31.573 -13.487 625 HE2 LYS 75 2HE LYS 75 1.244 -31.702 -11.124 626 HE3 LYS 75 1HE LYS 75 2.977 -31.461 -11.327 627 HZ1 LYS 75 3HZ LYS 75 2.641 -29.103 -10.835 628 HZ2 LYS 75 1HZ LYS 75 2.106 -30.083 -9.573 629 HZ3 LYS 75 2HZ LYS 75 0.989 -29.389 -10.588 630 H VAL 76 H VAL 76 2.093 -27.449 -16.867 631 HA VAL 76 HA VAL 76 3.712 -27.470 -19.187 632 HB VAL 76 HB VAL 76 2.516 -29.453 -19.539 633 HG11 VAL 76 1HG1 VAL 76 0.033 -29.549 -19.799 634 HG12 VAL 76 2HG1 VAL 76 -0.042 -27.869 -19.264 635 HG13 VAL 76 3HG1 VAL 76 0.547 -29.117 -18.165 636 HG21 VAL 76 3HG2 VAL 76 1.423 -28.990 -21.721 637 HG22 VAL 76 1HG2 VAL 76 2.980 -28.187 -21.514 638 HG23 VAL 76 2HG2 VAL 76 1.481 -27.271 -21.335 639 H ALA 77 H ALA 77 3.957 -25.475 -18.589 640 HA ALA 77 HA ALA 77 1.846 -23.685 -19.585 641 HB1 ALA 77 1HB ALA 77 3.996 -23.065 -17.540 642 HB2 ALA 77 2HB ALA 77 2.279 -23.276 -17.195 643 HB3 ALA 77 3HB ALA 77 2.819 -21.910 -18.169 644 H ALA 78 H ALA 78 5.345 -23.847 -19.023 645 HA ALA 78 HA ALA 78 7.159 -23.489 -20.327 646 HB1 ALA 78 1HB ALA 78 6.159 -25.319 -21.627 647 HB2 ALA 78 2HB ALA 78 7.063 -24.203 -22.646 648 HB3 ALA 78 3HB ALA 78 5.300 -24.135 -22.614 649 H LYS 79 H LYS 79 5.234 -21.288 -19.823 650 HA LYS 79 HA LYS 79 4.922 -19.121 -20.252 651 HB2 LYS 79 2HB LYS 79 7.421 -19.405 -21.888 652 HB3 LYS 79 1HB LYS 79 6.613 -17.872 -21.574 653 HG2 LYS 79 2HG LYS 79 6.948 -18.129 -19.208 654 HG3 LYS 79 1HG LYS 79 7.652 -19.729 -19.455 655 HD2 LYS 79 2HD LYS 79 9.359 -18.119 -19.110 656 HD3 LYS 79 1HD LYS 79 9.376 -18.755 -20.773 657 HE2 LYS 79 2HE LYS 79 8.277 -16.715 -21.581 658 HE3 LYS 79 1HE LYS 79 8.213 -16.082 -19.936 659 HZ1 LYS 79 3HZ LYS 79 10.047 -15.131 -21.210 660 HZ2 LYS 79 1HZ LYS 79 10.670 -16.667 -21.488 661 HZ3 LYS 79 2HZ LYS 79 10.643 -16.041 -19.928 662 H MET 80 H MET 80 3.023 -19.104 -21.313 663 HA MET 80 HA MET 80 3.003 -19.833 -24.116 664 HB2 MET 80 2HB MET 80 1.297 -20.815 -22.633 665 HB3 MET 80 1HB MET 80 0.666 -19.212 -22.301 666 HG2 MET 80 2HG MET 80 0.032 -18.965 -24.644 667 HG3 MET 80 1HG MET 80 0.694 -20.559 -24.996 668 HE1 MET 80 3HE MET 80 -0.308 -22.836 -24.021 669 HE2 MET 80 1HE MET 80 -1.713 -22.906 -22.961 670 HE3 MET 80 2HE MET 80 -0.209 -22.211 -22.374 671 H LEU 81 H LEU 81 4.360 -17.926 -24.265 672 HA LEU 81 HA LEU 81 3.392 -16.062 -25.990 673 HB2 LEU 81 2HB LEU 81 2.165 -15.069 -24.047 674 HB3 LEU 81 1HB LEU 81 3.682 -14.884 -23.195 675 HG LEU 81 HG LEU 81 4.435 -13.264 -24.919 676 HD11 LEU 81 1HD1 LEU 81 2.826 -12.357 -26.513 677 HD12 LEU 81 2HD1 LEU 81 1.646 -13.575 -26.017 678 HD13 LEU 81 3HD1 LEU 81 3.152 -14.064 -26.804 679 HD21 LEU 81 3HD2 LEU 81 3.359 -12.461 -22.886 680 HD22 LEU 81 1HD2 LEU 81 1.781 -12.597 -23.659 681 HD23 LEU 81 2HD2 LEU 81 2.962 -11.433 -24.264 682 H GLU 82 H GLU 82 5.172 -14.762 -26.725 683 HA GLU 82 HA GLU 82 7.653 -15.320 -25.322 684 HB2 GLU 82 2HB GLU 82 8.833 -15.463 -27.508 685 HB3 GLU 82 1HB GLU 82 7.685 -16.758 -27.255 686 HG2 GLU 82 2HG GLU 82 7.209 -14.328 -28.991 687 HG3 GLU 82 1HG GLU 82 7.732 -15.901 -29.575 688 H LYS 83 H LYS 83 9.066 -13.706 -25.104 689 HA LYS 83 HA LYS 83 8.192 -11.104 -26.091 690 HB2 LYS 83 2HB LYS 83 8.080 -11.231 -23.675 691 HB3 LYS 83 1HB LYS 83 9.708 -11.871 -23.592 692 HG2 LYS 83 2HG LYS 83 9.580 -9.519 -22.895 693 HG3 LYS 83 1HG LYS 83 10.621 -9.757 -24.295 694 HD2 LYS 83 2HD LYS 83 8.914 -8.929 -25.769 695 HD3 LYS 83 1HD LYS 83 7.760 -8.832 -24.438 696 HE2 LYS 83 2HE LYS 83 8.729 -6.643 -25.042 697 HE3 LYS 83 1HE LYS 83 9.064 -7.095 -23.372 698 HZ1 LYS 83 3HZ LYS 83 10.963 -7.340 -25.655 699 HZ2 LYS 83 1HZ LYS 83 11.308 -7.730 -24.049 700 HZ3 LYS 83 2HZ LYS 83 10.989 -6.137 -24.504 701 H ASP 84 H ASP 84 9.394 -10.308 -27.630 702 HA ASP 84 HA ASP 84 11.994 -11.358 -28.265 703 HB2 ASP 84 2HB ASP 84 10.588 -8.908 -29.369 704 HB3 ASP 84 1HB ASP 84 12.044 -9.619 -30.036 705 H ALA 85 H ALA 85 13.895 -10.563 -27.620 706 HA ALA 85 HA ALA 85 13.788 -8.470 -25.634 707 HB1 ALA 85 1HB ALA 85 16.074 -9.106 -25.098 708 HB2 ALA 85 2HB ALA 85 16.114 -10.188 -26.487 709 HB3 ALA 85 3HB ALA 85 15.030 -10.525 -25.138 710 H THR 86 H THR 86 14.185 -6.425 -26.094 711 HA THR 86 HA THR 86 15.234 -5.592 -28.597 712 HB THR 86 HB THR 86 14.795 -4.031 -26.034 713 HG1 THR 86 1HG THR 86 13.117 -4.187 -28.308 714 HG21 THR 86 3HG2 THR 86 16.254 -2.868 -27.641 715 HG22 THR 86 1HG2 THR 86 14.687 -2.068 -27.519 716 HG23 THR 86 2HG2 THR 86 15.053 -3.095 -28.910 717 H GLU 87 H GLU 87 17.360 -5.935 -29.025 718 HA GLU 87 HA GLU 87 19.309 -5.055 -27.058 719 HB2 GLU 87 2HB GLU 87 18.994 -7.434 -26.605 720 HB3 GLU 87 1HB GLU 87 19.292 -7.806 -28.295 721 HG2 GLU 87 2HG GLU 87 21.578 -6.990 -28.074 722 HG3 GLU 87 1HG GLU 87 21.281 -6.606 -26.380 723 H VAL 88 H VAL 88 20.831 -3.919 -28.023 724 HA VAL 88 HA VAL 88 21.269 -4.321 -30.877 725 HB VAL 88 HB VAL 88 22.353 -2.042 -30.874 726 HG11 VAL 88 1HG1 VAL 88 19.502 -2.102 -29.883 727 HG12 VAL 88 2HG1 VAL 88 20.024 -2.268 -31.558 728 HG13 VAL 88 3HG1 VAL 88 20.271 -0.743 -30.704 729 HG21 VAL 88 3HG2 VAL 88 21.266 -1.870 -28.054 730 HG22 VAL 88 1HG2 VAL 88 21.972 -0.533 -28.963 731 HG23 VAL 88 2HG2 VAL 88 22.969 -1.913 -28.509 732 H GLY 89 H GLY 89 23.175 -5.037 -31.557 733 HA2 GLY 89 2HA GLY 89 24.960 -6.010 -29.491 734 HA3 GLY 89 1HA GLY 89 25.006 -6.443 -31.194 735 H VAL 90 H VAL 90 24.967 -3.616 -31.998 736 HA VAL 90 HA VAL 90 27.436 -2.656 -30.919 737 HB VAL 90 HB VAL 90 28.307 -4.095 -32.648 738 HG11 VAL 90 1HG1 VAL 90 27.771 -3.834 -35.015 739 HG12 VAL 90 2HG1 VAL 90 26.531 -2.653 -34.601 740 HG13 VAL 90 3HG1 VAL 90 26.361 -4.329 -34.074 741 HG21 VAL 90 3HG2 VAL 90 29.484 -1.998 -32.340 742 HG22 VAL 90 1HG2 VAL 90 28.407 -1.204 -33.493 743 HG23 VAL 90 2HG2 VAL 90 29.504 -2.458 -34.045 744 H LYS 91 H LYS 91 26.916 -0.766 -30.330 745 HA LYS 91 HA LYS 91 25.787 1.047 -32.338 746 HB2 LYS 91 2HB LYS 91 24.104 0.379 -30.523 747 HB3 LYS 91 1HB LYS 91 25.162 1.164 -29.366 748 HG2 LYS 91 2HG LYS 91 23.775 2.550 -31.678 749 HG3 LYS 91 1HG LYS 91 23.198 2.543 -30.023 750 HD2 LYS 91 2HD LYS 91 25.216 3.744 -29.316 751 HD3 LYS 91 1HD LYS 91 25.825 3.700 -30.968 752 HE2 LYS 91 2HE LYS 91 23.877 5.015 -31.697 753 HE3 LYS 91 1HE LYS 91 23.319 5.074 -30.024 754 HZ1 LYS 91 3HZ LYS 91 24.485 7.098 -30.582 755 HZ2 LYS 91 1HZ LYS 91 25.873 6.235 -31.031 756 HZ3 LYS 91 2HZ LYS 91 25.352 6.238 -29.437 757 H ALA 92 H ALA 92 27.506 0.763 -29.220 758 HA ALA 92 HA ALA 92 28.843 3.253 -29.679 759 HB1 ALA 92 1HB ALA 92 29.306 1.192 -27.520 760 HB2 ALA 92 2HB ALA 92 28.210 2.564 -27.398 761 HB3 ALA 92 3HB ALA 92 29.947 2.837 -27.542 762 H ALA 93 H ALA 93 29.886 2.904 -31.595 763 HA ALA 93 HA ALA 93 32.532 1.867 -31.391 764 HB1 ALA 93 1HB ALA 93 32.349 0.258 -33.251 765 HB2 ALA 93 2HB ALA 93 30.605 0.515 -33.297 766 HB3 ALA 93 3HB ALA 93 31.348 -0.231 -31.882 767 H LEU 94 H LEU 94 33.646 3.434 -32.439 768 HA LEU 94 HA LEU 94 32.503 4.400 -34.908 769 HB2 LEU 94 2HB LEU 94 33.069 6.769 -34.324 770 HB3 LEU 94 1HB LEU 94 31.731 6.079 -33.443 771 HG LEU 94 HG LEU 94 33.329 5.755 -31.496 772 HD11 LEU 94 1HD1 LEU 94 35.442 5.897 -32.660 773 HD12 LEU 94 2HD1 LEU 94 35.327 7.143 -31.411 774 HD13 LEU 94 3HD1 LEU 94 35.103 7.569 -33.106 775 HD21 LEU 94 3HD2 LEU 94 33.176 8.088 -30.787 776 HD22 LEU 94 1HD2 LEU 94 31.683 7.529 -31.540 777 HD23 LEU 94 2HD2 LEU 94 32.789 8.563 -32.442 778 H GLU 95 H GLU 95 33.900 5.281 -36.402 779 HA GLU 95 HA GLU 95 36.670 4.371 -36.074 780 HB2 GLU 95 2HB GLU 95 35.126 4.961 -38.619 781 HB3 GLU 95 1HB GLU 95 36.748 4.324 -38.533 782 HG2 GLU 95 2HG GLU 95 35.269 2.550 -39.159 783 HG3 GLU 95 1HG GLU 95 35.800 2.248 -37.510 784 H GLU 96 H GLU 96 37.838 6.171 -35.430 785 HA GLU 96 HA GLU 96 36.930 8.715 -36.387 786 HB2 GLU 96 2HB GLU 96 38.713 9.731 -35.001 787 HB3 GLU 96 1HB GLU 96 37.617 8.710 -34.090 788 HG2 GLU 96 2HG GLU 96 39.271 6.971 -33.960 789 HG3 GLU 96 1HG GLU 96 40.340 7.856 -35.043 790 H ALA 97 H ALA 97 37.292 9.095 -38.389 791 HA ALA 97 HA ALA 97 39.967 8.648 -39.470 792 HB1 ALA 97 1HB ALA 97 38.961 9.132 -41.658 793 HB2 ALA 97 2HB ALA 97 37.425 9.496 -40.872 794 HB3 ALA 97 3HB ALA 97 38.073 7.855 -40.823 795 H LYS 98 H LYS 98 41.151 10.277 -38.603 796 HA LYS 98 HA LYS 98 40.046 12.952 -38.838 797 HB2 LYS 98 2HB LYS 98 42.303 11.952 -37.110 798 HB3 LYS 98 1HB LYS 98 41.796 13.633 -37.221 799 HG2 LYS 98 2HG LYS 98 39.564 12.986 -36.402 800 HG3 LYS 98 1HG LYS 98 40.143 11.328 -36.220 801 HD2 LYS 98 2HD LYS 98 41.828 12.078 -34.643 802 HD3 LYS 98 1HD LYS 98 41.296 13.748 -34.847 803 HE2 LYS 98 2HE LYS 98 39.079 13.125 -33.982 804 HE3 LYS 98 1HE LYS 98 39.648 11.475 -33.739 805 HZ1 LYS 98 3HZ LYS 98 39.755 12.741 -31.684 806 HZ2 LYS 98 1HZ LYS 98 40.741 13.897 -32.424 807 HZ3 LYS 98 2HZ LYS 98 41.306 12.335 -32.193 808 H LYS 99 H LYS 99 40.691 14.235 -40.244 809 HA LYS 99 HA LYS 99 43.404 14.278 -41.305 810 HB2 LYS 99 2HB LYS 99 42.036 12.844 -42.839 811 HB3 LYS 99 1HB LYS 99 40.871 14.156 -42.942 812 HG2 LYS 99 2HG LYS 99 42.709 15.582 -43.907 813 HG3 LYS 99 1HG LYS 99 43.691 14.123 -44.000 814 HD2 LYS 99 2HD LYS 99 42.604 14.613 -46.140 815 HD3 LYS 99 1HD LYS 99 42.011 13.094 -45.462 816 HE2 LYS 99 2HE LYS 99 40.013 14.168 -44.661 817 HE3 LYS 99 1HE LYS 99 40.619 15.751 -45.139 818 HZ1 LYS 99 3HZ LYS 99 40.065 13.541 -47.036 819 HZ2 LYS 99 1HZ LYS 99 40.453 15.142 -47.404 820 HZ3 LYS 99 2HZ LYS 99 38.967 14.755 -46.675 821 H VAL 100 H VAL 100 43.714 16.445 -42.324 822 HA VAL 100 HA VAL 100 42.269 18.492 -41.054 823 HB VAL 100 HB VAL 100 43.373 20.071 -42.616 824 HG11 VAL 100 1HG1 VAL 100 45.708 19.571 -42.028 825 HG12 VAL 100 2HG1 VAL 100 45.214 17.951 -41.531 826 HG13 VAL 100 3HG1 VAL 100 44.606 19.357 -40.669 827 HG21 VAL 100 3HG2 VAL 100 43.304 18.742 -44.671 828 HG22 VAL 100 1HG2 VAL 100 44.443 17.592 -43.979 829 HG23 VAL 100 2HG2 VAL 100 44.960 19.239 -44.319 830 H GLN 101 H GLN 101 40.451 19.515 -41.586 831 HA GLN 101 HA GLN 101 38.916 18.401 -43.780 832 HB2 GLN 101 2HB GLN 101 37.954 18.593 -41.467 833 HB3 GLN 101 1HB GLN 101 38.089 20.335 -41.594 834 HG2 GLN 101 2HG GLN 101 36.473 20.371 -43.380 835 HG3 GLN 101 1HG GLN 101 36.395 18.611 -43.386 836 HE21 GLN 101 1HE2 GLN 101 35.504 21.504 -41.730 837 HE22 GLN 101 2HE2 GLN 101 34.369 20.765 -40.658 838 H ILE 102 H ILE 102 41.124 20.608 -43.599 839 HA ILE 102 HA ILE 102 39.831 22.329 -45.539 840 HB ILE 102 HB ILE 102 40.219 23.686 -43.593 841 HG12 ILE 102 2HG1 ILE 102 42.339 24.294 -45.675 842 HG13 ILE 102 1HG1 ILE 102 40.648 24.763 -45.763 843 HG21 ILE 102 1HG2 ILE 102 43.084 22.764 -43.638 844 HG22 ILE 102 2HG2 ILE 102 41.863 22.380 -42.423 845 HG23 ILE 102 3HG2 ILE 102 42.440 24.038 -42.602 846 HD11 ILE 102 3HD1 ILE 102 40.952 26.193 -43.799 847 HD12 ILE 102 1HD1 ILE 102 42.059 26.629 -45.101 848 HD13 ILE 102 2HD1 ILE 102 42.645 25.711 -43.715 849 H GLU 103 H GLU 103 40.416 21.433 -47.333 850 HA GLU 103 HA GLU 103 43.272 21.148 -47.901 851 HB2 GLU 103 2HB GLU 103 40.921 19.632 -49.065 852 HB3 GLU 103 1HB GLU 103 42.565 19.505 -49.654 853 HG2 GLU 103 2HG GLU 103 43.264 18.592 -47.487 854 HG3 GLU 103 1HG GLU 103 41.607 18.727 -46.902 855 H LEU 104 H LEU 104 43.813 21.644 -50.119 856 HA LEU 104 HA LEU 104 42.427 24.004 -51.009 857 HB2 LEU 104 2HB LEU 104 44.961 23.723 -50.940 858 HB3 LEU 104 1HB LEU 104 44.811 22.576 -52.242 859 HG LEU 104 HG LEU 104 45.644 24.769 -52.984 860 HD11 LEU 104 1HD1 LEU 104 44.162 25.165 -54.858 861 HD12 LEU 104 2HD1 LEU 104 42.936 24.143 -54.099 862 HD13 LEU 104 3HD1 LEU 104 44.475 23.447 -54.611 863 HD21 LEU 104 3HD2 LEU 104 44.518 26.188 -51.370 864 HD22 LEU 104 1HD2 LEU 104 42.963 25.823 -52.111 865 HD23 LEU 104 2HD2 LEU 104 44.178 26.724 -53.014 866 H ASP 105 H ASP 105 40.559 23.586 -51.977 867 HA ASP 105 HA ASP 105 39.866 21.169 -53.234 868 HB2 ASP 105 2HB ASP 105 38.522 23.860 -53.323 869 HB3 ASP 105 1HB ASP 105 37.852 22.434 -54.095 870 H THR 106 H THR 106 40.622 24.300 -54.580 871 HA THR 106 HA THR 106 40.861 25.149 -56.583 872 HB THR 106 HB THR 106 43.041 24.013 -56.412 873 HG1 THR 106 1HG THR 106 42.077 25.123 -58.504 874 HG21 THR 106 3HG2 THR 106 42.367 21.650 -56.478 875 HG22 THR 106 1HG2 THR 106 43.543 21.986 -57.750 876 HG23 THR 106 2HG2 THR 106 41.829 21.842 -58.147 877 H SER 107 H SER 107 38.545 23.291 -56.177 878 HA SER 107 HA SER 107 37.768 22.252 -58.705 879 HB2 SER 107 2HB SER 107 36.034 23.087 -56.369 880 HB3 SER 107 1HB SER 107 35.622 21.927 -57.635 881 HG SER 107 HG SER 107 37.694 20.867 -56.781 882 H LEU 108 H LEU 108 37.241 25.230 -56.906 883 HA LEU 108 HA LEU 108 36.596 26.470 -59.373 884 HB2 LEU 108 2HB LEU 108 34.867 27.980 -58.156 885 HB3 LEU 108 1HB LEU 108 34.400 26.376 -58.651 886 HG LEU 108 HG LEU 108 34.701 25.615 -56.317 887 HD11 LEU 108 1HD1 LEU 108 36.201 27.319 -55.449 888 HD12 LEU 108 2HD1 LEU 108 34.725 27.240 -54.489 889 HD13 LEU 108 3HD1 LEU 108 34.950 28.543 -55.658 890 HD21 LEU 108 3HD2 LEU 108 32.514 26.109 -57.175 891 HD22 LEU 108 1HD2 LEU 108 32.706 27.816 -56.776 892 HD23 LEU 108 2HD2 LEU 108 32.617 26.616 -55.490 893 H SER 109 H SER 109 38.639 26.957 -59.457 894 HA SER 109 HA SER 109 39.367 29.214 -57.771 895 HB2 SER 109 2HB SER 109 41.788 28.484 -58.189 896 HB3 SER 109 1HB SER 109 40.835 27.464 -57.115 897 HG SER 109 HG SER 109 40.395 26.274 -59.269 898 H TYR 110 H TYR 110 40.443 27.793 -60.871 899 HA TYR 110 HA TYR 110 39.642 30.265 -62.123 900 HB2 TYR 110 2HB TYR 110 42.123 30.394 -61.511 901 HB3 TYR 110 1HB TYR 110 42.367 29.072 -62.643 902 HD1 TYR 110 1HD TYR 110 41.315 32.571 -62.332 903 HD2 TYR 110 2HD TYR 110 42.377 29.457 -65.008 904 HE1 TYR 110 1HE TYR 110 41.434 34.202 -64.149 905 HE2 TYR 110 2HE TYR 110 42.502 31.089 -66.844 906 HH TYR 110 HH TYR 110 42.514 34.436 -66.294 907 H ILE 111 H ILE 111 38.067 29.289 -63.230 908 HA ILE 111 HA ILE 111 38.708 26.867 -64.663 909 HB ILE 111 HB ILE 111 36.719 26.640 -63.437 910 HG12 ILE 111 2HG1 ILE 111 35.924 27.127 -66.314 911 HG13 ILE 111 1HG1 ILE 111 36.689 25.672 -65.702 912 HG21 ILE 111 1HG2 ILE 111 34.762 28.075 -63.632 913 HG22 ILE 111 2HG2 ILE 111 35.686 29.164 -64.669 914 HG23 ILE 111 3HG2 ILE 111 36.169 28.928 -62.988 915 HD11 ILE 111 3HD1 ILE 111 34.798 25.261 -64.293 916 HD12 ILE 111 1HD1 ILE 111 34.315 25.355 -65.991 917 HD13 ILE 111 2HD1 ILE 111 34.007 26.722 -64.898 Start of MODEL 20 1 H1 GLY -1 1HT GLY -1 -0.735 -3.917 -30.592 2 H2 GLY -1 2HT GLY -1 -1.765 -4.148 -29.273 3 H3 GLY -1 3HT GLY -1 -0.152 -4.656 -29.192 4 HA2 GLY -1 1HA GLY -1 0.611 -2.389 -29.336 5 HA3 GLY -1 2HA GLY -1 -1.074 -1.870 -29.379 6 H SER 0 H SER 0 -1.408 -0.902 -27.498 7 HA SER 0 HA SER 0 -0.393 -2.151 -25.083 8 HB2 SER 0 2HB SER 0 -1.722 0.527 -25.509 9 HB3 SER 0 1HB SER 0 -0.963 -0.033 -24.021 10 HG SER 0 HG SER 0 0.238 0.480 -26.518 11 H MET 1 H MET 1 -1.730 -3.669 -24.325 12 HA MET 1 HA MET 1 -4.574 -3.638 -24.784 13 HB2 MET 1 2HB MET 1 -2.983 -5.407 -22.904 14 HB3 MET 1 1HB MET 1 -4.609 -5.705 -23.502 15 HG2 MET 1 2HG MET 1 -2.090 -5.665 -25.144 16 HG3 MET 1 1HG MET 1 -2.995 -7.094 -24.657 17 HE1 MET 1 3HE MET 1 -3.509 -6.841 -28.545 18 HE2 MET 1 1HE MET 1 -2.883 -7.823 -27.224 19 HE3 MET 1 2HE MET 1 -2.073 -6.317 -27.665 20 H THR 2 H THR 2 -5.972 -2.533 -23.596 21 HA THR 2 HA THR 2 -5.000 -1.288 -21.166 22 HB THR 2 HB THR 2 -7.515 -0.750 -22.746 23 HG1 THR 2 1HG THR 2 -4.887 -0.145 -23.118 24 HG21 THR 2 3HG2 THR 2 -7.611 0.047 -20.408 25 HG22 THR 2 1HG2 THR 2 -7.501 1.397 -21.538 26 HG23 THR 2 2HG2 THR 2 -6.076 0.883 -20.636 27 H VAL 3 H VAL 3 -5.573 -1.928 -19.207 28 HA VAL 3 HA VAL 3 -8.127 -3.367 -18.787 29 HB VAL 3 HB VAL 3 -5.636 -3.778 -17.107 30 HG11 VAL 3 1HG1 VAL 3 -7.646 -4.342 -15.951 31 HG12 VAL 3 2HG1 VAL 3 -6.753 -5.810 -16.398 32 HG13 VAL 3 3HG1 VAL 3 -8.165 -5.344 -17.325 33 HG21 VAL 3 3HG2 VAL 3 -6.577 -5.613 -19.305 34 HG22 VAL 3 1HG2 VAL 3 -5.318 -5.930 -18.109 35 HG23 VAL 3 2HG2 VAL 3 -5.083 -4.645 -19.307 36 H TYR 4 H TYR 4 -9.335 -2.527 -16.961 37 HA TYR 4 HA TYR 4 -8.081 -0.232 -15.684 38 HB2 TYR 4 2HB TYR 4 -11.011 -0.971 -15.905 39 HB3 TYR 4 1HB TYR 4 -10.365 0.482 -15.141 40 HD1 TYR 4 2HD TYR 4 -10.834 -1.247 -18.363 41 HD2 TYR 4 1HD TYR 4 -9.682 2.372 -16.465 42 HE1 TYR 4 2HE TYR 4 -10.882 -0.112 -20.532 43 HE2 TYR 4 1HE TYR 4 -9.730 3.528 -18.641 44 HH TYR 4 HH TYR 4 -9.541 2.977 -20.992 45 H ILE 5 H ILE 5 -7.690 -0.212 -13.581 46 HA ILE 5 HA ILE 5 -8.512 -2.542 -11.942 47 HB ILE 5 HB ILE 5 -6.133 -0.740 -11.508 48 HG12 ILE 5 2HG1 ILE 5 -4.650 -2.504 -11.944 49 HG13 ILE 5 1HG1 ILE 5 -5.845 -3.665 -12.389 50 HG21 ILE 5 1HG2 ILE 5 -6.988 -1.634 -9.464 51 HG22 ILE 5 2HG2 ILE 5 -5.420 -2.369 -9.814 52 HG23 ILE 5 3HG2 ILE 5 -6.902 -3.269 -10.108 53 HD11 ILE 5 3HD1 ILE 5 -4.951 -1.189 -13.901 54 HD12 ILE 5 1HD1 ILE 5 -6.350 -2.148 -14.380 55 HD13 ILE 5 2HD1 ILE 5 -4.745 -2.874 -14.384 56 H CYS 6 H CYS 6 -10.018 -1.847 -10.495 57 HA CYS 6 HA CYS 6 -9.332 0.584 -9.075 58 HB2 CYS 6 2HB CYS 6 -11.369 1.081 -10.395 59 HB3 CYS 6 1HB CYS 6 -12.172 -0.303 -9.656 60 HG CYS 6 HG CYS 6 -13.320 1.697 -8.332 61 HA PRO 7 HA PRO 7 -9.116 -2.833 -6.057 62 HB2 PRO 7 2HB PRO 7 -7.745 -0.751 -4.481 63 HB3 PRO 7 1HB PRO 7 -7.170 -2.354 -4.940 64 HG2 PRO 7 2HG PRO 7 -6.150 -0.132 -6.048 65 HG3 PRO 7 1HG PRO 7 -6.352 -1.625 -6.979 66 HD2 PRO 7 2HD PRO 7 -8.024 0.856 -6.979 67 HD3 PRO 7 1HD PRO 7 -7.524 -0.194 -8.333 68 H GLU 8 H GLU 8 -10.454 0.212 -6.022 69 HA GLU 8 HA GLU 8 -11.388 0.265 -3.287 70 HB2 GLU 8 2HB GLU 8 -12.167 2.064 -5.558 71 HB3 GLU 8 1HB GLU 8 -12.275 2.391 -3.836 72 HG2 GLU 8 2HG GLU 8 -9.791 1.981 -5.394 73 HG3 GLU 8 1HG GLU 8 -10.443 3.562 -4.943 74 H THR 9 H THR 9 -12.976 0.426 -6.482 75 HA THR 9 HA THR 9 -15.366 -0.618 -5.184 76 HB THR 9 HB THR 9 -16.627 0.507 -7.033 77 HG1 THR 9 1HG THR 9 -15.425 1.131 -8.647 78 HG21 THR 9 3HG2 THR 9 -14.823 2.275 -5.370 79 HG22 THR 9 1HG2 THR 9 -16.341 1.565 -4.815 80 HG23 THR 9 2HG2 THR 9 -16.345 2.774 -6.102 81 H GLY 10 H GLY 10 -12.981 -1.650 -7.327 82 HA2 GLY 10 2HA GLY 10 -14.971 -3.301 -8.720 83 HA3 GLY 10 1HA GLY 10 -13.385 -3.102 -9.387 84 H ASP 11 H ASP 11 -12.993 -5.312 -9.511 85 HA ASP 11 HA ASP 11 -12.067 -6.663 -7.215 86 HB2 ASP 11 2HB ASP 11 -14.537 -6.987 -6.878 87 HB3 ASP 11 1HB ASP 11 -14.581 -7.835 -8.424 88 H ASP 12 H ASP 12 -10.988 -8.513 -7.743 89 HA ASP 12 HA ASP 12 -9.837 -8.495 -10.356 90 HB2 ASP 12 2HB ASP 12 -8.494 -10.403 -9.565 91 HB3 ASP 12 1HB ASP 12 -8.487 -9.053 -8.428 92 H GLY 13 H GLY 13 -12.578 -10.163 -9.095 93 HA2 GLY 13 2HA GLY 13 -12.408 -12.418 -10.881 94 HA3 GLY 13 1HA GLY 13 -13.778 -11.962 -9.878 95 H ASN 14 H ASN 14 -12.961 -9.275 -11.432 96 HA ASN 14 HA ASN 14 -15.153 -9.492 -13.277 97 HB2 ASN 14 2HB ASN 14 -13.343 -7.234 -12.531 98 HB3 ASN 14 1HB ASN 14 -14.553 -7.072 -13.783 99 HD21 ASN 14 1HD2 ASN 14 -14.349 -5.633 -11.321 100 HD22 ASN 14 2HD2 ASN 14 -15.793 -5.944 -10.433 101 H ASP 15 H ASP 15 -14.710 -8.123 -15.424 102 HA ASP 15 HA ASP 15 -12.835 -9.721 -16.968 103 HB2 ASP 15 2HB ASP 15 -14.859 -7.645 -17.852 104 HB3 ASP 15 1HB ASP 15 -13.895 -8.639 -18.932 105 H GLY 16 H GLY 16 -12.737 -6.852 -15.326 106 HA2 GLY 16 2HA GLY 16 -11.117 -5.267 -15.193 107 HA3 GLY 16 1HA GLY 16 -10.266 -6.113 -16.480 108 H SER 17 H SER 17 -13.521 -4.911 -16.825 109 HA SER 17 HA SER 17 -12.606 -3.083 -18.876 110 HB2 SER 17 2HB SER 17 -15.062 -2.766 -19.287 111 HB3 SER 17 1HB SER 17 -14.568 -4.456 -19.393 112 HG SER 17 HG SER 17 -16.371 -4.435 -18.172 113 H GLU 18 H GLU 18 -14.108 -0.837 -18.709 114 HA GLU 18 HA GLU 18 -13.023 0.381 -16.468 115 HB2 GLU 18 2HB GLU 18 -13.406 1.540 -18.613 116 HB3 GLU 18 1HB GLU 18 -15.136 1.380 -18.388 117 HG2 GLU 18 2HG GLU 18 -14.988 2.769 -16.385 118 HG3 GLU 18 1HG GLU 18 -13.250 2.908 -16.709 119 H LEU 19 H LEU 19 -16.223 -0.890 -17.319 120 HA LEU 19 HA LEU 19 -17.537 0.095 -14.989 121 HB2 LEU 19 2HB LEU 19 -18.382 -1.878 -17.093 122 HB3 LEU 19 1HB LEU 19 -19.392 -1.402 -15.749 123 HG LEU 19 HG LEU 19 -20.095 -0.280 -17.642 124 HD11 LEU 19 1HD1 LEU 19 -20.215 1.033 -15.642 125 HD12 LEU 19 2HD1 LEU 19 -19.894 2.091 -17.016 126 HD13 LEU 19 3HD1 LEU 19 -18.589 1.666 -15.916 127 HD21 LEU 19 3HD2 LEU 19 -18.171 -0.386 -19.082 128 HD22 LEU 19 1HD2 LEU 19 -17.300 0.759 -18.057 129 HD23 LEU 19 2HD2 LEU 19 -18.713 1.289 -18.971 130 H LYS 20 H LYS 20 -15.782 -2.776 -15.843 131 HA LYS 20 HA LYS 20 -16.340 -3.940 -13.152 132 HB2 LYS 20 2HB LYS 20 -15.524 -5.555 -15.574 133 HB3 LYS 20 1HB LYS 20 -16.136 -6.088 -14.032 134 HG2 LYS 20 2HG LYS 20 -18.372 -5.341 -14.523 135 HG3 LYS 20 1HG LYS 20 -17.838 -4.668 -16.066 136 HD2 LYS 20 2HD LYS 20 -17.156 -6.917 -16.803 137 HD3 LYS 20 1HD LYS 20 -17.720 -7.581 -15.273 138 HE2 LYS 20 2HE LYS 20 -19.430 -6.189 -17.341 139 HE3 LYS 20 1HE LYS 20 -19.336 -7.925 -17.085 140 HZ1 LYS 20 3HZ LYS 20 -21.268 -6.994 -16.031 141 HZ2 LYS 20 1HZ LYS 20 -20.328 -5.931 -15.126 142 HZ3 LYS 20 2HZ LYS 20 -20.220 -7.596 -14.853 143 HA PRO 21 HA PRO 21 -11.922 -3.003 -13.867 144 HB2 PRO 21 2HB PRO 21 -11.471 -1.587 -11.610 145 HB3 PRO 21 1HB PRO 21 -12.070 -0.853 -13.102 146 HG2 PRO 21 2HG PRO 21 -13.567 -1.592 -10.631 147 HG3 PRO 21 1HG PRO 21 -13.778 -0.203 -11.704 148 HD2 PRO 21 2HD PRO 21 -15.361 -2.459 -11.766 149 HD3 PRO 21 1HD PRO 21 -15.122 -1.353 -13.124 150 H LEU 22 H LEU 22 -10.210 -3.963 -12.910 151 HA LEU 22 HA LEU 22 -10.778 -6.197 -11.160 152 HB2 LEU 22 2HB LEU 22 -8.165 -5.172 -12.235 153 HB3 LEU 22 1HB LEU 22 -8.425 -6.730 -11.474 154 HG LEU 22 HG LEU 22 -9.618 -5.833 -14.079 155 HD11 LEU 22 1HD1 LEU 22 -8.150 -7.485 -15.066 156 HD12 LEU 22 2HD1 LEU 22 -7.423 -7.775 -13.485 157 HD13 LEU 22 3HD1 LEU 22 -7.261 -6.201 -14.252 158 HD21 LEU 22 3HD2 LEU 22 -9.763 -8.487 -12.659 159 HD22 LEU 22 1HD2 LEU 22 -10.344 -8.169 -14.294 160 HD23 LEU 22 2HD2 LEU 22 -11.096 -7.363 -12.916 161 H ARG 23 H ARG 23 -9.441 -6.512 -9.173 162 HA ARG 23 HA ARG 23 -9.275 -3.903 -7.917 163 HB2 ARG 23 2HB ARG 23 -9.561 -4.974 -5.762 164 HB3 ARG 23 1HB ARG 23 -10.815 -5.370 -6.867 165 HG2 ARG 23 2HG ARG 23 -10.369 -7.287 -5.691 166 HG3 ARG 23 1HG ARG 23 -9.643 -7.555 -7.269 167 HD2 ARG 23 2HD ARG 23 -7.436 -6.961 -6.315 168 HD3 ARG 23 1HD ARG 23 -8.197 -6.787 -4.733 169 HE ARG 23 HE ARG 23 -8.774 -9.319 -5.813 170 HH11 ARG 23 1HH1 ARG 23 -6.071 -7.514 -4.357 171 HH12 ARG 23 2HH1 ARG 23 -5.328 -8.920 -3.744 172 HH21 ARG 23 1HH2 ARG 23 -7.719 -11.207 -4.951 173 HH22 ARG 23 2HH2 ARG 23 -6.262 -11.018 -4.068 174 H THR 24 H THR 24 -7.203 -5.779 -9.403 175 HA THR 24 HA THR 24 -5.004 -4.682 -7.956 176 HB THR 24 HB THR 24 -5.065 -6.736 -6.718 177 HG1 THR 24 1HG THR 24 -3.091 -7.194 -6.957 178 HG21 THR 24 3HG2 THR 24 -6.574 -8.022 -8.188 179 HG22 THR 24 1HG2 THR 24 -5.141 -8.954 -7.765 180 HG23 THR 24 2HG2 THR 24 -5.269 -8.202 -9.357 181 H LEU 25 H LEU 25 -3.152 -4.611 -9.105 182 HA LEU 25 HA LEU 25 -3.349 -4.463 -11.927 183 HB2 LEU 25 2HB LEU 25 -1.933 -3.014 -10.545 184 HB3 LEU 25 1HB LEU 25 -0.997 -4.397 -10.049 185 HG LEU 25 HG LEU 25 -0.154 -4.675 -12.324 186 HD11 LEU 25 1HD1 LEU 25 -2.091 -3.810 -13.548 187 HD12 LEU 25 2HD1 LEU 25 -0.616 -2.975 -14.019 188 HD13 LEU 25 3HD1 LEU 25 -1.764 -2.192 -12.937 189 HD21 LEU 25 3HD2 LEU 25 1.203 -2.637 -12.382 190 HD22 LEU 25 1HD2 LEU 25 1.051 -3.283 -10.745 191 HD23 LEU 25 2HD2 LEU 25 0.092 -1.888 -11.236 192 H TYR 26 H TYR 26 -2.545 -6.880 -9.596 193 HA TYR 26 HA TYR 26 -0.872 -8.622 -10.975 194 HB2 TYR 26 2HB TYR 26 -1.475 -8.659 -8.585 195 HB3 TYR 26 1HB TYR 26 -3.095 -9.154 -9.017 196 HD1 TYR 26 1HD TYR 26 0.445 -10.183 -9.257 197 HD2 TYR 26 2HD TYR 26 -3.605 -11.440 -9.094 198 HE1 TYR 26 1HE TYR 26 1.166 -12.481 -8.974 199 HE2 TYR 26 2HE TYR 26 -2.867 -13.757 -8.802 200 HH TYR 26 HH TYR 26 -0.961 -15.099 -9.198 201 H GLN 27 H GLN 27 -4.412 -8.470 -10.835 202 HA GLN 27 HA GLN 27 -4.767 -10.716 -12.528 203 HB2 GLN 27 2HB GLN 27 -6.506 -10.098 -10.932 204 HB3 GLN 27 1HB GLN 27 -6.768 -8.568 -11.744 205 HG2 GLN 27 2HG GLN 27 -8.546 -10.142 -12.304 206 HG3 GLN 27 1HG GLN 27 -7.616 -9.781 -13.732 207 HE21 GLN 27 1HE2 GLN 27 -8.182 -11.620 -14.749 208 HE22 GLN 27 2HE2 GLN 27 -7.613 -13.188 -14.370 209 H ALA 28 H ALA 28 -4.524 -7.232 -13.183 210 HA ALA 28 HA ALA 28 -5.383 -7.207 -15.809 211 HB1 ALA 28 1HB ALA 28 -4.975 -5.196 -14.460 212 HB2 ALA 28 2HB ALA 28 -4.088 -5.128 -15.974 213 HB3 ALA 28 3HB ALA 28 -3.247 -5.532 -14.477 214 H MET 29 H MET 29 -2.193 -7.908 -14.401 215 HA MET 29 HA MET 29 -1.009 -8.356 -16.904 216 HB2 MET 29 2HB MET 29 -0.191 -8.789 -14.100 217 HB3 MET 29 1HB MET 29 0.692 -9.624 -15.358 218 HG2 MET 29 2HG MET 29 1.169 -7.368 -16.407 219 HG3 MET 29 1HG MET 29 0.392 -6.616 -15.034 220 HE1 MET 29 3HE MET 29 4.197 -6.047 -14.717 221 HE2 MET 29 1HE MET 29 2.646 -5.297 -15.077 222 HE3 MET 29 2HE MET 29 3.414 -6.359 -16.271 223 H ILE 30 H ILE 30 -2.721 -10.426 -14.678 224 HA ILE 30 HA ILE 30 -1.924 -12.909 -15.758 225 HB ILE 30 HB ILE 30 -4.605 -12.194 -14.517 226 HG12 ILE 30 2HG1 ILE 30 -2.103 -13.339 -13.241 227 HG13 ILE 30 1HG1 ILE 30 -2.750 -11.726 -12.993 228 HG21 ILE 30 1HG2 ILE 30 -4.835 -14.586 -14.037 229 HG22 ILE 30 2HG2 ILE 30 -3.336 -14.906 -14.902 230 HG23 ILE 30 3HG2 ILE 30 -4.742 -14.286 -15.772 231 HD11 ILE 30 3HD1 ILE 30 -4.719 -12.722 -11.952 232 HD12 ILE 30 1HD1 ILE 30 -3.221 -13.178 -11.138 233 HD13 ILE 30 2HD1 ILE 30 -4.025 -14.320 -12.214 234 H ILE 31 H ILE 31 -4.669 -10.874 -16.459 235 HA ILE 31 HA ILE 31 -5.872 -12.466 -18.416 236 HB ILE 31 HB ILE 31 -6.085 -9.469 -18.054 237 HG12 ILE 31 2HG1 ILE 31 -7.710 -11.755 -16.929 238 HG13 ILE 31 1HG1 ILE 31 -6.657 -10.661 -16.036 239 HG21 ILE 31 1HG2 ILE 31 -6.885 -10.257 -20.223 240 HG22 ILE 31 2HG2 ILE 31 -8.238 -9.739 -19.173 241 HG23 ILE 31 3HG2 ILE 31 -7.870 -11.459 -19.353 242 HD11 ILE 31 3HD1 ILE 31 -8.124 -8.797 -16.624 243 HD12 ILE 31 1HD1 ILE 31 -8.980 -10.067 -15.730 244 HD13 ILE 31 2HD1 ILE 31 -9.167 -9.931 -17.482 245 H THR 32 H THR 32 -3.414 -9.935 -18.688 246 HA THR 32 HA THR 32 -3.667 -10.036 -21.597 247 HB THR 32 HB THR 32 -2.308 -7.973 -21.617 248 HG1 THR 32 1HG THR 32 -2.616 -7.785 -18.824 249 HG21 THR 32 3HG2 THR 32 -4.664 -7.832 -19.702 250 HG22 THR 32 1HG2 THR 32 -4.790 -7.822 -21.463 251 HG23 THR 32 2HG2 THR 32 -4.012 -6.495 -20.606 252 H LYS 33 H LYS 33 -1.218 -10.429 -19.041 253 HA LYS 33 HA LYS 33 0.876 -11.117 -18.945 254 HB2 LYS 33 2HB LYS 33 0.265 -12.583 -21.516 255 HB3 LYS 33 1HB LYS 33 1.685 -12.856 -20.521 256 HG2 LYS 33 2HG LYS 33 0.159 -13.528 -18.666 257 HG3 LYS 33 1HG LYS 33 -1.182 -13.412 -19.808 258 HD2 LYS 33 2HD LYS 33 1.218 -15.235 -20.054 259 HD3 LYS 33 1HD LYS 33 -0.407 -15.722 -19.590 260 HE2 LYS 33 2HE LYS 33 -1.230 -14.993 -21.796 261 HE3 LYS 33 1HE LYS 33 0.413 -14.549 -22.246 262 HZ1 LYS 33 3HZ LYS 33 1.068 -16.862 -21.989 263 HZ2 LYS 33 1HZ LYS 33 -0.191 -16.739 -23.094 264 HZ3 LYS 33 2HZ LYS 33 -0.486 -17.282 -21.536 265 H SER 34 H SER 34 0.039 -8.807 -20.813 266 HA SER 34 HA SER 34 2.221 -8.801 -22.720 267 HB2 SER 34 2HB SER 34 0.093 -6.738 -22.203 268 HB3 SER 34 1HB SER 34 1.167 -6.823 -23.602 269 HG SER 34 HG SER 34 0.032 -9.186 -23.387 270 H SER 35 H SER 35 1.568 -7.415 -19.600 271 HA SER 35 HA SER 35 2.720 -6.120 -18.156 272 HB2 SER 35 2HB SER 35 5.083 -6.904 -19.860 273 HB3 SER 35 1HB SER 35 5.177 -6.225 -18.232 274 HG SER 35 HG SER 35 4.297 -8.743 -19.085 275 H LYS 36 H LYS 36 2.612 -5.015 -21.325 276 HA LYS 36 HA LYS 36 3.879 -2.418 -20.648 277 HB2 LYS 36 2HB LYS 36 4.369 -2.132 -23.024 278 HB3 LYS 36 1HB LYS 36 5.095 -3.606 -22.397 279 HG2 LYS 36 2HG LYS 36 3.387 -4.962 -23.423 280 HG3 LYS 36 1HG LYS 36 2.481 -3.528 -23.889 281 HD2 LYS 36 2HD LYS 36 3.670 -4.477 -25.799 282 HD3 LYS 36 1HD LYS 36 4.287 -2.877 -25.403 283 HE2 LYS 36 2HE LYS 36 6.187 -3.884 -24.263 284 HE3 LYS 36 1HE LYS 36 5.560 -5.496 -24.609 285 HZ1 LYS 36 3HZ LYS 36 6.370 -3.485 -26.642 286 HZ2 LYS 36 1HZ LYS 36 5.783 -5.019 -26.972 287 HZ3 LYS 36 2HZ LYS 36 7.265 -4.848 -26.204 288 H GLY 37 H GLY 37 0.924 -3.790 -21.113 289 HA2 GLY 37 2HA GLY 37 -0.241 -1.932 -22.939 290 HA3 GLY 37 1HA GLY 37 -1.113 -3.072 -21.927 291 H ASP 38 H ASP 38 -2.367 -0.811 -22.115 292 HA ASP 38 HA ASP 38 -1.461 0.991 -20.054 293 HB2 ASP 38 2HB ASP 38 -3.994 0.949 -21.722 294 HB3 ASP 38 1HB ASP 38 -3.746 2.082 -20.405 295 H PHE 39 H PHE 39 -1.618 0.306 -18.141 296 HA PHE 39 HA PHE 39 -4.024 -1.142 -17.372 297 HB2 PHE 39 2HB PHE 39 -1.334 -1.023 -15.965 298 HB3 PHE 39 1HB PHE 39 -2.721 -1.973 -15.457 299 HD1 PHE 39 1HD PHE 39 -3.624 -3.617 -17.388 300 HD2 PHE 39 2HD PHE 39 0.359 -2.141 -17.099 301 HE1 PHE 39 1HE PHE 39 -2.822 -5.500 -18.742 302 HE2 PHE 39 2HE PHE 39 1.153 -4.011 -18.456 303 HZ PHE 39 HZ PHE 39 -0.426 -5.699 -19.279 304 H LEU 40 H LEU 40 -5.394 0.277 -16.637 305 HA LEU 40 HA LEU 40 -4.258 2.714 -15.456 306 HB2 LEU 40 2HB LEU 40 -7.052 2.392 -16.576 307 HB3 LEU 40 1HB LEU 40 -6.227 3.825 -16.017 308 HG LEU 40 HG LEU 40 -5.413 2.283 -18.472 309 HD11 LEU 40 1HD1 LEU 40 -6.940 4.858 -18.193 310 HD12 LEU 40 2HD1 LEU 40 -7.566 3.323 -18.788 311 HD13 LEU 40 3HD1 LEU 40 -6.329 4.189 -19.705 312 HD21 LEU 40 3HD2 LEU 40 -3.557 3.460 -17.441 313 HD22 LEU 40 1HD2 LEU 40 -4.510 4.942 -17.375 314 HD23 LEU 40 2HD2 LEU 40 -4.037 4.266 -18.934 315 H ILE 41 H ILE 41 -4.503 2.989 -13.426 316 HA ILE 41 HA ILE 41 -6.462 1.315 -12.083 317 HB ILE 41 HB ILE 41 -3.922 2.502 -10.935 318 HG12 ILE 41 2HG1 ILE 41 -4.518 -0.237 -12.124 319 HG13 ILE 41 1HG1 ILE 41 -3.243 0.879 -12.474 320 HG21 ILE 41 1HG2 ILE 41 -5.885 0.519 -9.792 321 HG22 ILE 41 2HG2 ILE 41 -5.706 2.193 -9.301 322 HG23 ILE 41 3HG2 ILE 41 -4.386 1.044 -9.005 323 HD11 ILE 41 3HD1 ILE 41 -2.070 0.326 -10.458 324 HD12 ILE 41 1HD1 ILE 41 -2.610 -1.154 -11.296 325 HD13 ILE 41 2HD1 ILE 41 -3.485 -0.601 -9.894 326 H ARG 42 H ARG 42 -7.917 2.176 -10.866 327 HA ARG 42 HA ARG 42 -8.433 4.986 -11.016 328 HB2 ARG 42 2HB ARG 42 -10.144 3.101 -10.908 329 HB3 ARG 42 1HB ARG 42 -9.768 3.009 -9.199 330 HG2 ARG 42 2HG ARG 42 -11.724 4.357 -9.373 331 HG3 ARG 42 1HG ARG 42 -10.384 5.409 -9.027 332 HD2 ARG 42 2HD ARG 42 -10.434 6.453 -10.983 333 HD3 ARG 42 1HD ARG 42 -10.967 5.024 -11.922 334 HE ARG 42 HE ARG 42 -12.980 5.976 -10.200 335 HH11 ARG 42 1HH1 ARG 42 -11.339 6.870 -13.215 336 HH12 ARG 42 2HH1 ARG 42 -12.644 7.764 -13.833 337 HH21 ARG 42 1HH2 ARG 42 -14.770 7.183 -11.057 338 HH22 ARG 42 2HH2 ARG 42 -14.664 7.941 -12.580 339 H THR 43 H THR 43 -7.647 6.302 -9.775 340 HA THR 43 HA THR 43 -6.740 5.604 -7.096 341 HB THR 43 HB THR 43 -4.809 5.457 -8.682 342 HG1 THR 43 1HG THR 43 -4.094 5.920 -6.728 343 HG21 THR 43 3HG2 THR 43 -5.246 8.432 -9.026 344 HG22 THR 43 1HG2 THR 43 -5.440 7.203 -10.272 345 HG23 THR 43 2HG2 THR 43 -3.840 7.539 -9.606 346 H LYS 44 H LYS 44 -6.583 7.497 -5.734 347 HA LYS 44 HA LYS 44 -8.277 9.601 -6.816 348 HB2 LYS 44 2HB LYS 44 -7.862 8.768 -3.943 349 HB3 LYS 44 1HB LYS 44 -8.846 10.135 -4.455 350 HG2 LYS 44 2HG LYS 44 -10.264 8.601 -5.736 351 HG3 LYS 44 1HG LYS 44 -9.320 7.241 -5.140 352 HD2 LYS 44 2HD LYS 44 -10.907 9.172 -3.443 353 HD3 LYS 44 1HD LYS 44 -11.421 7.550 -3.906 354 HE2 LYS 44 2HE LYS 44 -9.471 6.631 -2.702 355 HE3 LYS 44 1HE LYS 44 -9.040 8.264 -2.194 356 HZ1 LYS 44 3HZ LYS 44 -11.554 6.835 -1.501 357 HZ2 LYS 44 1HZ LYS 44 -11.186 8.412 -1.061 358 HZ3 LYS 44 2HZ LYS 44 -10.283 7.150 -0.447 359 H LYS 45 H LYS 45 -7.242 11.191 -7.437 360 HA LYS 45 HA LYS 45 -4.945 12.168 -5.910 361 HB2 LYS 45 2HB LYS 45 -4.135 11.030 -8.019 362 HB3 LYS 45 1HB LYS 45 -5.230 12.047 -8.906 363 HG2 LYS 45 2HG LYS 45 -3.983 13.974 -8.488 364 HG3 LYS 45 1HG LYS 45 -3.038 13.166 -7.236 365 HD2 LYS 45 2HD LYS 45 -3.119 12.219 -10.024 366 HD3 LYS 45 1HD LYS 45 -1.912 13.445 -9.528 367 HE2 LYS 45 2HE LYS 45 -1.182 11.759 -7.786 368 HE3 LYS 45 1HE LYS 45 -2.278 10.598 -8.519 369 HZ1 LYS 45 3HZ LYS 45 0.032 10.370 -9.255 370 HZ2 LYS 45 1HZ LYS 45 -0.043 11.917 -9.924 371 HZ3 LYS 45 2HZ LYS 45 -1.005 10.673 -10.545 372 H ASP 46 H ASP 46 -5.041 14.239 -5.454 373 HA ASP 46 HA ASP 46 -5.877 16.322 -5.121 374 HB2 ASP 46 2HB ASP 46 -5.161 16.593 -7.517 375 HB3 ASP 46 1HB ASP 46 -6.755 16.075 -8.031 376 H GLY 47 H GLY 47 -7.397 14.004 -4.534 377 HA2 GLY 47 2HA GLY 47 -9.402 13.631 -3.456 378 HA3 GLY 47 1HA GLY 47 -9.867 15.272 -3.866 379 H LYS 48 H LYS 48 -8.941 13.328 -6.564 380 HA LYS 48 HA LYS 48 -11.765 12.677 -7.082 381 HB2 LYS 48 2HB LYS 48 -9.789 13.823 -9.051 382 HB3 LYS 48 1HB LYS 48 -11.360 13.164 -9.481 383 HG2 LYS 48 2HG LYS 48 -12.446 14.889 -8.131 384 HG3 LYS 48 1HG LYS 48 -10.864 15.541 -7.702 385 HD2 LYS 48 2HD LYS 48 -11.867 16.840 -9.514 386 HD3 LYS 48 1HD LYS 48 -10.415 16.005 -10.052 387 HE2 LYS 48 2HE LYS 48 -12.201 15.886 -11.718 388 HE3 LYS 48 1HE LYS 48 -11.756 14.290 -11.137 389 HZ1 LYS 48 3HZ LYS 48 -14.116 14.503 -11.298 390 HZ2 LYS 48 1HZ LYS 48 -14.144 15.867 -10.319 391 HZ3 LYS 48 2HZ LYS 48 -13.732 14.359 -9.670 392 H GLN 49 H GLN 49 -12.190 10.769 -8.241 393 HA GLN 49 HA GLN 49 -10.098 8.814 -8.175 394 HB2 GLN 49 2HB GLN 49 -12.949 8.613 -9.204 395 HB3 GLN 49 1HB GLN 49 -11.861 7.277 -8.941 396 HG2 GLN 49 2HG GLN 49 -13.491 7.272 -7.208 397 HG3 GLN 49 1HG GLN 49 -11.969 7.764 -6.493 398 HE21 GLN 49 1HE2 GLN 49 -13.125 8.679 -4.775 399 HE22 GLN 49 2HE2 GLN 49 -13.929 10.202 -4.947 400 H VAL 50 H VAL 50 -8.832 8.527 -9.882 401 HA VAL 50 HA VAL 50 -9.834 9.234 -12.554 402 HB VAL 50 HB VAL 50 -7.612 10.160 -13.133 403 HG11 VAL 50 1HG1 VAL 50 -7.749 12.276 -11.904 404 HG12 VAL 50 2HG1 VAL 50 -8.840 11.524 -10.746 405 HG13 VAL 50 3HG1 VAL 50 -9.344 11.726 -12.423 406 HG21 VAL 50 3HG2 VAL 50 -5.966 10.691 -11.378 407 HG22 VAL 50 1HG2 VAL 50 -6.239 8.950 -11.499 408 HG23 VAL 50 2HG2 VAL 50 -6.970 9.862 -10.194 409 H TRP 51 H TRP 51 -8.660 8.091 -14.288 410 HA TRP 51 HA TRP 51 -7.568 5.557 -13.365 411 HB2 TRP 51 2HB TRP 51 -8.300 6.561 -16.131 412 HB3 TRP 51 1HB TRP 51 -7.645 4.997 -15.878 413 HD1 TRP 51 HD TRP 51 -10.680 6.552 -16.535 414 HE1 TRP 51 1HE TRP 51 -12.739 5.080 -15.882 415 HE3 TRP 51 3HE TRP 51 -8.334 3.236 -13.487 416 HZ2 TRP 51 2HZ TRP 51 -13.245 2.834 -14.271 417 HZ3 TRP 51 3HZ TRP 51 -9.657 1.453 -12.436 418 HH2 TRP 51 HH TRP 51 -12.059 1.260 -12.817 419 H GLU 52 H GLU 52 -5.433 5.560 -13.056 420 HA GLU 52 HA GLU 52 -3.792 7.212 -14.855 421 HB2 GLU 52 2HB GLU 52 -3.745 8.050 -12.521 422 HB3 GLU 52 1HB GLU 52 -3.201 6.468 -11.977 423 HG2 GLU 52 2HG GLU 52 -1.175 6.726 -13.353 424 HG3 GLU 52 1HG GLU 52 -1.720 8.334 -13.810 425 H ALA 53 H ALA 53 -1.962 6.247 -15.696 426 HA ALA 53 HA ALA 53 -2.089 3.449 -16.043 427 HB1 ALA 53 1HB ALA 53 0.178 5.344 -16.666 428 HB2 ALA 53 2HB ALA 53 -1.153 4.945 -17.751 429 HB3 ALA 53 3HB ALA 53 0.004 3.700 -17.278 430 H ALA 54 H ALA 54 -0.900 1.854 -15.239 431 HA ALA 54 HA ALA 54 -0.055 1.923 -12.598 432 HB1 ALA 54 1HB ALA 54 0.700 -0.051 -14.738 433 HB2 ALA 54 2HB ALA 54 -0.758 -0.110 -13.746 434 HB3 ALA 54 3HB ALA 54 0.828 -0.309 -13.001 435 H SER 55 H SER 55 2.241 1.073 -11.974 436 HA SER 55 HA SER 55 4.038 3.050 -13.121 437 HB2 SER 55 2HB SER 55 4.054 1.754 -10.395 438 HB3 SER 55 1HB SER 55 5.116 3.049 -10.954 439 HG SER 55 HG SER 55 3.017 4.170 -11.389 440 H LYS 56 H LYS 56 6.016 2.400 -13.689 441 HA LYS 56 HA LYS 56 6.475 -0.108 -14.643 442 HB2 LYS 56 2HB LYS 56 8.882 0.492 -14.818 443 HB3 LYS 56 1HB LYS 56 7.806 1.716 -15.450 444 HG2 LYS 56 2HG LYS 56 9.185 1.849 -12.753 445 HG3 LYS 56 1HG LYS 56 9.781 2.620 -14.214 446 HD2 LYS 56 2HD LYS 56 7.175 3.251 -12.792 447 HD3 LYS 56 1HD LYS 56 8.643 4.212 -12.747 448 HE2 LYS 56 2HE LYS 56 8.469 4.646 -15.138 449 HE3 LYS 56 1HE LYS 56 7.044 3.624 -15.245 450 HZ1 LYS 56 3HZ LYS 56 6.465 5.958 -15.160 451 HZ2 LYS 56 1HZ LYS 56 7.255 6.167 -13.712 452 HZ3 LYS 56 2HZ LYS 56 5.854 5.229 -13.786 453 H THR 57 H THR 57 7.523 1.101 -11.435 454 HA THR 57 HA THR 57 8.796 -1.304 -10.743 455 HB THR 57 HB THR 57 8.570 -0.289 -8.411 456 HG1 THR 57 1HG THR 57 7.435 1.493 -8.233 457 HG21 THR 57 3HG2 THR 57 9.836 1.366 -10.613 458 HG22 THR 57 1HG2 THR 57 10.584 -0.012 -9.807 459 HG23 THR 57 2HG2 THR 57 10.240 1.459 -8.898 460 H ALA 58 H ALA 58 5.551 -0.054 -10.296 461 HA ALA 58 HA ALA 58 4.629 -2.054 -8.517 462 HB1 ALA 58 1HB ALA 58 3.014 -0.343 -10.413 463 HB2 ALA 58 2HB ALA 58 3.483 0.106 -8.773 464 HB3 ALA 58 3HB ALA 58 2.380 -1.242 -9.036 465 H LEU 59 H LEU 59 4.590 -1.753 -12.041 466 HA LEU 59 HA LEU 59 3.131 -4.060 -12.623 467 HB2 LEU 59 2HB LEU 59 5.280 -2.577 -14.137 468 HB3 LEU 59 1HB LEU 59 4.342 -3.979 -14.790 469 HG LEU 59 HG LEU 59 3.079 -1.381 -13.908 470 HD11 LEU 59 1HD1 LEU 59 4.748 -0.907 -15.671 471 HD12 LEU 59 2HD1 LEU 59 3.100 -0.746 -16.277 472 HD13 LEU 59 3HD1 LEU 59 4.042 -2.185 -16.664 473 HD21 LEU 59 3HD2 LEU 59 1.281 -2.127 -15.275 474 HD22 LEU 59 1HD2 LEU 59 1.682 -3.452 -14.192 475 HD23 LEU 59 2HD2 LEU 59 2.206 -3.475 -15.892 476 H LYS 60 H LYS 60 6.579 -3.576 -11.979 477 HA LYS 60 HA LYS 60 7.266 -6.270 -12.435 478 HB2 LYS 60 2HB LYS 60 8.661 -4.048 -11.006 479 HB3 LYS 60 1HB LYS 60 9.243 -5.688 -10.763 480 HG2 LYS 60 2HG LYS 60 10.508 -4.523 -12.475 481 HG3 LYS 60 1HG LYS 60 9.640 -5.899 -13.141 482 HD2 LYS 60 2HD LYS 60 7.942 -4.402 -14.034 483 HD3 LYS 60 1HD LYS 60 8.766 -3.022 -13.310 484 HE2 LYS 60 2HE LYS 60 10.721 -3.478 -14.661 485 HE3 LYS 60 1HE LYS 60 9.924 -4.860 -15.397 486 HZ1 LYS 60 3HZ LYS 60 8.234 -3.319 -16.293 487 HZ2 LYS 60 1HZ LYS 60 9.787 -2.949 -16.826 488 HZ3 LYS 60 2HZ LYS 60 9.097 -2.011 -15.638 489 H LYS 61 H LYS 61 5.851 -4.705 -9.679 490 HA LYS 61 HA LYS 61 6.303 -6.866 -7.893 491 HB2 LYS 61 2HB LYS 61 4.186 -4.722 -7.801 492 HB3 LYS 61 1HB LYS 61 4.512 -5.886 -6.528 493 HG2 LYS 61 2HG LYS 61 6.786 -4.952 -6.306 494 HG3 LYS 61 1HG LYS 61 6.381 -3.750 -7.530 495 HD2 LYS 61 2HD LYS 61 6.126 -2.814 -5.283 496 HD3 LYS 61 1HD LYS 61 4.571 -2.913 -6.118 497 HE2 LYS 61 2HE LYS 61 3.997 -4.936 -4.902 498 HE3 LYS 61 1HE LYS 61 5.581 -4.957 -4.131 499 HZ1 LYS 61 3HZ LYS 61 3.500 -2.869 -3.769 500 HZ2 LYS 61 1HZ LYS 61 4.977 -2.921 -2.973 501 HZ3 LYS 61 2HZ LYS 61 3.824 -4.128 -2.702 502 H SER 62 H SER 62 3.501 -5.913 -9.922 503 HA SER 62 HA SER 62 1.832 -8.021 -9.129 504 HB2 SER 62 2HB SER 62 0.658 -7.427 -11.298 505 HB3 SER 62 1HB SER 62 0.871 -6.096 -10.159 506 HG SER 62 HG SER 62 2.256 -6.630 -12.567 507 H TRP 63 H TRP 63 4.307 -7.761 -11.675 508 HA TRP 63 HA TRP 63 3.601 -10.218 -12.868 509 HB2 TRP 63 2HB TRP 63 4.686 -8.355 -14.061 510 HB3 TRP 63 1HB TRP 63 6.128 -8.587 -13.082 511 HD1 TRP 63 HD TRP 63 7.744 -10.395 -13.794 512 HE1 TRP 63 1HE TRP 63 7.877 -12.045 -15.827 513 HE3 TRP 63 3HE TRP 63 3.062 -9.754 -15.628 514 HZ2 TRP 63 2HZ TRP 63 6.160 -12.913 -17.907 515 HZ3 TRP 63 3HZ TRP 63 2.365 -11.013 -17.618 516 HH2 TRP 63 HH TRP 63 3.881 -12.557 -18.732 517 H LYS 64 H LYS 64 5.825 -9.203 -10.361 518 HA LYS 64 HA LYS 64 7.472 -11.470 -10.274 519 HB2 LYS 64 2HB LYS 64 7.970 -9.368 -9.085 520 HB3 LYS 64 1HB LYS 64 6.651 -9.691 -7.978 521 HG2 LYS 64 2HG LYS 64 7.790 -11.684 -7.170 522 HG3 LYS 64 1HG LYS 64 9.099 -11.410 -8.314 523 HD2 LYS 64 2HD LYS 64 9.569 -9.263 -7.240 524 HD3 LYS 64 1HD LYS 64 8.278 -9.570 -6.079 525 HE2 LYS 64 2HE LYS 64 9.454 -11.597 -5.329 526 HE3 LYS 64 1HE LYS 64 10.738 -11.253 -6.482 527 HZ1 LYS 64 3HZ LYS 64 9.977 -9.532 -4.191 528 HZ2 LYS 64 1HZ LYS 64 11.214 -9.209 -5.288 529 HZ3 LYS 64 2HZ LYS 64 11.321 -10.536 -4.275 530 H ARG 65 H ARG 65 4.430 -10.787 -8.598 531 HA ARG 65 HA ARG 65 4.400 -13.302 -7.261 532 HB2 ARG 65 2HB ARG 65 2.301 -11.197 -7.727 533 HB3 ARG 65 1HB ARG 65 1.893 -12.701 -6.954 534 HG2 ARG 65 2HG ARG 65 2.159 -10.977 -5.311 535 HG3 ARG 65 1HG ARG 65 3.494 -12.106 -5.127 536 HD2 ARG 65 2HD ARG 65 4.979 -10.574 -6.252 537 HD3 ARG 65 1HD ARG 65 3.628 -9.494 -6.615 538 HE ARG 65 HE ARG 65 3.615 -9.788 -3.904 539 HH11 ARG 65 1HH1 ARG 65 5.977 -8.619 -6.227 540 HH12 ARG 65 2HH1 ARG 65 6.716 -7.517 -5.132 541 HH21 ARG 65 1HH2 ARG 65 4.525 -8.272 -2.469 542 HH22 ARG 65 2HH2 ARG 65 5.826 -7.269 -2.902 543 H TYR 66 H TYR 66 3.371 -12.124 -10.351 544 HA TYR 66 HA TYR 66 1.554 -14.189 -11.014 545 HB2 TYR 66 2HB TYR 66 1.631 -11.981 -12.141 546 HB3 TYR 66 1HB TYR 66 3.201 -12.396 -12.813 547 HD1 TYR 66 2HD TYR 66 -0.231 -13.761 -12.634 548 HD2 TYR 66 1HD TYR 66 3.232 -13.159 -14.983 549 HE1 TYR 66 2HE TYR 66 -1.394 -14.720 -14.581 550 HE2 TYR 66 1HE TYR 66 2.091 -14.121 -16.931 551 HH TYR 66 HH TYR 66 0.226 -15.687 -17.329 552 H GLU 67 H GLU 67 5.014 -13.747 -11.532 553 HA GLU 67 HA GLU 67 5.686 -16.164 -12.915 554 HB2 GLU 67 2HB GLU 67 7.219 -14.789 -10.700 555 HB3 GLU 67 1HB GLU 67 7.869 -15.895 -11.897 556 HG2 GLU 67 2HG GLU 67 6.589 -13.321 -12.559 557 HG3 GLU 67 1HG GLU 67 8.313 -13.421 -12.210 558 H GLN 68 H GLN 68 5.289 -15.438 -9.606 559 HA GLN 68 HA GLN 68 6.025 -17.933 -8.610 560 HB2 GLN 68 2HB GLN 68 4.172 -15.919 -7.363 561 HB3 GLN 68 1HB GLN 68 4.872 -17.299 -6.520 562 HG2 GLN 68 2HG GLN 68 7.101 -16.455 -6.941 563 HG3 GLN 68 1HG GLN 68 6.431 -15.083 -7.825 564 HE21 GLN 68 1HE2 GLN 68 8.133 -15.138 -5.537 565 HE22 GLN 68 2HE2 GLN 68 7.317 -14.292 -4.259 566 H GLU 69 H GLU 69 2.659 -16.841 -9.366 567 HA GLU 69 HA GLU 69 1.748 -19.417 -8.603 568 HB2 GLU 69 2HB GLU 69 -0.460 -18.930 -9.488 569 HB3 GLU 69 1HB GLU 69 0.129 -17.615 -8.492 570 HG2 GLU 69 2HG GLU 69 0.453 -16.244 -10.403 571 HG3 GLU 69 1HG GLU 69 0.169 -17.605 -11.497 572 H MET 70 H MET 70 2.780 -18.158 -11.654 573 HA MET 70 HA MET 70 1.866 -20.449 -13.106 574 HB2 MET 70 2HB MET 70 4.026 -18.484 -13.799 575 HB3 MET 70 1HB MET 70 3.452 -19.728 -14.891 576 HG2 MET 70 2HG MET 70 1.191 -18.701 -14.763 577 HG3 MET 70 1HG MET 70 1.892 -17.401 -13.801 578 HE1 MET 70 3HE MET 70 4.496 -15.899 -16.334 579 HE2 MET 70 1HE MET 70 4.792 -17.253 -15.240 580 HE3 MET 70 2HE MET 70 3.868 -15.858 -14.683 581 H LEU 71 H LEU 71 4.766 -19.655 -11.343 582 HA LEU 71 HA LEU 71 6.285 -21.831 -12.146 583 HB2 LEU 71 2HB LEU 71 7.286 -19.931 -11.359 584 HB3 LEU 71 1HB LEU 71 6.378 -19.776 -9.909 585 HG LEU 71 HG LEU 71 8.511 -21.794 -10.565 586 HD11 LEU 71 1HD1 LEU 71 9.921 -20.441 -8.991 587 HD12 LEU 71 2HD1 LEU 71 8.579 -19.308 -8.819 588 HD13 LEU 71 3HD1 LEU 71 9.382 -19.497 -10.379 589 HD21 LEU 71 3HD2 LEU 71 7.037 -22.675 -8.852 590 HD22 LEU 71 1HD2 LEU 71 7.203 -21.194 -7.916 591 HD23 LEU 71 2HD2 LEU 71 8.595 -22.269 -8.122 592 H LYS 72 H LYS 72 3.961 -21.354 -9.523 593 HA LYS 72 HA LYS 72 4.326 -23.989 -8.412 594 HB2 LYS 72 2HB LYS 72 2.009 -22.055 -8.109 595 HB3 LYS 72 1HB LYS 72 2.222 -23.520 -7.168 596 HG2 LYS 72 2HG LYS 72 4.076 -21.147 -7.170 597 HG3 LYS 72 1HG LYS 72 2.886 -21.526 -5.925 598 HD2 LYS 72 2HD LYS 72 4.050 -23.634 -5.455 599 HD3 LYS 72 1HD LYS 72 5.224 -23.262 -6.714 600 HE2 LYS 72 2HE LYS 72 5.924 -21.278 -5.494 601 HE3 LYS 72 1HE LYS 72 4.742 -21.621 -4.236 602 HZ1 LYS 72 3HZ LYS 72 6.961 -22.372 -3.637 603 HZ2 LYS 72 1HZ LYS 72 7.008 -23.387 -4.977 604 HZ3 LYS 72 2HZ LYS 72 5.896 -23.671 -3.742 605 H ASN 73 H ASN 73 2.236 -22.475 -10.680 606 HA ASN 73 HA ASN 73 0.527 -23.073 -11.844 607 HB2 ASN 73 2HB ASN 73 0.972 -24.525 -13.770 608 HB3 ASN 73 1HB ASN 73 2.253 -23.378 -13.461 609 HD21 ASN 73 1HD2 ASN 73 2.237 -25.773 -15.014 610 HD22 ASN 73 2HD2 ASN 73 3.459 -26.817 -14.401 611 H GLU 74 H GLU 74 -0.773 -23.545 -10.201 612 HA GLU 74 HA GLU 74 -1.748 -26.310 -10.264 613 HB2 GLU 74 2HB GLU 74 -2.714 -23.961 -8.611 614 HB3 GLU 74 1HB GLU 74 -3.182 -25.639 -8.414 615 HG2 GLU 74 2HG GLU 74 -0.877 -26.169 -7.730 616 HG3 GLU 74 1HG GLU 74 -0.469 -24.459 -7.869 617 H LYS 75 H LYS 75 -2.826 -22.970 -10.411 618 HA LYS 75 HA LYS 75 -4.710 -23.625 -12.550 619 HB2 LYS 75 2HB LYS 75 -6.020 -23.407 -10.496 620 HB3 LYS 75 1HB LYS 75 -5.207 -21.895 -10.109 621 HG2 LYS 75 2HG LYS 75 -6.186 -20.907 -12.175 622 HG3 LYS 75 1HG LYS 75 -7.102 -22.396 -12.401 623 HD2 LYS 75 2HD LYS 75 -8.224 -22.032 -10.250 624 HD3 LYS 75 1HD LYS 75 -7.274 -20.568 -9.996 625 HE2 LYS 75 2HE LYS 75 -8.258 -19.574 -12.010 626 HE3 LYS 75 1HE LYS 75 -9.213 -21.028 -12.265 627 HZ1 LYS 75 3HZ LYS 75 -9.425 -19.187 -9.935 628 HZ2 LYS 75 1HZ LYS 75 -10.337 -20.586 -10.152 629 HZ3 LYS 75 2HZ LYS 75 -10.508 -19.289 -11.205 630 H VAL 76 H VAL 76 -3.985 -22.442 -14.251 631 HA VAL 76 HA VAL 76 -2.794 -19.831 -13.676 632 HB VAL 76 HB VAL 76 -3.017 -21.280 -16.350 633 HG11 VAL 76 1HG1 VAL 76 -1.440 -18.825 -15.581 634 HG12 VAL 76 2HG1 VAL 76 -2.874 -18.866 -16.612 635 HG13 VAL 76 3HG1 VAL 76 -1.379 -19.629 -17.152 636 HG21 VAL 76 3HG2 VAL 76 -1.536 -22.495 -14.837 637 HG22 VAL 76 1HG2 VAL 76 -0.636 -21.014 -14.512 638 HG23 VAL 76 2HG2 VAL 76 -0.607 -21.726 -16.123 639 H ALA 77 H ALA 77 -4.899 -21.162 -16.133 640 HA ALA 77 HA ALA 77 -6.673 -20.385 -17.233 641 HB1 ALA 77 1HB ALA 77 -7.613 -21.500 -15.276 642 HB2 ALA 77 2HB ALA 77 -8.639 -20.220 -15.947 643 HB3 ALA 77 3HB ALA 77 -7.712 -19.926 -14.469 644 H ALA 78 H ALA 78 -5.471 -18.657 -17.985 645 HA ALA 78 HA ALA 78 -6.295 -16.049 -16.974 646 HB1 ALA 78 1HB ALA 78 -4.261 -16.798 -19.077 647 HB2 ALA 78 2HB ALA 78 -3.909 -16.367 -17.404 648 HB3 ALA 78 3HB ALA 78 -4.583 -15.163 -18.499 649 H LYS 79 H LYS 79 -8.186 -15.433 -17.790 650 HA LYS 79 HA LYS 79 -9.024 -16.380 -20.351 651 HB2 LYS 79 2HB LYS 79 -11.119 -15.069 -20.092 652 HB3 LYS 79 1HB LYS 79 -10.752 -15.962 -18.637 653 HG2 LYS 79 2HG LYS 79 -10.057 -13.054 -18.868 654 HG3 LYS 79 1HG LYS 79 -11.677 -13.575 -18.436 655 HD2 LYS 79 2HD LYS 79 -9.193 -14.410 -16.983 656 HD3 LYS 79 1HD LYS 79 -10.176 -13.018 -16.490 657 HE2 LYS 79 2HE LYS 79 -12.111 -14.625 -16.292 658 HE3 LYS 79 1HE LYS 79 -10.979 -15.936 -16.593 659 HZ1 LYS 79 3HZ LYS 79 -11.366 -15.628 -14.234 660 HZ2 LYS 79 1HZ LYS 79 -10.842 -14.033 -14.320 661 HZ3 LYS 79 2HZ LYS 79 -9.772 -15.324 -14.590 662 H MET 80 H MET 80 -7.693 -15.789 -21.864 663 HA MET 80 HA MET 80 -6.736 -13.075 -21.927 664 HB2 MET 80 2HB MET 80 -6.100 -15.382 -23.719 665 HB3 MET 80 1HB MET 80 -5.366 -13.791 -23.801 666 HG2 MET 80 2HG MET 80 -4.473 -14.103 -21.538 667 HG3 MET 80 1HG MET 80 -5.170 -15.724 -21.505 668 HE1 MET 80 3HE MET 80 -2.590 -13.340 -23.212 669 HE2 MET 80 1HE MET 80 -3.534 -13.888 -24.596 670 HE3 MET 80 2HE MET 80 -1.851 -14.383 -24.427 671 H LEU 81 H LEU 81 -7.822 -11.601 -22.834 672 HA LEU 81 HA LEU 81 -8.596 -12.014 -25.543 673 HB2 LEU 81 2HB LEU 81 -10.752 -10.851 -25.335 674 HB3 LEU 81 1HB LEU 81 -10.746 -12.267 -24.333 675 HG LEU 81 HG LEU 81 -11.964 -10.662 -23.193 676 HD11 LEU 81 1HD1 LEU 81 -10.801 -10.152 -21.131 677 HD12 LEU 81 2HD1 LEU 81 -9.288 -10.655 -21.893 678 HD13 LEU 81 3HD1 LEU 81 -10.592 -11.819 -21.677 679 HD21 LEU 81 3HD2 LEU 81 -11.405 -8.663 -24.399 680 HD22 LEU 81 1HD2 LEU 81 -9.794 -8.631 -23.679 681 HD23 LEU 81 2HD2 LEU 81 -11.220 -8.367 -22.671 682 H GLU 82 H GLU 82 -7.818 -10.463 -26.752 683 HA GLU 82 HA GLU 82 -6.181 -8.569 -25.370 684 HB2 GLU 82 2HB GLU 82 -6.590 -8.904 -28.343 685 HB3 GLU 82 1HB GLU 82 -5.432 -7.826 -27.594 686 HG2 GLU 82 2HG GLU 82 -4.203 -9.696 -28.315 687 HG3 GLU 82 1HG GLU 82 -4.371 -9.877 -26.578 688 H LYS 83 H LYS 83 -7.206 -6.934 -24.479 689 HA LYS 83 HA LYS 83 -9.366 -5.669 -25.829 690 HB2 LYS 83 2HB LYS 83 -9.339 -5.588 -23.373 691 HB3 LYS 83 1HB LYS 83 -7.808 -4.723 -23.400 692 HG2 LYS 83 2HG LYS 83 -9.646 -3.196 -22.949 693 HG3 LYS 83 1HG LYS 83 -8.892 -2.823 -24.497 694 HD2 LYS 83 2HD LYS 83 -10.710 -4.093 -25.628 695 HD3 LYS 83 1HD LYS 83 -11.480 -4.323 -24.056 696 HE2 LYS 83 2HE LYS 83 -10.917 -1.687 -25.412 697 HE3 LYS 83 1HE LYS 83 -12.488 -2.466 -25.266 698 HZ1 LYS 83 3HZ LYS 83 -12.324 -2.218 -22.850 699 HZ2 LYS 83 1HZ LYS 83 -12.200 -0.738 -23.623 700 HZ3 LYS 83 2HZ LYS 83 -10.831 -1.444 -23.015 701 H ASP 84 H ASP 84 -8.543 -5.247 -27.744 702 HA ASP 84 HA ASP 84 -6.521 -3.147 -27.919 703 HB2 ASP 84 2HB ASP 84 -5.971 -5.210 -29.141 704 HB3 ASP 84 1HB ASP 84 -7.485 -5.085 -30.031 705 H ALA 85 H ALA 85 -7.364 -1.252 -28.152 706 HA ALA 85 HA ALA 85 -10.039 -0.903 -29.146 707 HB1 ALA 85 1HB ALA 85 -9.258 0.499 -27.301 708 HB2 ALA 85 2HB ALA 85 -9.609 1.502 -28.712 709 HB3 ALA 85 3HB ALA 85 -7.939 1.105 -28.301 710 H THR 86 H THR 86 -10.388 -0.945 -31.247 711 HA THR 86 HA THR 86 -8.448 -1.041 -33.216 712 HB THR 86 HB THR 86 -11.315 -0.141 -33.573 713 HG1 THR 86 1HG THR 86 -10.135 -2.617 -32.979 714 HG21 THR 86 3HG2 THR 86 -9.899 0.072 -35.575 715 HG22 THR 86 1HG2 THR 86 -11.077 -1.224 -35.777 716 HG23 THR 86 2HG2 THR 86 -9.397 -1.608 -35.405 717 H GLU 87 H GLU 87 -7.040 0.579 -33.538 718 HA GLU 87 HA GLU 87 -8.061 3.334 -33.685 719 HB2 GLU 87 2HB GLU 87 -6.048 2.588 -32.172 720 HB3 GLU 87 1HB GLU 87 -5.156 2.517 -33.675 721 HG2 GLU 87 2HG GLU 87 -6.441 4.966 -32.463 722 HG3 GLU 87 1HG GLU 87 -4.728 4.599 -32.509 723 H VAL 88 H VAL 88 -8.805 3.487 -35.763 724 HA VAL 88 HA VAL 88 -6.871 3.150 -37.906 725 HB VAL 88 HB VAL 88 -8.592 2.152 -39.406 726 HG11 VAL 88 1HG1 VAL 88 -8.039 0.497 -36.952 727 HG12 VAL 88 2HG1 VAL 88 -6.993 0.660 -38.365 728 HG13 VAL 88 3HG1 VAL 88 -8.563 -0.131 -38.516 729 HG21 VAL 88 3HG2 VAL 88 -10.605 2.906 -38.270 730 HG22 VAL 88 1HG2 VAL 88 -10.241 1.868 -36.891 731 HG23 VAL 88 2HG2 VAL 88 -10.632 1.155 -38.456 732 H GLY 89 H GLY 89 -7.481 4.397 -39.832 733 HA2 GLY 89 2HA GLY 89 -9.693 6.108 -39.841 734 HA3 GLY 89 1HA GLY 89 -8.337 6.949 -39.114 735 H VAL 90 H VAL 90 -9.665 5.611 -41.998 736 HA VAL 90 HA VAL 90 -8.030 7.450 -43.479 737 HB VAL 90 HB VAL 90 -6.727 5.363 -43.671 738 HG11 VAL 90 1HG1 VAL 90 -9.200 4.132 -44.846 739 HG12 VAL 90 2HG1 VAL 90 -8.452 3.727 -43.304 740 HG13 VAL 90 3HG1 VAL 90 -7.600 3.389 -44.811 741 HG21 VAL 90 3HG2 VAL 90 -6.711 6.871 -45.576 742 HG22 VAL 90 1HG2 VAL 90 -8.140 6.082 -46.238 743 HG23 VAL 90 2HG2 VAL 90 -6.619 5.198 -46.125 744 H LYS 91 H LYS 91 -9.266 8.583 -44.733 745 HA LYS 91 HA LYS 91 -11.737 7.383 -45.753 746 HB2 LYS 91 2HB LYS 91 -11.207 10.243 -44.941 747 HB3 LYS 91 1HB LYS 91 -12.552 9.795 -45.964 748 HG2 LYS 91 2HG LYS 91 -13.317 10.128 -43.705 749 HG3 LYS 91 1HG LYS 91 -13.450 8.421 -44.109 750 HD2 LYS 91 2HD LYS 91 -11.447 7.953 -42.832 751 HD3 LYS 91 1HD LYS 91 -11.217 9.671 -42.519 752 HE2 LYS 91 2HE LYS 91 -13.311 9.765 -41.299 753 HE3 LYS 91 1HE LYS 91 -13.624 8.069 -41.652 754 HZ1 LYS 91 3HZ LYS 91 -11.389 9.126 -39.998 755 HZ2 LYS 91 1HZ LYS 91 -11.686 7.490 -40.319 756 HZ3 LYS 91 2HZ LYS 91 -12.789 8.381 -39.433 757 H ALA 92 H ALA 92 -11.832 7.190 -47.862 758 HA ALA 92 HA ALA 92 -10.583 9.194 -49.515 759 HB1 ALA 92 1HB ALA 92 -8.887 7.414 -49.347 760 HB2 ALA 92 2HB ALA 92 -9.535 7.545 -50.982 761 HB3 ALA 92 3HB ALA 92 -10.072 6.240 -49.923 762 H ALA 93 H ALA 93 -12.700 9.855 -49.846 763 HA ALA 93 HA ALA 93 -14.053 8.222 -51.821 764 HB1 ALA 93 1HB ALA 93 -15.488 9.527 -49.503 765 HB2 ALA 93 2HB ALA 93 -15.225 7.794 -49.705 766 HB3 ALA 93 3HB ALA 93 -16.246 8.674 -50.848 767 H LEU 94 H LEU 94 -13.168 9.583 -53.285 768 HA LEU 94 HA LEU 94 -14.698 11.880 -53.889 769 HB2 LEU 94 2HB LEU 94 -12.676 13.427 -54.027 770 HB3 LEU 94 1HB LEU 94 -13.307 13.105 -52.434 771 HG LEU 94 HG LEU 94 -11.404 11.472 -52.108 772 HD11 LEU 94 1HD1 LEU 94 -10.817 11.042 -54.407 773 HD12 LEU 94 2HD1 LEU 94 -9.432 11.656 -53.502 774 HD13 LEU 94 3HD1 LEU 94 -10.308 12.717 -54.606 775 HD21 LEU 94 3HD2 LEU 94 -9.741 13.210 -51.674 776 HD22 LEU 94 1HD2 LEU 94 -11.358 13.674 -51.142 777 HD23 LEU 94 2HD2 LEU 94 -10.697 14.345 -52.634 778 H GLU 95 H GLU 95 -14.598 12.398 -56.101 779 HA GLU 95 HA GLU 95 -12.559 11.374 -57.759 780 HB2 GLU 95 2HB GLU 95 -13.884 9.698 -58.974 781 HB3 GLU 95 1HB GLU 95 -13.592 9.231 -57.303 782 HG2 GLU 95 2HG GLU 95 -15.833 9.915 -56.694 783 HG3 GLU 95 1HG GLU 95 -16.130 10.465 -58.335 784 H GLU 96 H GLU 96 -12.734 12.056 -59.797 785 HA GLU 96 HA GLU 96 -15.217 12.807 -60.886 786 HB2 GLU 96 2HB GLU 96 -14.490 15.050 -61.761 787 HB3 GLU 96 1HB GLU 96 -14.656 15.023 -60.022 788 HG2 GLU 96 2HG GLU 96 -12.044 14.909 -61.539 789 HG3 GLU 96 1HG GLU 96 -12.752 16.356 -60.839 790 H ALA 97 H ALA 97 -15.114 11.218 -62.209 791 HA ALA 97 HA ALA 97 -12.756 11.018 -63.969 792 HB1 ALA 97 1HB ALA 97 -14.400 8.765 -62.834 793 HB2 ALA 97 2HB ALA 97 -12.800 9.255 -62.283 794 HB3 ALA 97 3HB ALA 97 -13.012 8.604 -63.908 795 H LYS 98 H LYS 98 -15.594 12.208 -64.282 796 HA LYS 98 HA LYS 98 -16.226 10.649 -66.677 797 HB2 LYS 98 2HB LYS 98 -18.080 12.395 -65.079 798 HB3 LYS 98 1HB LYS 98 -18.507 11.631 -66.599 799 HG2 LYS 98 2HG LYS 98 -18.124 9.420 -65.550 800 HG3 LYS 98 1HG LYS 98 -17.812 10.236 -64.017 801 HD2 LYS 98 2HD LYS 98 -20.379 10.401 -65.604 802 HD3 LYS 98 1HD LYS 98 -20.127 9.403 -64.171 803 HE2 LYS 98 2HE LYS 98 -19.952 12.422 -64.275 804 HE3 LYS 98 1HE LYS 98 -21.317 11.497 -63.676 805 HZ1 LYS 98 3HZ LYS 98 -19.887 12.267 -61.881 806 HZ2 LYS 98 1HZ LYS 98 -18.579 11.418 -62.501 807 HZ3 LYS 98 2HZ LYS 98 -19.934 10.599 -61.924 808 H LYS 99 H LYS 99 -14.953 11.585 -68.131 809 HA LYS 99 HA LYS 99 -15.812 14.239 -68.987 810 HB2 LYS 99 2HB LYS 99 -13.550 14.385 -67.846 811 HB3 LYS 99 1HB LYS 99 -12.926 13.257 -69.025 812 HG2 LYS 99 2HG LYS 99 -14.033 15.990 -69.746 813 HG3 LYS 99 1HG LYS 99 -12.348 15.697 -69.371 814 HD2 LYS 99 2HD LYS 99 -13.869 14.395 -71.648 815 HD3 LYS 99 1HD LYS 99 -12.827 15.807 -71.815 816 HE2 LYS 99 2HE LYS 99 -10.917 14.467 -71.015 817 HE3 LYS 99 1HE LYS 99 -11.964 13.059 -70.880 818 HZ1 LYS 99 3HZ LYS 99 -11.276 14.493 -73.399 819 HZ2 LYS 99 1HZ LYS 99 -12.338 13.187 -73.288 820 HZ3 LYS 99 2HZ LYS 99 -10.719 12.986 -72.920 821 H VAL 100 H VAL 100 -17.068 13.519 -70.593 822 HA VAL 100 HA VAL 100 -15.745 11.990 -72.696 823 HB VAL 100 HB VAL 100 -17.854 10.720 -73.129 824 HG11 VAL 100 1HG1 VAL 100 -16.056 9.657 -71.874 825 HG12 VAL 100 2HG1 VAL 100 -17.628 9.126 -71.276 826 HG13 VAL 100 3HG1 VAL 100 -16.698 10.318 -70.369 827 HG21 VAL 100 3HG2 VAL 100 -19.566 10.610 -71.380 828 HG22 VAL 100 1HG2 VAL 100 -19.431 12.236 -72.050 829 HG23 VAL 100 2HG2 VAL 100 -18.723 11.867 -70.476 830 H GLN 101 H GLN 101 -16.865 12.137 -74.773 831 HA GLN 101 HA GLN 101 -18.630 14.416 -75.129 832 HB2 GLN 101 2HB GLN 101 -17.230 15.311 -76.946 833 HB3 GLN 101 1HB GLN 101 -16.374 15.353 -75.414 834 HG2 GLN 101 2HG GLN 101 -15.135 13.353 -76.050 835 HG3 GLN 101 1HG GLN 101 -16.004 13.307 -77.584 836 HE21 GLN 101 1HE2 GLN 101 -14.138 13.523 -78.773 837 HE22 GLN 101 2HE2 GLN 101 -13.270 15.010 -78.866 838 H ILE 102 H ILE 102 -19.068 14.416 -77.706 839 HA ILE 102 HA ILE 102 -19.059 11.682 -78.629 840 HB ILE 102 HB ILE 102 -21.225 11.811 -77.585 841 HG12 ILE 102 2HG1 ILE 102 -22.771 11.462 -79.521 842 HG13 ILE 102 1HG1 ILE 102 -21.524 12.098 -80.584 843 HG21 ILE 102 1HG2 ILE 102 -21.739 14.329 -79.131 844 HG22 ILE 102 2HG2 ILE 102 -21.539 14.170 -77.385 845 HG23 ILE 102 3HG2 ILE 102 -22.943 13.457 -78.183 846 HD11 ILE 102 3HD1 ILE 102 -21.310 9.604 -78.903 847 HD12 ILE 102 1HD1 ILE 102 -20.059 10.234 -79.977 848 HD13 ILE 102 2HD1 ILE 102 -21.591 9.670 -80.640 849 H GLU 103 H GLU 103 -17.873 11.845 -80.384 850 HA GLU 103 HA GLU 103 -18.256 14.111 -82.154 851 HB2 GLU 103 2HB GLU 103 -16.265 11.838 -82.238 852 HB3 GLU 103 1HB GLU 103 -16.341 13.150 -83.401 853 HG2 GLU 103 2HG GLU 103 -15.844 14.747 -81.610 854 HG3 GLU 103 1HG GLU 103 -15.721 13.408 -80.466 855 H LEU 104 H LEU 104 -19.528 13.954 -83.860 856 HA LEU 104 HA LEU 104 -20.675 11.391 -84.459 857 HB2 LEU 104 2HB LEU 104 -21.209 14.071 -85.746 858 HB3 LEU 104 1HB LEU 104 -22.128 12.608 -86.018 859 HG LEU 104 HG LEU 104 -21.976 14.154 -83.428 860 HD11 LEU 104 1HD1 LEU 104 -23.334 15.259 -85.100 861 HD12 LEU 104 2HD1 LEU 104 -24.349 14.587 -83.823 862 HD13 LEU 104 3HD1 LEU 104 -24.234 13.771 -85.380 863 HD21 LEU 104 3HD2 LEU 104 -22.157 11.774 -82.967 864 HD22 LEU 104 1HD2 LEU 104 -23.503 11.641 -84.101 865 HD23 LEU 104 2HD2 LEU 104 -23.685 12.583 -82.622 866 H ASP 105 H ASP 105 -18.992 10.308 -85.222 867 HA ASP 105 HA ASP 105 -17.621 11.187 -87.646 868 HB2 ASP 105 2HB ASP 105 -16.323 10.165 -85.767 869 HB3 ASP 105 1HB ASP 105 -17.254 8.689 -85.957 870 H THR 106 H THR 106 -19.410 8.459 -86.374 871 HA THR 106 HA THR 106 -20.769 6.913 -87.157 872 HB THR 106 HB THR 106 -22.405 7.501 -88.891 873 HG1 THR 106 1HG THR 106 -20.549 9.395 -89.476 874 HG21 THR 106 3HG2 THR 106 -23.461 9.362 -87.647 875 HG22 THR 106 1HG2 THR 106 -21.936 9.633 -86.800 876 HG23 THR 106 2HG2 THR 106 -22.815 8.122 -86.571 877 H SER 107 H SER 107 -21.496 5.503 -88.983 878 HA SER 107 HA SER 107 -19.213 4.449 -90.292 879 HB2 SER 107 2HB SER 107 -22.143 3.847 -90.750 880 HB3 SER 107 1HB SER 107 -20.785 2.830 -91.238 881 HG SER 107 HG SER 107 -20.375 3.205 -88.739 882 H LEU 108 H LEU 108 -21.408 6.921 -91.092 883 HA LEU 108 HA LEU 108 -21.763 8.250 -92.807 884 HB2 LEU 108 2HB LEU 108 -19.337 8.532 -92.976 885 HB3 LEU 108 1HB LEU 108 -19.221 7.065 -93.926 886 HG LEU 108 HG LEU 108 -20.442 8.133 -95.748 887 HD11 LEU 108 1HD1 LEU 108 -20.833 10.552 -95.740 888 HD12 LEU 108 2HD1 LEU 108 -20.310 10.625 -94.060 889 HD13 LEU 108 3HD1 LEU 108 -21.773 9.736 -94.489 890 HD21 LEU 108 3HD2 LEU 108 -18.012 8.194 -95.742 891 HD22 LEU 108 1HD2 LEU 108 -18.039 9.683 -94.801 892 HD23 LEU 108 2HD2 LEU 108 -18.664 9.669 -96.453 893 H SER 109 H SER 109 -23.646 7.331 -93.288 894 HA SER 109 HA SER 109 -23.735 6.076 -95.887 895 HB2 SER 109 2HB SER 109 -25.136 4.946 -93.450 896 HB3 SER 109 1HB SER 109 -25.315 4.363 -95.102 897 HG SER 109 HG SER 109 -22.729 4.417 -94.554 898 H TYR 110 H TYR 110 -25.904 6.313 -96.808 899 HA TYR 110 HA TYR 110 -27.747 8.030 -95.403 900 HB2 TYR 110 2HB TYR 110 -26.187 9.585 -96.567 901 HB3 TYR 110 1HB TYR 110 -26.513 8.764 -98.083 902 HD1 TYR 110 2HD TYR 110 -27.953 10.929 -95.466 903 HD2 TYR 110 1HD TYR 110 -28.477 9.263 -99.346 904 HE1 TYR 110 2HE TYR 110 -29.828 12.460 -95.868 905 HE2 TYR 110 1HE TYR 110 -30.346 10.785 -99.757 906 HH TYR 110 HH TYR 110 -30.973 13.445 -97.748 907 H ILE 111 H ILE 111 -29.848 7.641 -96.144 908 HA ILE 111 HA ILE 111 -30.101 6.022 -98.509 909 HB ILE 111 HB ILE 111 -29.927 4.340 -96.806 910 HG12 ILE 111 2HG1 ILE 111 -32.137 3.185 -96.973 911 HG13 ILE 111 1HG1 ILE 111 -32.815 4.663 -97.641 912 HG21 ILE 111 1HG2 ILE 111 -32.077 5.751 -95.272 913 HG22 ILE 111 2HG2 ILE 111 -30.381 5.559 -94.822 914 HG23 ILE 111 3HG2 ILE 111 -31.442 4.150 -94.891 915 HD11 ILE 111 3HD1 ILE 111 -31.293 4.492 -99.549 916 HD12 ILE 111 1HD1 ILE 111 -32.299 3.056 -99.382 917 HD13 ILE 111 2HD1 ILE 111 -30.614 3.014 -98.867
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