NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
464455 | 2kjq | 16336 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 -5.839 -7.443 -18.432 2 H2 MET 1 H2 MET 1 -5.507 -5.871 -17.891 3 H3 MET 1 H3 MET 1 -4.649 -7.184 -17.253 4 HA MET 1 HA MET 1 -3.664 -7.634 -19.387 5 HB2 MET 1 2HB MET 1 -3.948 -6.148 -21.253 6 HB3 MET 1 1HB MET 1 -5.542 -6.665 -20.728 7 HG2 MET 1 2HG MET 1 -4.256 -4.029 -20.054 8 HG3 MET 1 1HG MET 1 -5.446 -4.286 -21.326 9 HE1 MET 1 2HE MET 1 -6.936 -2.348 -20.347 10 HE2 MET 1 3HE MET 1 -5.737 -2.073 -19.083 11 HE3 MET 1 1HE MET 1 -7.438 -2.253 -18.661 12 H GLY 2 HN GLY 2 -1.643 -6.771 -19.843 13 HA2 GLY 2 2HA GLY 2 -0.365 -4.527 -19.521 14 HA3 GLY 2 1HA GLY 2 -0.758 -4.825 -17.831 15 H HIS 3 HN HIS 3 0.413 -6.249 -16.677 16 HA HIS 3 HA HIS 3 2.036 -7.719 -16.084 17 HB2 HIS 3 2HB HIS 3 0.837 -9.238 -17.616 18 HB3 HIS 3 1HB HIS 3 1.815 -8.658 -18.956 19 HD1 HIS 3 1HD HIS 3 3.659 -10.179 -19.532 20 HD2 HIS 3 2HD HIS 3 2.672 -10.416 -15.497 21 HE1 HIS 3 1HE HIS 3 5.171 -11.943 -18.565 22 HE2 HIS 3 2HE HIS 3 4.411 -12.211 -16.181 23 H HIS 4 HN HIS 4 2.564 -5.123 -17.813 24 HA HIS 4 HA HIS 4 5.398 -5.710 -18.370 25 HB2 HIS 4 2HB HIS 4 4.093 -4.988 -20.351 26 HB3 HIS 4 1HB HIS 4 3.687 -3.488 -19.521 27 HD1 HIS 4 1HD HIS 4 5.158 -1.577 -20.144 28 HD2 HIS 4 2HD HIS 4 7.105 -5.245 -20.527 29 HE1 HIS 4 1HE HIS 4 7.455 -1.048 -21.022 30 HE2 HIS 4 2HE HIS 4 8.600 -3.277 -21.303 31 H HIS 5 HN HIS 5 6.779 -4.923 -16.944 32 HA HIS 5 HA HIS 5 6.407 -2.212 -15.969 33 HB2 HIS 5 2HB HIS 5 6.576 -2.707 -13.642 34 HB3 HIS 5 1HB HIS 5 5.320 -3.761 -14.272 35 HD1 HIS 5 1HD HIS 5 8.542 -3.758 -12.511 36 HD2 HIS 5 2HD HIS 5 6.137 -6.545 -14.466 37 HE1 HIS 5 1HE HIS 5 9.382 -6.023 -11.782 38 HE2 HIS 5 2HE HIS 5 7.843 -7.691 -12.876 39 H HIS 6 HN HIS 6 8.285 -1.183 -16.170 40 HA HIS 6 HA HIS 6 10.766 -2.700 -15.836 41 HB2 HIS 6 2HB HIS 6 9.850 -1.313 -18.284 42 HB3 HIS 6 1HB HIS 6 11.525 -1.031 -17.821 43 HD1 HIS 6 1HD HIS 6 9.607 -4.312 -17.560 44 HD2 HIS 6 2HD HIS 6 12.857 -2.641 -19.543 45 HE1 HIS 6 1HE HIS 6 10.663 -6.202 -18.837 46 HE2 HIS 6 2HE HIS 6 12.697 -5.196 -19.931 47 H HIS 7 HN HIS 7 12.077 -1.758 -14.503 48 HA HIS 7 HA HIS 7 11.408 0.583 -13.144 49 HB2 HIS 7 2HB HIS 7 13.656 0.405 -12.090 50 HB3 HIS 7 1HB HIS 7 12.738 -1.091 -12.044 51 HD1 HIS 7 1HD HIS 7 15.987 0.256 -12.951 52 HD2 HIS 7 2HD HIS 7 13.670 -3.022 -14.060 53 HE1 HIS 7 1HE HIS 7 17.569 -1.358 -14.061 54 HE2 HIS 7 2HE HIS 7 16.121 -3.264 -14.854 55 H HIS 8 HN HIS 8 11.199 2.387 -14.277 56 HA HIS 8 HA HIS 8 13.629 3.471 -15.535 57 HB2 HIS 8 2HB HIS 8 10.710 4.026 -16.084 58 HB3 HIS 8 1HB HIS 8 11.994 5.086 -16.651 59 HD1 HIS 8 1HD HIS 8 10.398 1.772 -17.305 60 HD2 HIS 8 2HD HIS 8 13.561 4.055 -18.739 61 HE1 HIS 8 1HE HIS 8 11.058 0.722 -19.493 62 HE2 HIS 8 2HE HIS 8 12.819 2.260 -20.439 63 H SER 9 HN SER 9 14.601 4.488 -13.864 64 HA SER 9 HA SER 9 13.096 5.710 -11.764 65 HB2 SER 9 2HB SER 9 16.071 5.826 -12.293 66 HB3 SER 9 1HB SER 9 15.258 6.180 -10.767 67 HG SER 9 HG SER 9 15.185 4.121 -10.359 68 H HIS 10 HN HIS 10 11.914 7.352 -12.712 69 HA HIS 10 HA HIS 10 13.414 9.838 -12.971 70 HB2 HIS 10 2HB HIS 10 11.516 8.784 -15.064 71 HB3 HIS 10 1HB HIS 10 11.817 10.508 -14.877 72 HD1 HIS 10 1HD HIS 10 12.802 7.939 -16.984 73 HD2 HIS 10 2HD HIS 10 14.937 10.788 -14.822 74 HE1 HIS 10 1HE HIS 10 15.053 8.101 -18.103 75 HE2 HIS 10 2HE HIS 10 16.288 9.911 -16.854 76 H MET 11 HN MET 11 11.483 11.621 -13.370 77 HA MET 11 HA MET 11 9.814 12.787 -12.391 78 HB2 MET 11 2HB MET 11 8.307 10.990 -13.035 79 HB3 MET 11 1HB MET 11 8.761 10.058 -11.617 80 HG2 MET 11 2HG MET 11 6.590 11.101 -11.328 81 HG3 MET 11 1HG MET 11 7.757 11.738 -10.171 82 HE1 MET 11 3HE MET 11 4.941 13.100 -10.814 83 HE2 MET 11 1HE MET 11 5.410 14.799 -10.887 84 HE3 MET 11 2HE MET 11 6.092 13.749 -9.646 85 H ASP 12 HN ASP 12 11.603 13.492 -11.088 86 HA ASP 12 HA ASP 12 11.343 12.681 -8.271 87 HB2 ASP 12 2HB ASP 12 13.662 13.572 -7.993 88 HB3 ASP 12 1HB ASP 12 13.569 12.198 -9.088 89 H TYR 13 HN TYR 13 10.017 14.762 -10.112 90 HA TYR 13 HA TYR 13 10.522 17.139 -8.456 91 HB2 TYR 13 2HB TYR 13 9.096 16.995 -11.125 92 HB3 TYR 13 1HB TYR 13 9.544 18.453 -10.245 93 HD1 TYR 13 1HD TYR 13 12.129 18.685 -9.742 94 HD2 TYR 13 2HD TYR 13 10.472 16.264 -12.822 95 HE1 TYR 13 1HE TYR 13 14.275 18.755 -10.941 96 HE2 TYR 13 2HE TYR 13 12.612 16.325 -14.029 97 HH TYR 13 HH TYR 13 15.476 17.283 -12.662 98 HA PRO 14 HA PRO 14 6.667 16.304 -6.427 99 HB2 PRO 14 2HB PRO 14 6.672 19.218 -5.888 100 HB3 PRO 14 1HB PRO 14 6.613 17.865 -4.753 101 HG2 PRO 14 2HG PRO 14 8.832 19.326 -5.043 102 HG3 PRO 14 1HG PRO 14 8.913 17.574 -4.777 103 HD2 PRO 14 2HD PRO 14 9.253 19.124 -7.312 104 HD3 PRO 14 1HD PRO 14 10.146 17.704 -6.730 105 H SER 15 HN SER 15 6.826 19.416 -8.149 106 HA SER 15 HA SER 15 5.425 20.486 -9.559 107 HB2 SER 15 2HB SER 15 4.489 17.680 -10.202 108 HB3 SER 15 1HB SER 15 4.142 19.115 -11.166 109 HG SER 15 HG SER 15 6.629 19.286 -11.057 110 H PHE 16 HN PHE 16 4.297 21.553 -7.896 111 HA PHE 16 HA PHE 16 1.470 20.977 -7.937 112 HB2 PHE 16 2HB PHE 16 1.160 20.835 -5.527 113 HB3 PHE 16 1HB PHE 16 2.245 19.557 -6.055 114 HD1 PHE 16 2HD PHE 16 4.665 19.722 -5.578 115 HD2 PHE 16 1HD PHE 16 1.871 22.521 -4.012 116 HE1 PHE 16 2HE PHE 16 6.329 20.445 -3.922 117 HE2 PHE 16 1HE PHE 16 3.533 23.250 -2.349 118 HZ PHE 16 HZ PHE 16 5.765 22.213 -2.303 119 H ASP 17 HN ASP 17 0.190 22.725 -7.115 120 HA ASP 17 HA ASP 17 1.468 25.058 -6.047 121 HB2 ASP 17 2HB ASP 17 0.741 26.619 -7.793 122 HB3 ASP 17 1HB ASP 17 1.874 25.439 -8.435 123 H LYS 18 HN LYS 18 -0.125 26.725 -5.476 124 HA LYS 18 HA LYS 18 -2.252 25.621 -4.051 125 HB2 LYS 18 2HB LYS 18 -2.990 28.052 -3.836 126 HB3 LYS 18 1HB LYS 18 -1.368 27.662 -3.278 127 HG2 LYS 18 2HG LYS 18 -0.570 28.422 -5.574 128 HG3 LYS 18 1HG LYS 18 -2.185 29.106 -5.775 129 HD2 LYS 18 2HD LYS 18 -1.892 30.571 -3.943 130 HD3 LYS 18 1HD LYS 18 -0.436 29.726 -3.410 131 HE2 LYS 18 2HE LYS 18 -0.771 31.398 -5.897 132 HE3 LYS 18 1HE LYS 18 0.211 31.776 -4.483 133 HZ1 LYS 18 3HZ LYS 18 1.769 30.946 -5.935 134 HZ2 LYS 18 1HZ LYS 18 0.706 29.808 -6.612 135 HZ3 LYS 18 2HZ LYS 18 1.360 29.544 -5.073 136 H PHE 19 HN PHE 19 -4.387 25.331 -4.439 137 HA PHE 19 HA PHE 19 -5.126 25.028 -7.154 138 HB2 PHE 19 2HB PHE 19 -5.890 23.588 -5.191 139 HB3 PHE 19 1HB PHE 19 -7.021 24.880 -4.809 140 HD1 PHE 19 1HD PHE 19 -6.175 22.210 -7.145 141 HD2 PHE 19 2HD PHE 19 -8.945 25.309 -6.221 142 HE1 PHE 19 1HE PHE 19 -7.790 21.235 -8.727 143 HE2 PHE 19 2HE PHE 19 -10.559 24.342 -7.802 144 HZ PHE 19 HZ PHE 19 -9.986 22.303 -9.055 145 H LEU 20 HN LEU 20 -7.039 28.376 -5.716 146 HA LEU 20 HA LEU 20 -6.613 25.982 -4.105 147 HB2 LEU 20 2HB LEU 20 -5.843 27.426 -2.279 148 HB3 LEU 20 1HB LEU 20 -4.752 27.461 -3.641 149 HG LEU 20 HG LEU 20 -6.811 29.621 -3.245 150 HD11 LEU 20 1HD1 LEU 20 -5.128 30.913 -2.038 151 HD12 LEU 20 2HD1 LEU 20 -4.039 29.526 -2.056 152 HD13 LEU 20 3HD1 LEU 20 -5.554 29.446 -1.158 153 HD21 LEU 20 3HD2 LEU 20 -5.652 29.510 -5.406 154 HD22 LEU 20 1HD2 LEU 20 -4.098 29.590 -4.576 155 HD23 LEU 20 2HD2 LEU 20 -5.209 30.959 -4.505 156 H GLY 21 HN GLY 21 -8.973 26.518 -5.239 157 HA2 GLY 21 2HA GLY 21 -10.572 28.524 -4.085 158 HA3 GLY 21 1HA GLY 21 -11.146 27.183 -5.053 159 H THR 22 HN THR 22 -9.554 25.795 -2.517 160 HA THR 22 HA THR 22 -10.119 24.944 -0.481 161 HB THR 22 HB THR 22 -12.288 27.031 -0.272 162 HG1 THR 22 1HG THR 22 -9.713 27.508 -0.770 163 HG21 THR 22 3HG2 THR 22 -11.649 27.006 2.105 164 HG22 THR 22 1HG2 THR 22 -10.433 25.775 1.756 165 HG23 THR 22 2HG2 THR 22 -12.146 25.408 1.547 166 H GLU 23 HN GLU 23 -11.424 24.079 -2.956 167 HA GLU 23 HA GLU 23 -14.161 23.466 -2.411 168 HB2 GLU 23 2HB GLU 23 -12.189 22.431 -4.437 169 HB3 GLU 23 1HB GLU 23 -13.823 21.802 -4.316 170 HG2 GLU 23 2HG GLU 23 -14.675 24.095 -4.730 171 HG3 GLU 23 1HG GLU 23 -13.007 24.615 -4.994 172 H ASN 24 HN ASN 24 -14.980 21.234 -2.352 173 HA ASN 24 HA ASN 24 -13.416 19.529 -0.581 174 HB2 ASN 24 2HB ASN 24 -15.912 19.990 -0.280 175 HB3 ASN 24 1HB ASN 24 -16.175 19.006 -1.715 176 HD21 ASN 24 1HD2 ASN 24 -17.388 17.533 -0.543 177 HD22 ASN 24 2HD2 ASN 24 -16.644 16.393 0.531 178 H ALA 25 HN ALA 25 -13.143 20.160 -3.599 179 HA ALA 25 HA ALA 25 -13.498 17.840 -5.118 180 HB1 ALA 25 1HB ALA 25 -13.130 20.051 -6.097 181 HB2 ALA 25 2HB ALA 25 -11.970 18.874 -6.715 182 HB3 ALA 25 3HB ALA 25 -11.474 20.044 -5.492 183 H GLU 26 HN GLU 26 -11.180 18.573 -2.703 184 HA GLU 26 HA GLU 26 -9.013 17.007 -3.494 185 HB2 GLU 26 2HB GLU 26 -10.041 17.471 -0.688 186 HB3 GLU 26 1HB GLU 26 -8.434 16.890 -1.110 187 HG2 GLU 26 2HG GLU 26 -8.036 19.015 -2.320 188 HG3 GLU 26 1HG GLU 26 -9.600 19.593 -1.746 189 H LEU 27 HN LEU 27 -12.113 16.142 -2.163 190 HA LEU 27 HA LEU 27 -11.489 13.419 -1.601 191 HB2 LEU 27 2HB LEU 27 -13.342 14.442 -0.486 192 HB3 LEU 27 1HB LEU 27 -14.073 14.917 -2.007 193 HG LEU 27 HG LEU 27 -14.414 12.516 -2.532 194 HD11 LEU 27 1HD1 LEU 27 -14.247 10.877 -0.732 195 HD12 LEU 27 2HD1 LEU 27 -13.560 12.109 0.326 196 HD13 LEU 27 3HD1 LEU 27 -12.674 11.581 -1.105 197 HD21 LEU 27 3HD2 LEU 27 -16.208 13.887 -1.603 198 HD22 LEU 27 1HD2 LEU 27 -15.674 13.482 0.028 199 HD23 LEU 27 2HD2 LEU 27 -16.313 12.223 -1.029 200 H VAL 28 HN VAL 28 -12.722 15.208 -4.355 201 HA VAL 28 HA VAL 28 -13.467 12.971 -5.932 202 HB VAL 28 HB VAL 28 -12.672 15.734 -6.877 203 HG11 VAL 28 1HG1 VAL 28 -14.040 15.228 -8.836 204 HG12 VAL 28 2HG1 VAL 28 -14.357 13.612 -8.207 205 HG13 VAL 28 3HG1 VAL 28 -12.718 14.071 -8.670 206 HG21 VAL 28 3HG2 VAL 28 -15.387 14.660 -6.112 207 HG22 VAL 28 1HG2 VAL 28 -15.075 16.239 -6.832 208 HG23 VAL 28 2HG2 VAL 28 -14.454 15.865 -5.224 209 H TYR 29 HN TYR 29 -10.482 14.771 -5.490 210 HA TYR 29 HA TYR 29 -9.035 13.529 -7.599 211 HB2 TYR 29 2HB TYR 29 -8.269 15.633 -6.624 212 HB3 TYR 29 1HB TYR 29 -8.043 14.851 -5.064 213 HD1 TYR 29 2HD TYR 29 -6.864 14.698 -8.602 214 HD2 TYR 29 1HD TYR 29 -5.967 13.952 -4.508 215 HE1 TYR 29 2HE TYR 29 -4.554 14.119 -9.220 216 HE2 TYR 29 1HE TYR 29 -3.657 13.367 -5.114 217 HH TYR 29 HH TYR 29 -2.328 14.013 -8.185 218 H VAL 30 HN VAL 30 -9.835 12.620 -4.353 219 HA VAL 30 HA VAL 30 -7.959 10.466 -4.188 220 HB VAL 30 HB VAL 30 -10.476 10.997 -2.590 221 HG11 VAL 30 1HG1 VAL 30 -9.908 8.618 -2.576 222 HG12 VAL 30 2HG1 VAL 30 -9.634 9.359 -0.998 223 HG13 VAL 30 3HG1 VAL 30 -8.270 9.013 -2.061 224 HG21 VAL 30 3HG2 VAL 30 -7.569 11.441 -1.922 225 HG22 VAL 30 1HG2 VAL 30 -8.934 11.729 -0.843 226 HG23 VAL 30 2HG2 VAL 30 -8.747 12.695 -2.305 227 H LEU 31 HN LEU 31 -11.394 10.761 -4.996 228 HA LEU 31 HA LEU 31 -12.078 8.083 -5.117 229 HB2 LEU 31 2HB LEU 31 -13.123 10.328 -6.836 230 HB3 LEU 31 1HB LEU 31 -13.897 8.770 -6.629 231 HG LEU 31 HG LEU 31 -13.458 10.807 -4.444 232 HD11 LEU 31 1HD1 LEU 31 -15.910 11.036 -4.517 233 HD12 LEU 31 2HD1 LEU 31 -15.941 10.006 -5.949 234 HD13 LEU 31 3HD1 LEU 31 -15.127 11.569 -6.003 235 HD21 LEU 31 3HD2 LEU 31 -14.897 9.354 -3.102 236 HD22 LEU 31 1HD2 LEU 31 -13.411 8.535 -3.582 237 HD23 LEU 31 2HD2 LEU 31 -14.924 8.174 -4.412 238 H ARG 32 HN ARG 32 -10.790 6.651 -6.105 239 HA ARG 32 HA ARG 32 -10.529 6.890 -9.026 240 HB2 ARG 32 2HB ARG 32 -8.456 6.271 -7.003 241 HB3 ARG 32 1HB ARG 32 -8.467 5.231 -8.420 242 HG2 ARG 32 2HG ARG 32 -6.926 7.042 -8.759 243 HG3 ARG 32 1HG ARG 32 -8.295 7.233 -9.851 244 HD2 ARG 32 2HD ARG 32 -9.286 8.821 -8.204 245 HD3 ARG 32 1HD ARG 32 -7.788 8.717 -7.283 246 HE ARG 32 HE ARG 32 -6.721 9.542 -9.450 247 HH11 ARG 32 1HH1 ARG 32 -9.980 10.356 -8.454 248 HH12 ARG 32 2HH1 ARG 32 -9.959 11.911 -9.224 249 HH21 ARG 32 1HH2 ARG 32 -6.711 11.576 -10.496 250 HH22 ARG 32 2HH2 ARG 32 -8.107 12.612 -10.379 251 H HIS 33 HN HIS 33 -9.493 4.302 -9.461 252 HA HIS 33 HA HIS 33 -11.912 2.740 -8.876 253 HB2 HIS 33 2HB HIS 33 -9.732 2.172 -10.902 254 HB3 HIS 33 1HB HIS 33 -11.247 1.297 -10.732 255 HD1 HIS 33 1HD HIS 33 -10.182 2.893 -13.296 256 HD2 HIS 33 2HD HIS 33 -13.105 4.144 -10.614 257 HE1 HIS 33 1HE HIS 33 -11.587 4.556 -14.552 258 HE2 HIS 33 2HE HIS 33 -13.206 5.457 -12.844 259 H LYS 34 HN LYS 34 -11.513 0.318 -8.644 260 HA LYS 34 HA LYS 34 -9.544 -0.089 -6.559 261 HB2 LYS 34 2HB LYS 34 -10.533 -2.309 -6.318 262 HB3 LYS 34 1HB LYS 34 -11.779 -1.071 -6.323 263 HG2 LYS 34 2HG LYS 34 -12.333 -1.600 -8.625 264 HG3 LYS 34 1HG LYS 34 -11.029 -2.788 -8.680 265 HD2 LYS 34 2HD LYS 34 -12.137 -4.055 -6.884 266 HD3 LYS 34 1HD LYS 34 -13.462 -2.888 -6.899 267 HE2 LYS 34 2HE LYS 34 -13.967 -3.472 -9.207 268 HE3 LYS 34 1HE LYS 34 -12.614 -4.603 -9.234 269 HZ1 LYS 34 3HZ LYS 34 -13.717 -5.887 -7.492 270 HZ2 LYS 34 1HZ LYS 34 -14.699 -5.757 -8.870 271 HZ3 LYS 34 2HZ LYS 34 -15.023 -4.810 -7.500 272 H HIS 35 HN HIS 35 -8.530 -2.503 -6.756 273 HA HIS 35 HA HIS 35 -7.487 -3.091 -9.359 274 HB2 HIS 35 2HB HIS 35 -5.069 -2.710 -8.643 275 HB3 HIS 35 1HB HIS 35 -6.010 -1.276 -9.022 276 HD1 HIS 35 1HD HIS 35 -5.908 0.537 -7.360 277 HD2 HIS 35 2HD HIS 35 -4.918 -3.153 -5.700 278 HE1 HIS 35 1HE HIS 35 -5.172 1.024 -4.999 279 HE2 HIS 35 2HE HIS 35 -4.799 -1.243 -3.962 280 H GLY 36 HN GLY 36 -5.146 -4.452 -8.552 281 HA2 GLY 36 2HA GLY 36 -6.222 -6.948 -7.983 282 HA3 GLY 36 1HA GLY 36 -4.521 -6.538 -7.882 283 H GLN 37 HN GLN 37 -5.538 -8.421 -6.271 284 HA GLN 37 HA GLN 37 -6.625 -7.530 -3.819 285 HB2 GLN 37 2HB GLN 37 -6.806 -9.837 -4.821 286 HB3 GLN 37 1HB GLN 37 -5.141 -10.109 -4.334 287 HG2 GLN 37 2HG GLN 37 -5.739 -9.836 -2.007 288 HG3 GLN 37 1HG GLN 37 -7.401 -9.457 -2.456 289 HE21 GLN 37 1HE2 GLN 37 -6.443 -11.569 -0.746 290 HE22 GLN 37 2HE2 GLN 37 -6.964 -13.056 -1.463 291 H PHE 38 HN PHE 38 -3.362 -8.765 -4.582 292 HA PHE 38 HA PHE 38 -2.349 -7.267 -2.255 293 HB2 PHE 38 2HB PHE 38 -1.197 -9.755 -3.540 294 HB3 PHE 38 1HB PHE 38 -0.475 -8.882 -2.196 295 HD1 PHE 38 2HD PHE 38 -2.000 -8.628 -0.083 296 HD2 PHE 38 1HD PHE 38 -2.549 -11.564 -3.112 297 HE1 PHE 38 2HE PHE 38 -3.261 -10.027 1.504 298 HE2 PHE 38 1HE PHE 38 -3.815 -12.963 -1.537 299 HZ PHE 38 HZ PHE 38 -4.171 -12.198 0.776 300 H ILE 39 HN ILE 39 -1.579 -5.395 -3.070 301 HA ILE 39 HA ILE 39 0.142 -5.578 -5.455 302 HB ILE 39 HB ILE 39 -1.761 -3.331 -4.782 303 HG12 ILE 39 2HG1 ILE 39 -2.919 -5.285 -5.672 304 HG13 ILE 39 1HG1 ILE 39 -2.899 -3.997 -6.870 305 HG21 ILE 39 1HG2 ILE 39 -1.071 -2.372 -6.940 306 HG22 ILE 39 2HG2 ILE 39 0.142 -3.641 -7.104 307 HG23 ILE 39 3HG2 ILE 39 0.267 -2.464 -5.795 308 HD11 ILE 39 3HD1 ILE 39 -1.096 -6.401 -6.833 309 HD12 ILE 39 1HD1 ILE 39 -1.073 -5.114 -8.038 310 HD13 ILE 39 2HD1 ILE 39 -2.488 -6.156 -7.886 311 H TYR 40 HN TYR 40 2.088 -4.781 -5.285 312 HA TYR 40 HA TYR 40 2.714 -2.934 -3.077 313 HB2 TYR 40 2HB TYR 40 3.756 -5.180 -2.859 314 HB3 TYR 40 1HB TYR 40 4.527 -4.956 -4.424 315 HD1 TYR 40 2HD TYR 40 6.300 -3.203 -4.672 316 HD2 TYR 40 1HD TYR 40 4.679 -4.263 -0.888 317 HE1 TYR 40 2HE TYR 40 8.247 -2.198 -3.562 318 HE2 TYR 40 1HE TYR 40 6.625 -3.263 0.232 319 HH TYR 40 HH TYR 40 8.781 -1.223 -1.304 320 H VAL 41 HN VAL 41 3.290 -0.954 -3.729 321 HA VAL 41 HA VAL 41 4.405 -0.653 -6.444 322 HB VAL 41 HB VAL 41 3.395 1.614 -6.514 323 HG11 VAL 41 1HG1 VAL 41 2.270 -0.249 -7.598 324 HG12 VAL 41 2HG1 VAL 41 1.091 0.880 -6.928 325 HG13 VAL 41 3HG1 VAL 41 1.433 -0.637 -6.096 326 HG21 VAL 41 3HG2 VAL 41 1.980 0.734 -3.997 327 HG22 VAL 41 1HG2 VAL 41 1.620 2.194 -4.919 328 HG23 VAL 41 2HG2 VAL 41 3.182 2.018 -4.120 329 H TRP 42 HN TRP 42 5.956 1.032 -6.735 330 HA TRP 42 HA TRP 42 7.055 2.224 -4.318 331 HB2 TRP 42 2HB TRP 42 9.359 1.499 -4.904 332 HB3 TRP 42 1HB TRP 42 8.308 0.157 -4.476 333 HD1 TRP 42 1HD TRP 42 7.155 -1.039 -6.871 334 HE1 TRP 42 1HE TRP 42 8.468 -1.744 -8.967 335 HE3 TRP 42 3HE TRP 42 11.330 1.847 -6.230 336 HZ2 TRP 42 2HZ TRP 42 10.944 -1.166 -10.184 337 HZ3 TRP 42 3HZ TRP 42 13.125 1.705 -7.908 338 HH2 TRP 42 2HH TRP 42 12.934 0.230 -9.841 339 H GLY 43 HN GLY 43 7.093 4.324 -4.752 340 HA2 GLY 43 2HA GLY 43 8.290 6.105 -5.854 341 HA3 GLY 43 1HA GLY 43 8.240 5.163 -7.335 342 H GLU 44 HN GLU 44 5.993 4.761 -8.225 343 HA GLU 44 HA GLU 44 4.967 7.239 -8.959 344 HB2 GLU 44 2HB GLU 44 3.673 4.527 -9.205 345 HB3 GLU 44 1HB GLU 44 3.113 5.977 -10.021 346 HG2 GLU 44 2HG GLU 44 4.359 5.157 -11.699 347 HG3 GLU 44 1HG GLU 44 5.656 5.984 -10.840 348 H GLU 45 HN GLU 45 4.046 5.316 -6.225 349 HA GLU 45 HA GLU 45 1.935 7.263 -5.646 350 HB2 GLU 45 2HB GLU 45 0.880 5.249 -6.630 351 HB3 GLU 45 1HB GLU 45 1.584 4.277 -5.346 352 HG2 GLU 45 2HG GLU 45 -0.736 4.753 -4.880 353 HG3 GLU 45 1HG GLU 45 0.304 5.536 -3.691 354 H GLY 46 HN GLY 46 3.728 4.484 -4.347 355 HA2 GLY 46 2HA GLY 46 3.364 5.300 -1.626 356 HA3 GLY 46 1HA GLY 46 4.402 4.001 -2.195 357 H ALA 47 HN ALA 47 4.190 7.530 -2.094 358 HA ALA 47 HA ALA 47 7.023 7.623 -1.337 359 HB1 ALA 47 1HB ALA 47 7.435 9.481 -2.886 360 HB2 ALA 47 2HB ALA 47 5.798 9.317 -3.519 361 HB3 ALA 47 3HB ALA 47 6.966 8.017 -3.751 362 H GLY 48 HN GLY 48 4.389 7.959 0.004 363 HA2 GLY 48 2HA GLY 48 3.802 9.321 1.819 364 HA3 GLY 48 1HA GLY 48 4.920 10.547 1.235 365 H LYS 49 HN LYS 49 2.488 8.991 -0.744 366 HA LYS 49 HA LYS 49 0.982 11.526 -0.814 367 HB2 LYS 49 2HB LYS 49 1.537 9.578 -3.064 368 HB3 LYS 49 1HB LYS 49 0.339 10.864 -3.164 369 HG2 LYS 49 2HG LYS 49 3.296 11.249 -2.713 370 HG3 LYS 49 1HG LYS 49 2.435 11.501 -4.235 371 HD2 LYS 49 2HD LYS 49 1.144 13.290 -3.268 372 HD3 LYS 49 1HD LYS 49 1.821 12.970 -1.671 373 HE2 LYS 49 2HE LYS 49 4.036 13.600 -2.476 374 HE3 LYS 49 1HE LYS 49 3.378 13.893 -4.085 375 HZ1 LYS 49 3HZ LYS 49 2.064 15.683 -3.245 376 HZ2 LYS 49 1HZ LYS 49 3.666 15.928 -2.737 377 HZ3 LYS 49 2HZ LYS 49 2.507 15.343 -1.643 378 H SER 50 HN SER 50 0.579 8.107 -1.731 379 HA SER 50 HA SER 50 -0.840 6.499 -1.016 380 HB2 SER 50 2HB SER 50 -1.539 8.324 1.284 381 HB3 SER 50 1HB SER 50 -1.587 6.561 1.244 382 HG SER 50 HG SER 50 0.760 6.689 0.888 383 H HIS 51 HN HIS 51 -1.897 8.954 -2.589 384 HA HIS 51 HA HIS 51 -4.599 9.243 -1.714 385 HB2 HIS 51 2HB HIS 51 -4.950 10.324 -4.001 386 HB3 HIS 51 1HB HIS 51 -3.832 11.111 -2.901 387 HD1 HIS 51 1HD HIS 51 -1.588 11.629 -3.785 388 HD2 HIS 51 2HD HIS 51 -3.590 8.841 -6.130 389 HE1 HIS 51 1HE HIS 51 -0.147 11.292 -5.822 390 HE2 HIS 51 2HE HIS 51 -1.240 9.391 -7.061 391 H LEU 52 HN LEU 52 -2.976 7.151 -4.028 392 HA LEU 52 HA LEU 52 -5.393 6.073 -5.090 393 HB2 LEU 52 2HB LEU 52 -3.419 5.921 -6.416 394 HB3 LEU 52 1HB LEU 52 -2.520 5.171 -5.111 395 HG LEU 52 HG LEU 52 -4.021 3.208 -5.301 396 HD11 LEU 52 1HD1 LEU 52 -5.285 2.937 -7.407 397 HD12 LEU 52 2HD1 LEU 52 -4.955 4.629 -7.787 398 HD13 LEU 52 3HD1 LEU 52 -5.926 4.214 -6.374 399 HD21 LEU 52 3HD2 LEU 52 -2.428 3.949 -7.749 400 HD22 LEU 52 1HD2 LEU 52 -2.931 2.316 -7.311 401 HD23 LEU 52 2HD2 LEU 52 -1.804 3.197 -6.281 402 H LEU 53 HN LEU 53 -3.293 5.398 -2.388 403 HA LEU 53 HA LEU 53 -4.396 2.893 -1.661 404 HB2 LEU 53 2HB LEU 53 -2.895 4.996 -0.117 405 HB3 LEU 53 1HB LEU 53 -3.537 3.571 0.675 406 HG LEU 53 HG LEU 53 -2.167 2.176 -0.903 407 HD11 LEU 53 1HD1 LEU 53 -0.324 3.206 -2.080 408 HD12 LEU 53 2HD1 LEU 53 -0.846 4.803 -1.551 409 HD13 LEU 53 3HD1 LEU 53 -1.855 3.866 -2.652 410 HD21 LEU 53 3HD2 LEU 53 -0.667 4.094 0.873 411 HD22 LEU 53 1HD2 LEU 53 -0.084 2.530 0.309 412 HD23 LEU 53 2HD2 LEU 53 -1.474 2.614 1.392 413 H GLN 54 HN GLN 54 -5.114 6.225 -0.713 414 HA GLN 54 HA GLN 54 -7.168 5.606 1.124 415 HB2 GLN 54 2HB GLN 54 -6.643 8.110 -0.482 416 HB3 GLN 54 1HB GLN 54 -7.844 7.996 0.798 417 HG2 GLN 54 2HG GLN 54 -6.093 7.502 2.415 418 HG3 GLN 54 1HG GLN 54 -4.880 7.571 1.140 419 HE21 GLN 54 1HE2 GLN 54 -7.603 9.748 1.268 420 HE22 GLN 54 2HE2 GLN 54 -6.701 11.166 1.672 421 H ALA 55 HN ALA 55 -7.160 6.294 -2.334 422 HA ALA 55 HA ALA 55 -9.895 6.339 -2.843 423 HB1 ALA 55 1HB ALA 55 -7.699 5.195 -4.567 424 HB2 ALA 55 2HB ALA 55 -8.208 6.883 -4.523 425 HB3 ALA 55 3HB ALA 55 -9.312 5.644 -5.118 426 H TRP 56 HN TRP 56 -7.643 3.640 -2.771 427 HA TRP 56 HA TRP 56 -9.500 1.644 -3.510 428 HB2 TRP 56 2HB TRP 56 -7.050 1.475 -3.764 429 HB3 TRP 56 1HB TRP 56 -6.885 1.405 -2.017 430 HD1 TRP 56 1HD TRP 56 -8.680 -0.660 -4.780 431 HE1 TRP 56 1HE TRP 56 -8.463 -3.147 -4.137 432 HE3 TRP 56 3HE TRP 56 -6.273 -0.121 -0.312 433 HZ2 TRP 56 2HZ TRP 56 -7.399 -4.665 -2.017 434 HZ3 TRP 56 3HZ TRP 56 -5.685 -2.141 0.965 435 HH2 TRP 56 2HH TRP 56 -6.240 -4.364 0.132 436 H VAL 57 HN VAL 57 -8.346 2.825 -0.400 437 HA VAL 57 HA VAL 57 -9.719 0.969 1.215 438 HB VAL 57 HB VAL 57 -8.776 3.786 1.779 439 HG11 VAL 57 1HG1 VAL 57 -9.083 3.288 4.155 440 HG12 VAL 57 2HG1 VAL 57 -9.850 1.756 3.735 441 HG13 VAL 57 3HG1 VAL 57 -10.619 3.278 3.287 442 HG21 VAL 57 3HG2 VAL 57 -7.020 2.610 3.062 443 HG22 VAL 57 1HG2 VAL 57 -6.991 2.207 1.346 444 HG23 VAL 57 2HG2 VAL 57 -7.674 1.070 2.508 445 H ALA 58 HN ALA 58 -10.621 4.136 -0.069 446 HA ALA 58 HA ALA 58 -13.052 4.383 1.357 447 HB1 ALA 58 1HB ALA 58 -11.856 6.292 0.358 448 HB2 ALA 58 2HB ALA 58 -13.550 6.225 -0.123 449 HB3 ALA 58 3HB ALA 58 -12.296 5.703 -1.247 450 H GLN 59 HN GLN 59 -12.337 3.163 -1.920 451 HA GLN 59 HA GLN 59 -15.052 2.872 -2.648 452 HB2 GLN 59 2HB GLN 59 -14.270 1.513 -4.517 453 HB3 GLN 59 1HB GLN 59 -13.284 2.952 -4.330 454 HG2 GLN 59 2HG GLN 59 -11.703 1.363 -4.765 455 HG3 GLN 59 1HG GLN 59 -11.703 1.377 -3.004 456 HE21 GLN 59 1HE2 GLN 59 -14.266 -0.085 -4.880 457 HE22 GLN 59 2HE2 GLN 59 -13.885 -1.720 -4.472 458 H ALA 60 HN ALA 60 -12.878 0.837 -0.847 459 HA ALA 60 HA ALA 60 -14.577 -1.467 -0.863 460 HB1 ALA 60 1HB ALA 60 -12.172 -1.638 -0.422 461 HB2 ALA 60 2HB ALA 60 -13.124 -2.308 0.901 462 HB3 ALA 60 3HB ALA 60 -12.382 -0.717 1.067 463 H LEU 61 HN LEU 61 -14.043 1.265 1.298 464 HA LEU 61 HA LEU 61 -15.724 0.507 3.398 465 HB2 LEU 61 2HB LEU 61 -14.901 3.207 2.356 466 HB3 LEU 61 1HB LEU 61 -15.898 3.023 3.783 467 HG LEU 61 HG LEU 61 -13.105 1.922 3.451 468 HD11 LEU 61 1HD1 LEU 61 -12.468 3.628 5.067 469 HD12 LEU 61 2HD1 LEU 61 -14.119 4.249 5.077 470 HD13 LEU 61 3HD1 LEU 61 -13.145 4.359 3.610 471 HD21 LEU 61 3HD2 LEU 61 -14.947 1.969 5.842 472 HD22 LEU 61 1HD2 LEU 61 -13.268 1.430 5.846 473 HD23 LEU 61 2HD2 LEU 61 -14.476 0.541 4.920 474 H GLU 62 HN GLU 62 -16.426 2.106 0.345 475 HA GLU 62 HA GLU 62 -19.080 2.870 0.875 476 HB2 GLU 62 2HB GLU 62 -17.772 2.127 -1.735 477 HB3 GLU 62 1HB GLU 62 -19.356 2.874 -1.597 478 HG2 GLU 62 2HG GLU 62 -18.310 4.814 -0.509 479 HG3 GLU 62 1HG GLU 62 -16.729 4.066 -0.756 480 H ALA 63 HN ALA 63 -17.693 -0.205 0.072 481 HA ALA 63 HA ALA 63 -20.229 -1.371 -0.714 482 HB1 ALA 63 1HB ALA 63 -18.957 -3.439 -0.991 483 HB2 ALA 63 2HB ALA 63 -17.540 -2.666 -0.282 484 HB3 ALA 63 3HB ALA 63 -18.177 -2.095 -1.824 485 H GLY 64 HN GLY 64 -19.039 -0.447 2.143 486 HA2 GLY 64 2HA GLY 64 -19.851 -0.883 4.268 487 HA3 GLY 64 1HA GLY 64 -20.759 -2.239 3.612 488 H LYS 65 HN LYS 65 -17.453 -2.159 2.781 489 HA LYS 65 HA LYS 65 -16.962 -4.354 4.651 490 HB2 LYS 65 2HB LYS 65 -15.359 -3.635 2.199 491 HB3 LYS 65 1HB LYS 65 -15.240 -5.105 3.149 492 HG2 LYS 65 2HG LYS 65 -17.553 -4.271 1.415 493 HG3 LYS 65 1HG LYS 65 -16.400 -5.570 1.100 494 HD2 LYS 65 2HD LYS 65 -17.193 -6.768 3.069 495 HD3 LYS 65 1HD LYS 65 -18.325 -5.461 3.422 496 HE2 LYS 65 2HE LYS 65 -19.393 -5.872 1.215 497 HE3 LYS 65 1HE LYS 65 -18.331 -7.262 1.004 498 HZ1 LYS 65 3HZ LYS 65 -20.448 -7.986 1.824 499 HZ2 LYS 65 1HZ LYS 65 -20.378 -6.902 3.130 500 HZ3 LYS 65 2HZ LYS 65 -19.298 -8.205 3.049 501 H ASN 66 HN ASN 66 -14.914 -4.443 5.684 502 HA ASN 66 HA ASN 66 -14.203 -1.841 6.694 503 HB2 ASN 66 2HB ASN 66 -14.461 -4.078 8.005 504 HB3 ASN 66 1HB ASN 66 -12.812 -4.368 7.492 505 HD21 ASN 66 1HD2 ASN 66 -13.935 -3.944 10.151 506 HD22 ASN 66 2HD2 ASN 66 -13.085 -2.597 10.818 507 H ALA 67 HN ALA 67 -12.399 -0.734 6.351 508 HA ALA 67 HA ALA 67 -10.091 -1.876 5.050 509 HB1 ALA 67 1HB ALA 67 -10.164 -0.367 3.114 510 HB2 ALA 67 2HB ALA 67 -11.749 0.208 3.627 511 HB3 ALA 67 3HB ALA 67 -11.540 -1.470 3.126 512 H ALA 68 HN ALA 68 -8.263 -0.640 5.388 513 HA ALA 68 HA ALA 68 -8.521 2.071 6.385 514 HB1 ALA 68 1HB ALA 68 -7.364 -0.094 8.136 515 HB2 ALA 68 2HB ALA 68 -8.885 0.757 8.405 516 HB3 ALA 68 3HB ALA 68 -7.357 1.634 8.487 517 H TYR 69 HN TYR 69 -6.634 3.256 6.223 518 HA TYR 69 HA TYR 69 -4.325 1.837 5.111 519 HB2 TYR 69 2HB TYR 69 -3.788 3.734 3.780 520 HB3 TYR 69 1HB TYR 69 -5.502 3.460 3.544 521 HD1 TYR 69 2HD TYR 69 -7.157 4.998 4.605 522 HD2 TYR 69 1HD TYR 69 -2.967 5.746 4.754 523 HE1 TYR 69 2HE TYR 69 -7.598 7.342 5.213 524 HE2 TYR 69 1HE TYR 69 -3.396 8.087 5.363 525 HH TYR 69 HH TYR 69 -5.111 9.739 5.220 526 H ILE 70 HN ILE 70 -2.369 2.213 6.046 527 HA ILE 70 HA ILE 70 -2.347 4.035 8.361 528 HB ILE 70 HB ILE 70 -1.175 1.244 8.282 529 HG12 ILE 70 2HG1 ILE 70 -3.462 2.378 9.914 530 HG13 ILE 70 1HG1 ILE 70 -3.639 1.311 8.523 531 HG21 ILE 70 1HG2 ILE 70 -0.585 1.626 10.629 532 HG22 ILE 70 2HG2 ILE 70 -1.184 3.281 10.512 533 HG23 ILE 70 3HG2 ILE 70 0.222 2.785 9.571 534 HD11 ILE 70 3HD1 ILE 70 -2.317 0.630 11.140 535 HD12 ILE 70 1HD1 ILE 70 -2.441 -0.442 9.744 536 HD13 ILE 70 2HD1 ILE 70 -3.900 0.082 10.583 537 H ASP 71 HN ASP 71 -0.696 5.391 8.408 538 HA ASP 71 HA ASP 71 1.457 5.240 6.502 539 HB2 ASP 71 2HB ASP 71 0.859 7.130 8.790 540 HB3 ASP 71 1HB ASP 71 2.315 7.254 7.813 541 H ALA 72 HN ALA 72 2.937 3.673 6.904 542 HA ALA 72 HA ALA 72 3.528 2.730 9.525 543 HB1 ALA 72 1HB ALA 72 3.730 1.332 7.521 544 HB2 ALA 72 2HB ALA 72 5.215 1.358 8.470 545 HB3 ALA 72 3HB ALA 72 5.097 2.310 6.988 546 H ALA 73 HN ALA 73 4.293 5.607 8.253 547 HA ALA 73 HA ALA 73 6.763 5.796 9.836 548 HB1 ALA 73 1HB ALA 73 7.496 7.581 8.258 549 HB2 ALA 73 2HB ALA 73 6.097 7.198 7.245 550 HB3 ALA 73 3HB ALA 73 7.356 5.990 7.510 551 H SER 74 HN SER 74 3.693 6.453 10.064 552 HA SER 74 HA SER 74 4.120 8.985 11.466 553 HB2 SER 74 2HB SER 74 3.328 9.695 9.299 554 HB3 SER 74 1HB SER 74 2.009 8.532 9.348 555 HG SER 74 HG SER 74 0.910 10.108 10.168 556 H MET 75 HN MET 75 2.288 6.062 10.991 557 HA MET 75 HA MET 75 1.011 6.470 13.603 558 HB2 MET 75 2HB MET 75 -0.309 5.492 11.065 559 HB3 MET 75 1HB MET 75 -1.017 5.272 12.655 560 HG2 MET 75 2HG MET 75 -0.957 7.750 12.934 561 HG3 MET 75 1HG MET 75 -0.447 7.870 11.254 562 HE1 MET 75 3HE MET 75 -3.555 6.471 9.338 563 HE2 MET 75 1HE MET 75 -2.135 5.557 9.848 564 HE3 MET 75 2HE MET 75 -1.949 7.183 9.190 565 HA PRO 76 HA PRO 76 2.573 2.364 14.210 566 HB2 PRO 76 2HB PRO 76 1.446 1.799 16.567 567 HB3 PRO 76 1HB PRO 76 2.687 3.049 16.417 568 HG2 PRO 76 2HG PRO 76 -0.276 3.333 16.640 569 HG3 PRO 76 1HG PRO 76 1.003 4.312 17.378 570 HD2 PRO 76 2HD PRO 76 -0.404 4.999 15.089 571 HD3 PRO 76 1HD PRO 76 1.184 5.650 15.539 572 H LEU 77 HN LEU 77 1.903 0.158 14.348 573 HA LEU 77 HA LEU 77 -0.741 -0.302 13.217 574 HB2 LEU 77 2HB LEU 77 1.237 -1.367 12.185 575 HB3 LEU 77 1HB LEU 77 1.547 -2.225 13.682 576 HG LEU 77 HG LEU 77 -0.588 -3.426 13.430 577 HD11 LEU 77 1HD1 LEU 77 -1.815 -3.294 11.324 578 HD12 LEU 77 2HD1 LEU 77 -0.759 -1.987 10.787 579 HD13 LEU 77 3HD1 LEU 77 -1.824 -1.748 12.173 580 HD21 LEU 77 3HD2 LEU 77 0.079 -4.823 11.538 581 HD22 LEU 77 1HD2 LEU 77 1.452 -4.419 12.565 582 HD23 LEU 77 2HD2 LEU 77 1.226 -3.583 11.028 583 H THR 78 HN THR 78 -2.285 -1.636 14.170 584 HA THR 78 HA THR 78 -1.828 -2.344 16.978 585 HB THR 78 HB THR 78 -4.201 -1.616 17.428 586 HG1 THR 78 1HG THR 78 -4.377 0.211 15.479 587 HG21 THR 78 3HG2 THR 78 -3.664 0.794 17.576 588 HG22 THR 78 1HG2 THR 78 -2.251 0.523 16.554 589 HG23 THR 78 2HG2 THR 78 -2.341 -0.222 18.151 590 H ASP 79 HN ASP 79 -3.490 -3.879 17.787 591 HA ASP 79 HA ASP 79 -3.839 -6.074 16.025 592 HB2 ASP 79 2HB ASP 79 -5.073 -7.099 17.896 593 HB3 ASP 79 1HB ASP 79 -3.560 -6.386 18.439 594 H ALA 80 HN ALA 80 -5.697 -3.308 16.770 595 HA ALA 80 HA ALA 80 -8.284 -4.122 16.119 596 HB1 ALA 80 1HB ALA 80 -7.747 -1.987 17.188 597 HB2 ALA 80 2HB ALA 80 -8.754 -1.765 15.758 598 HB3 ALA 80 3HB ALA 80 -7.026 -1.418 15.682 599 H ALA 81 HN ALA 81 -5.525 -3.565 14.116 600 HA ALA 81 HA ALA 81 -6.747 -2.909 11.681 601 HB1 ALA 81 1HB ALA 81 -4.201 -4.455 12.126 602 HB2 ALA 81 2HB ALA 81 -4.348 -2.697 12.081 603 HB3 ALA 81 3HB ALA 81 -4.683 -3.649 10.634 604 H PHE 82 HN PHE 82 -6.661 -5.917 13.383 605 HA PHE 82 HA PHE 82 -6.977 -7.646 11.153 606 HB2 PHE 82 2HB PHE 82 -7.424 -7.937 14.098 607 HB3 PHE 82 1HB PHE 82 -7.981 -9.193 12.997 608 HD1 PHE 82 1HD PHE 82 -6.251 -10.184 11.390 609 HD2 PHE 82 2HD PHE 82 -5.233 -7.921 14.843 610 HE1 PHE 82 1HE PHE 82 -4.002 -11.180 11.370 611 HE2 PHE 82 2HE PHE 82 -2.980 -8.910 14.832 612 HZ PHE 82 HZ PHE 82 -2.361 -10.540 13.092 613 H GLU 83 HN GLU 83 -9.118 -5.455 12.611 614 HA GLU 83 HA GLU 83 -11.563 -6.799 12.039 615 HB2 GLU 83 2HB GLU 83 -10.985 -3.856 12.373 616 HB3 GLU 83 1HB GLU 83 -12.588 -4.564 12.309 617 HG2 GLU 83 2HG GLU 83 -12.023 -5.885 14.326 618 HG3 GLU 83 1HG GLU 83 -10.500 -5.006 14.417 619 H ALA 84 HN ALA 84 -9.307 -4.934 10.223 620 HA ALA 84 HA ALA 84 -11.175 -4.249 8.138 621 HB1 ALA 84 1HB ALA 84 -9.447 -2.651 8.794 622 HB2 ALA 84 2HB ALA 84 -9.299 -3.107 7.096 623 HB3 ALA 84 3HB ALA 84 -8.201 -3.795 8.293 624 H GLU 85 HN GLU 85 -11.362 -5.185 6.207 625 HA GLU 85 HA GLU 85 -9.914 -7.678 5.739 626 HB2 GLU 85 2HB GLU 85 -12.442 -7.362 5.416 627 HB3 GLU 85 1HB GLU 85 -12.032 -6.466 3.966 628 HG2 GLU 85 2HG GLU 85 -12.616 -8.775 3.466 629 HG3 GLU 85 1HG GLU 85 -10.948 -8.416 3.021 630 H TYR 86 HN TYR 86 -10.198 -4.431 4.513 631 HA TYR 86 HA TYR 86 -8.131 -4.984 2.486 632 HB2 TYR 86 2HB TYR 86 -10.011 -2.617 2.707 633 HB3 TYR 86 1HB TYR 86 -8.844 -2.880 1.422 634 HD1 TYR 86 1HD TYR 86 -11.844 -4.463 2.992 635 HD2 TYR 86 2HD TYR 86 -9.537 -3.915 -0.539 636 HE1 TYR 86 1HE TYR 86 -13.574 -5.629 1.690 637 HE2 TYR 86 2HE TYR 86 -11.255 -5.086 -1.850 638 HH TYR 86 HH TYR 86 -14.354 -5.752 -0.665 639 H LEU 87 HN LEU 87 -6.134 -4.493 3.181 640 HA LEU 87 HA LEU 87 -5.830 -2.200 5.015 641 HB2 LEU 87 2HB LEU 87 -4.290 -4.776 4.815 642 HB3 LEU 87 1HB LEU 87 -3.595 -3.359 5.574 643 HG LEU 87 HG LEU 87 -4.445 -4.740 7.306 644 HD11 LEU 87 1HD1 LEU 87 -6.378 -2.490 6.809 645 HD12 LEU 87 2HD1 LEU 87 -4.827 -2.378 7.639 646 HD13 LEU 87 3HD1 LEU 87 -6.140 -3.319 8.346 647 HD21 LEU 87 3HD2 LEU 87 -7.057 -4.788 5.808 648 HD22 LEU 87 1HD2 LEU 87 -6.775 -5.480 7.406 649 HD23 LEU 87 2HD2 LEU 87 -5.935 -6.135 6.001 650 H ALA 88 HN ALA 88 -4.501 -0.579 4.473 651 HA ALA 88 HA ALA 88 -2.676 -0.967 2.191 652 HB1 ALA 88 1HB ALA 88 -4.252 1.533 2.810 653 HB2 ALA 88 2HB ALA 88 -4.601 0.396 1.509 654 HB3 ALA 88 3HB ALA 88 -3.103 1.326 1.487 655 H VAL 89 HN VAL 89 -0.605 -0.526 2.649 656 HA VAL 89 HA VAL 89 -0.027 1.072 5.064 657 HB VAL 89 HB VAL 89 1.483 -1.397 4.175 658 HG11 VAL 89 1HG1 VAL 89 2.681 -1.149 6.310 659 HG12 VAL 89 2HG1 VAL 89 1.818 0.362 6.606 660 HG13 VAL 89 3HG1 VAL 89 2.931 0.235 5.244 661 HG21 VAL 89 3HG2 VAL 89 0.602 -2.449 6.201 662 HG22 VAL 89 1HG2 VAL 89 -0.697 -1.976 5.106 663 HG23 VAL 89 2HG2 VAL 89 -0.354 -1.005 6.538 664 H ASP 90 HN ASP 90 0.996 2.859 4.499 665 HA ASP 90 HA ASP 90 2.795 2.817 2.164 666 HB2 ASP 90 2HB ASP 90 0.806 4.425 2.228 667 HB3 ASP 90 1HB ASP 90 1.650 5.267 3.522 668 H GLN 91 HN GLN 91 4.854 3.819 2.357 669 HA GLN 91 HA GLN 91 6.827 4.363 3.339 670 HB2 GLN 91 2HB GLN 91 5.019 5.193 5.612 671 HB3 GLN 91 1HB GLN 91 6.757 5.452 5.612 672 HG2 GLN 91 2HG GLN 91 6.623 7.201 4.223 673 HG3 GLN 91 1HG GLN 91 5.378 6.446 3.227 674 HE21 GLN 91 1HE2 GLN 91 3.256 6.659 3.786 675 HE22 GLN 91 2HE2 GLN 91 2.674 7.866 4.887 676 H VAL 92 HN VAL 92 5.762 1.664 3.547 677 HA VAL 92 HA VAL 92 6.440 0.623 6.133 678 HB VAL 92 HB VAL 92 4.921 -0.647 4.764 679 HG11 VAL 92 1HG1 VAL 92 5.622 0.032 2.557 680 HG12 VAL 92 2HG1 VAL 92 5.629 -1.730 2.659 681 HG13 VAL 92 3HG1 VAL 92 7.146 -0.834 2.739 682 HG21 VAL 92 3HG2 VAL 92 5.963 -2.850 4.787 683 HG22 VAL 92 1HG2 VAL 92 6.343 -1.939 6.249 684 HG23 VAL 92 2HG2 VAL 92 7.550 -2.101 4.971 685 H GLU 93 HN GLU 93 8.303 0.426 6.945 686 HA GLU 93 HA GLU 93 10.565 -0.776 5.966 687 HB2 GLU 93 2HB GLU 93 12.103 1.147 5.585 688 HB3 GLU 93 1HB GLU 93 10.845 1.048 4.362 689 HG2 GLU 93 2HG GLU 93 9.641 2.857 5.365 690 HG3 GLU 93 1HG GLU 93 10.733 2.875 6.748 691 H LYS 94 HN LYS 94 9.126 1.708 7.908 692 HA LYS 94 HA LYS 94 11.150 1.573 9.961 693 HB2 LYS 94 2HB LYS 94 8.613 3.165 9.696 694 HB3 LYS 94 1HB LYS 94 9.687 3.276 11.079 695 HG2 LYS 94 2HG LYS 94 10.465 3.874 8.234 696 HG3 LYS 94 1HG LYS 94 10.042 5.081 9.451 697 HD2 LYS 94 2HD LYS 94 12.293 3.096 9.755 698 HD3 LYS 94 1HD LYS 94 12.500 4.739 9.139 699 HE2 LYS 94 2HE LYS 94 11.780 5.681 11.211 700 HE3 LYS 94 1HE LYS 94 11.277 4.104 11.819 701 HZ1 LYS 94 3HZ LYS 94 14.084 4.803 11.150 702 HZ2 LYS 94 1HZ LYS 94 13.534 3.400 11.926 703 HZ3 LYS 94 2HZ LYS 94 13.430 4.899 12.711 704 H LEU 95 HN LEU 95 8.965 -0.614 9.256 705 HA LEU 95 HA LEU 95 7.513 -1.037 11.621 706 HB2 LEU 95 2HB LEU 95 8.663 -3.059 9.690 707 HB3 LEU 95 1HB LEU 95 7.483 -3.422 10.932 708 HG LEU 95 HG LEU 95 7.045 -1.600 8.555 709 HD11 LEU 95 1HD1 LEU 95 7.154 -3.991 7.996 710 HD12 LEU 95 2HD1 LEU 95 5.532 -3.333 7.784 711 HD13 LEU 95 3HD1 LEU 95 5.904 -4.320 9.197 712 HD21 LEU 95 3HD2 LEU 95 5.128 -2.478 10.720 713 HD22 LEU 95 1HD2 LEU 95 4.725 -1.513 9.300 714 HD23 LEU 95 2HD2 LEU 95 5.800 -0.858 10.534 715 H GLY 96 HN GLY 96 8.057 -1.872 13.589 716 HA2 GLY 96 2HA GLY 96 10.940 -2.089 14.056 717 HA3 GLY 96 1HA GLY 96 9.713 -1.781 15.274 718 H ASN 97 HN ASN 97 8.350 -3.576 15.942 719 HA ASN 97 HA ASN 97 9.621 -6.189 15.516 720 HB2 ASN 97 2HB ASN 97 10.729 -5.152 17.469 721 HB3 ASN 97 1HB ASN 97 9.163 -4.974 18.251 722 HD21 ASN 97 1HD2 ASN 97 10.258 -7.740 16.347 723 HD22 ASN 97 2HD2 ASN 97 10.241 -8.861 17.666 724 H GLU 98 HN GLU 98 7.241 -4.868 17.824 725 HA GLU 98 HA GLU 98 5.605 -7.167 17.710 726 HB2 GLU 98 2HB GLU 98 5.594 -5.614 19.618 727 HB3 GLU 98 1HB GLU 98 4.882 -4.369 18.605 728 HG2 GLU 98 2HG GLU 98 2.901 -5.768 18.282 729 HG3 GLU 98 1HG GLU 98 3.610 -7.004 19.318 730 H GLU 99 HN GLU 99 5.399 -4.016 16.145 731 HA GLU 99 HA GLU 99 2.886 -4.453 14.902 732 HB2 GLU 99 2HB GLU 99 4.755 -2.694 13.457 733 HB3 GLU 99 1HB GLU 99 3.130 -2.369 14.040 734 HG2 GLU 99 2HG GLU 99 4.380 -0.909 15.289 735 HG3 GLU 99 1HG GLU 99 4.265 -2.293 16.374 736 H GLN 100 HN GLN 100 6.168 -5.234 14.056 737 HA GLN 100 HA GLN 100 5.640 -5.851 11.325 738 HB2 GLN 100 2HB GLN 100 7.885 -5.249 12.284 739 HB3 GLN 100 1HB GLN 100 7.922 -6.837 13.037 740 HG2 GLN 100 2HG GLN 100 7.951 -7.924 10.917 741 HG3 GLN 100 1HG GLN 100 7.655 -6.400 10.078 742 HE21 GLN 100 1HE2 GLN 100 9.985 -8.349 11.742 743 HE22 GLN 100 2HE2 GLN 100 11.376 -7.412 11.312 744 H ALA 101 HN ALA 101 5.935 -7.754 14.303 745 HA ALA 101 HA ALA 101 5.403 -10.271 13.106 746 HB1 ALA 101 1HB ALA 101 6.431 -10.070 15.316 747 HB2 ALA 101 2HB ALA 101 4.960 -11.041 15.389 748 HB3 ALA 101 3HB ALA 101 4.944 -9.369 15.951 749 H LEU 102 HN LEU 102 3.385 -7.746 14.487 750 HA LEU 102 HA LEU 102 0.890 -9.024 14.375 751 HB2 LEU 102 2HB LEU 102 1.631 -6.714 15.362 752 HB3 LEU 102 1HB LEU 102 1.267 -6.100 13.765 753 HG LEU 102 HG LEU 102 -0.547 -5.764 15.418 754 HD11 LEU 102 1HD1 LEU 102 -2.380 -6.575 13.987 755 HD12 LEU 102 2HD1 LEU 102 -1.209 -7.523 13.071 756 HD13 LEU 102 3HD1 LEU 102 -1.105 -5.762 13.081 757 HD21 LEU 102 3HD2 LEU 102 -0.766 -8.765 15.314 758 HD22 LEU 102 1HD2 LEU 102 -1.907 -7.674 16.101 759 HD23 LEU 102 2HD2 LEU 102 -0.255 -7.806 16.703 760 H LEU 103 HN LEU 103 2.544 -6.955 12.017 761 HA LEU 103 HA LEU 103 0.722 -7.135 9.913 762 HB2 LEU 103 2HB LEU 103 2.907 -5.731 10.253 763 HB3 LEU 103 1HB LEU 103 3.685 -7.077 9.449 764 HG LEU 103 HG LEU 103 3.174 -5.190 7.943 765 HD11 LEU 103 1HD1 LEU 103 3.389 -7.422 7.018 766 HD12 LEU 103 2HD1 LEU 103 2.178 -6.487 6.139 767 HD13 LEU 103 3HD1 LEU 103 1.672 -7.715 7.300 768 HD21 LEU 103 3HD2 LEU 103 1.121 -4.407 8.973 769 HD22 LEU 103 1HD2 LEU 103 0.300 -5.897 8.506 770 HD23 LEU 103 2HD2 LEU 103 0.859 -4.772 7.268 771 H PHE 104 HN PHE 104 3.529 -9.168 10.676 772 HA PHE 104 HA PHE 104 3.378 -11.015 8.617 773 HB2 PHE 104 2HB PHE 104 5.217 -10.996 10.207 774 HB3 PHE 104 1HB PHE 104 4.136 -11.462 11.511 775 HD1 PHE 104 1HD PHE 104 5.663 -12.631 8.351 776 HD2 PHE 104 2HD PHE 104 3.635 -13.718 11.930 777 HE1 PHE 104 1HE PHE 104 6.118 -15.002 7.886 778 HE2 PHE 104 2HE PHE 104 4.084 -16.091 11.466 779 HZ PHE 104 HZ PHE 104 5.329 -16.735 9.442 780 H SER 105 HN SER 105 1.713 -11.076 11.747 781 HA SER 105 HA SER 105 0.319 -13.483 11.366 782 HB2 SER 105 2HB SER 105 0.599 -12.163 13.531 783 HB3 SER 105 1HB SER 105 -0.711 -11.131 12.963 784 HG SER 105 HG SER 105 -1.705 -12.675 14.154 785 H ILE 106 HN ILE 106 -0.468 -10.152 10.511 786 HA ILE 106 HA ILE 106 -3.055 -10.536 9.530 787 HB ILE 106 HB ILE 106 -0.927 -8.612 8.575 788 HG12 ILE 106 2HG1 ILE 106 -3.277 -8.231 10.446 789 HG13 ILE 106 1HG1 ILE 106 -1.590 -8.356 10.938 790 HG21 ILE 106 1HG2 ILE 106 -3.887 -8.631 8.007 791 HG22 ILE 106 2HG2 ILE 106 -2.594 -8.908 6.839 792 HG23 ILE 106 3HG2 ILE 106 -2.777 -7.325 7.594 793 HD11 ILE 106 3HD1 ILE 106 -2.793 -6.179 9.241 794 HD12 ILE 106 1HD1 ILE 106 -1.095 -6.300 9.703 795 HD13 ILE 106 2HD1 ILE 106 -2.327 -6.052 10.939 796 H PHE 107 HN PHE 107 0.075 -10.793 7.860 797 HA PHE 107 HA PHE 107 -0.836 -11.547 5.337 798 HB2 PHE 107 2HB PHE 107 1.686 -11.813 6.834 799 HB3 PHE 107 1HB PHE 107 1.456 -13.015 5.571 800 HD1 PHE 107 1HD PHE 107 0.631 -12.007 3.268 801 HD2 PHE 107 2HD PHE 107 2.725 -9.847 6.273 802 HE1 PHE 107 1HE PHE 107 1.408 -10.409 1.569 803 HE2 PHE 107 2HE PHE 107 3.505 -8.240 4.579 804 HZ PHE 107 HZ PHE 107 2.847 -8.522 2.226 805 H ASN 108 HN ASN 108 -0.155 -13.547 8.183 806 HA ASN 108 HA ASN 108 -0.653 -16.038 6.956 807 HB2 ASN 108 2HB ASN 108 0.501 -15.773 9.141 808 HB3 ASN 108 1HB ASN 108 -1.036 -15.307 9.866 809 HD21 ASN 108 1HD2 ASN 108 -1.076 -17.019 11.282 810 HD22 ASN 108 2HD2 ASN 108 -1.348 -18.654 10.766 811 H ARG 109 HN ARG 109 -2.772 -13.873 8.831 812 HA ARG 109 HA ARG 109 -5.061 -15.493 8.758 813 HB2 ARG 109 2HB ARG 109 -4.643 -13.378 10.143 814 HB3 ARG 109 1HB ARG 109 -5.129 -12.478 8.713 815 HG2 ARG 109 2HG ARG 109 -7.069 -14.511 9.310 816 HG3 ARG 109 1HG ARG 109 -6.772 -13.514 10.732 817 HD2 ARG 109 2HD ARG 109 -8.576 -12.542 9.494 818 HD3 ARG 109 1HD ARG 109 -7.167 -11.497 9.326 819 HE ARG 109 HE ARG 109 -7.090 -13.183 7.159 820 HH11 ARG 109 1HH1 ARG 109 -9.456 -10.921 8.440 821 HH12 ARG 109 2HH1 ARG 109 -10.031 -10.460 6.862 822 HH21 ARG 109 1HH2 ARG 109 -7.879 -12.568 5.106 823 HH22 ARG 109 2HH2 ARG 109 -9.147 -11.380 4.983 824 H PHE 110 HN PHE 110 -3.753 -13.215 6.426 825 HA PHE 110 HA PHE 110 -5.994 -13.205 4.681 826 HB2 PHE 110 2HB PHE 110 -3.078 -12.545 4.292 827 HB3 PHE 110 1HB PHE 110 -4.233 -12.463 2.969 828 HD1 PHE 110 1HD PHE 110 -5.908 -11.592 5.925 829 HD2 PHE 110 2HD PHE 110 -3.138 -10.065 3.077 830 HE1 PHE 110 1HE PHE 110 -6.509 -9.297 6.574 831 HE2 PHE 110 2HE PHE 110 -3.733 -7.768 3.723 832 HZ PHE 110 HZ PHE 110 -5.421 -7.380 5.475 833 H ARG 111 HN ARG 111 -2.887 -14.927 4.522 834 HA ARG 111 HA ARG 111 -3.519 -16.356 2.162 835 HB2 ARG 111 2HB ARG 111 -1.218 -15.891 2.925 836 HB3 ARG 111 1HB ARG 111 -1.457 -16.977 4.286 837 HG2 ARG 111 2HG ARG 111 -0.185 -18.079 2.566 838 HG3 ARG 111 1HG ARG 111 -1.766 -18.845 2.718 839 HD2 ARG 111 2HD ARG 111 -2.562 -17.688 0.753 840 HD3 ARG 111 1HD ARG 111 -1.057 -16.776 0.641 841 HE ARG 111 HE ARG 111 -0.481 -19.534 0.584 842 HH11 ARG 111 1HH1 ARG 111 -1.918 -17.041 -1.431 843 HH12 ARG 111 2HH1 ARG 111 -1.503 -17.835 -2.919 844 HH21 ARG 111 1HH2 ARG 111 0.050 -20.569 -1.379 845 HH22 ARG 111 2HH2 ARG 111 -0.397 -19.829 -2.889 846 H ASN 112 HN ASN 112 -3.910 -17.060 5.568 847 HA ASN 112 HA ASN 112 -4.441 -19.831 5.349 848 HB2 ASN 112 2HB ASN 112 -4.228 -17.956 7.417 849 HB3 ASN 112 1HB ASN 112 -5.881 -18.548 7.522 850 HD21 ASN 112 1HD2 ASN 112 -2.534 -19.311 7.846 851 HD22 ASN 112 2HD2 ASN 112 -2.746 -20.866 8.567 852 H SER 113 HN SER 113 -6.589 -17.016 5.566 853 HA SER 113 HA SER 113 -8.971 -18.589 5.459 854 HB2 SER 113 2HB SER 113 -8.953 -16.486 6.664 855 HB3 SER 113 1HB SER 113 -8.500 -15.609 5.205 856 HG SER 113 HG SER 113 -10.875 -17.132 5.286 857 H GLY 114 HN GLY 114 -6.961 -17.024 3.078 858 HA2 GLY 114 2HA GLY 114 -7.098 -17.284 0.743 859 HA3 GLY 114 1HA GLY 114 -8.698 -18.001 0.943 860 H LYS 115 HN LYS 115 -7.806 -15.158 2.596 861 HA LYS 115 HA LYS 115 -9.474 -13.469 0.875 862 HB2 LYS 115 2HB LYS 115 -9.782 -14.198 3.712 863 HB3 LYS 115 1HB LYS 115 -9.873 -12.482 3.388 864 HG2 LYS 115 2HG LYS 115 -11.596 -13.180 1.573 865 HG3 LYS 115 1HG LYS 115 -11.685 -14.675 2.507 866 HD2 LYS 115 2HD LYS 115 -12.234 -11.877 3.487 867 HD3 LYS 115 1HD LYS 115 -13.402 -13.182 3.286 868 HE2 LYS 115 2HE LYS 115 -12.502 -14.403 5.092 869 HE3 LYS 115 1HE LYS 115 -11.048 -13.408 5.141 870 HZ1 LYS 115 3HZ LYS 115 -12.569 -12.851 6.936 871 HZ2 LYS 115 1HZ LYS 115 -13.793 -12.491 5.819 872 HZ3 LYS 115 2HZ LYS 115 -12.389 -11.534 5.877 873 H GLY 116 HN GLY 116 -9.227 -11.161 2.338 874 HA2 GLY 116 2HA GLY 116 -7.730 -9.686 3.368 875 HA3 GLY 116 1HA GLY 116 -6.432 -10.834 3.078 876 H PHE 117 HN PHE 117 -7.394 -7.884 2.362 877 HA PHE 117 HA PHE 117 -6.150 -7.950 -0.307 878 HB2 PHE 117 2HB PHE 117 -8.245 -6.064 0.802 879 HB3 PHE 117 1HB PHE 117 -7.414 -5.830 -0.729 880 HD1 PHE 117 1HD PHE 117 -9.733 -8.043 1.096 881 HD2 PHE 117 2HD PHE 117 -8.105 -6.941 -2.678 882 HE1 PHE 117 1HE PHE 117 -11.444 -9.400 -0.034 883 HE2 PHE 117 2HE PHE 117 -9.810 -8.299 -3.817 884 HZ PHE 117 HZ PHE 117 -11.484 -9.531 -2.493 885 H LEU 118 HN LEU 118 -4.356 -6.686 -0.566 886 HA LEU 118 HA LEU 118 -3.631 -4.899 1.638 887 HB2 LEU 118 2HB LEU 118 -2.734 -7.249 2.004 888 HB3 LEU 118 1HB LEU 118 -1.728 -6.975 0.597 889 HG LEU 118 HG LEU 118 -0.609 -5.121 1.726 890 HD11 LEU 118 1HD1 LEU 118 -1.010 -4.690 4.097 891 HD12 LEU 118 2HD1 LEU 118 -2.335 -5.854 4.088 892 HD13 LEU 118 3HD1 LEU 118 -2.457 -4.374 3.136 893 HD21 LEU 118 3HD2 LEU 118 -0.697 -7.673 3.332 894 HD22 LEU 118 1HD2 LEU 118 0.567 -6.447 3.427 895 HD23 LEU 118 2HD2 LEU 118 0.326 -7.352 1.932 896 H LEU 119 HN LEU 119 -2.371 -3.237 1.098 897 HA LEU 119 HA LEU 119 -1.217 -3.070 -1.582 898 HB2 LEU 119 2HB LEU 119 -3.429 -2.070 -1.793 899 HB3 LEU 119 1HB LEU 119 -3.139 -1.063 -0.388 900 HG LEU 119 HG LEU 119 -1.362 0.127 -1.633 901 HD11 LEU 119 1HD1 LEU 119 -1.166 -0.186 -4.045 902 HD12 LEU 119 2HD1 LEU 119 -2.304 -1.531 -3.968 903 HD13 LEU 119 3HD1 LEU 119 -0.735 -1.660 -3.173 904 HD21 LEU 119 3HD2 LEU 119 -2.852 1.364 -3.106 905 HD22 LEU 119 1HD2 LEU 119 -3.652 0.987 -1.580 906 HD23 LEU 119 2HD2 LEU 119 -4.033 0.057 -3.030 907 H LEU 120 HN LEU 120 0.865 -2.524 -1.284 908 HA LEU 120 HA LEU 120 1.504 -0.778 1.011 909 HB2 LEU 120 2HB LEU 120 3.326 -2.909 -0.101 910 HB3 LEU 120 1HB LEU 120 3.580 -1.939 1.336 911 HG LEU 120 HG LEU 120 1.305 -3.138 2.062 912 HD11 LEU 120 1HD1 LEU 120 1.088 -4.364 -0.047 913 HD12 LEU 120 2HD1 LEU 120 1.267 -5.448 1.332 914 HD13 LEU 120 3HD1 LEU 120 2.635 -5.153 0.259 915 HD21 LEU 120 3HD2 LEU 120 3.369 -3.150 3.330 916 HD22 LEU 120 1HD2 LEU 120 4.059 -4.349 2.237 917 HD23 LEU 120 2HD2 LEU 120 2.686 -4.774 3.258 918 H GLY 121 HN GLY 121 3.128 0.752 0.741 919 HA2 GLY 121 2HA GLY 121 4.322 0.982 -1.928 920 HA3 GLY 121 1HA GLY 121 3.397 2.340 -1.303 921 H SER 122 HN SER 122 6.373 1.668 -1.908 922 HA SER 122 HA SER 122 7.352 3.413 0.164 923 HB2 SER 122 2HB SER 122 9.199 1.925 0.863 924 HB3 SER 122 1HB SER 122 7.627 1.237 1.267 925 HG SER 122 HG SER 122 8.459 -0.430 0.284 926 H GLU 123 HN GLU 123 10.098 3.090 -0.316 927 HA GLU 123 HA GLU 123 10.157 4.210 -3.029 928 HB2 GLU 123 2HB GLU 123 11.995 4.628 -0.677 929 HB3 GLU 123 1HB GLU 123 12.226 5.352 -2.261 930 HG2 GLU 123 2HG GLU 123 10.159 6.589 -2.028 931 HG3 GLU 123 1HG GLU 123 9.845 5.807 -0.477 932 H TYR 124 HN TYR 124 11.024 1.323 -1.572 933 HA TYR 124 HA TYR 124 13.439 1.150 -3.253 934 HB2 TYR 124 2HB TYR 124 13.063 -0.180 -0.566 935 HB3 TYR 124 1HB TYR 124 14.510 -0.240 -1.569 936 HD1 TYR 124 1HD TYR 124 15.909 1.786 -1.842 937 HD2 TYR 124 2HD TYR 124 12.579 1.730 0.804 938 HE1 TYR 124 1HE TYR 124 16.750 3.823 -0.748 939 HE2 TYR 124 2HE TYR 124 13.410 3.764 1.906 940 HH TYR 124 HH TYR 124 15.863 5.701 0.594 941 H THR 125 HN THR 125 12.094 -1.475 -1.338 942 HA THR 125 HA THR 125 10.551 -2.790 -3.251 943 HB THR 125 HB THR 125 12.545 -4.682 -3.432 944 HG1 THR 125 1HG THR 125 13.756 -2.202 -4.107 945 HG21 THR 125 3HG2 THR 125 11.845 -2.567 -5.469 946 HG22 THR 125 1HG2 THR 125 10.992 -4.089 -5.213 947 HG23 THR 125 2HG2 THR 125 12.650 -4.097 -5.813 948 HA PRO 126 HA PRO 126 9.644 -5.084 0.308 949 HB2 PRO 126 2HB PRO 126 8.777 -7.473 -0.637 950 HB3 PRO 126 1HB PRO 126 7.866 -5.974 -0.823 951 HG2 PRO 126 2HG PRO 126 9.611 -7.382 -2.795 952 HG3 PRO 126 1HG PRO 126 8.040 -6.597 -3.048 953 HD2 PRO 126 2HD PRO 126 10.409 -5.429 -3.699 954 HD3 PRO 126 1HD PRO 126 8.977 -4.506 -3.210 955 H GLN 127 HN GLN 127 11.878 -6.676 -1.870 956 HA GLN 127 HA GLN 127 12.711 -8.492 0.273 957 HB2 GLN 127 2HB GLN 127 13.367 -8.536 -2.677 958 HB3 GLN 127 1HB GLN 127 13.964 -9.698 -1.500 959 HG2 GLN 127 2HG GLN 127 11.566 -10.263 -1.001 960 HG3 GLN 127 1HG GLN 127 11.125 -9.274 -2.392 961 HE21 GLN 127 1HE2 GLN 127 11.670 -9.984 -4.468 962 HE22 GLN 127 2HE2 GLN 127 12.119 -11.625 -4.787 963 H GLN 128 HN GLN 128 13.449 -5.492 -0.608 964 HA GLN 128 HA GLN 128 16.337 -5.867 -0.153 965 HB2 GLN 128 2HB GLN 128 15.605 -4.862 -2.370 966 HB3 GLN 128 1HB GLN 128 15.049 -3.469 -1.458 967 HG2 GLN 128 2HG GLN 128 17.214 -3.029 -2.395 968 HG3 GLN 128 1HG GLN 128 17.332 -3.113 -0.637 969 HE21 GLN 128 1HE2 GLN 128 18.112 -4.688 -3.644 970 HE22 GLN 128 2HE2 GLN 128 19.260 -5.801 -2.990 971 H LEU 129 HN LEU 129 13.431 -4.578 1.058 972 HA LEU 129 HA LEU 129 14.489 -2.477 2.648 973 HB2 LEU 129 2HB LEU 129 11.924 -4.047 2.772 974 HB3 LEU 129 1HB LEU 129 12.313 -2.797 3.935 975 HG LEU 129 HG LEU 129 12.100 -2.344 0.960 976 HD11 LEU 129 1HD1 LEU 129 10.130 -1.723 3.159 977 HD12 LEU 129 2HD1 LEU 129 9.947 -2.980 1.935 978 HD13 LEU 129 3HD1 LEU 129 9.964 -1.282 1.458 979 HD21 LEU 129 3HD2 LEU 129 12.088 0.021 1.583 980 HD22 LEU 129 1HD2 LEU 129 13.576 -0.768 2.109 981 HD23 LEU 129 2HD2 LEU 129 12.303 -0.418 3.277 982 H VAL 130 HN VAL 130 14.782 -2.421 4.907 983 HA VAL 130 HA VAL 130 16.042 -4.779 5.958 984 HB VAL 130 HB VAL 130 15.453 -2.196 7.419 985 HG11 VAL 130 1HG1 VAL 130 16.026 -4.045 8.897 986 HG12 VAL 130 2HG1 VAL 130 17.341 -2.872 8.852 987 HG13 VAL 130 3HG1 VAL 130 17.475 -4.382 7.950 988 HG21 VAL 130 3HG2 VAL 130 17.728 -1.500 6.814 989 HG22 VAL 130 1HG2 VAL 130 16.715 -1.717 5.387 990 HG23 VAL 130 2HG2 VAL 130 17.905 -2.946 5.821 991 H ILE 131 HN ILE 131 14.477 -6.302 6.195 992 HA ILE 131 HA ILE 131 12.740 -5.964 8.517 993 HB ILE 131 HB ILE 131 10.925 -7.249 7.346 994 HG12 ILE 131 2HG1 ILE 131 12.517 -6.527 4.866 995 HG13 ILE 131 1HG1 ILE 131 12.257 -8.153 5.489 996 HG21 ILE 131 1HG2 ILE 131 10.705 -4.873 7.728 997 HG22 ILE 131 2HG2 ILE 131 10.009 -5.298 6.166 998 HG23 ILE 131 3HG2 ILE 131 11.591 -4.522 6.244 999 HD11 ILE 131 3HD1 ILE 131 10.822 -7.635 3.572 1000 HD12 ILE 131 1HD1 ILE 131 10.096 -6.313 4.485 1001 HD13 ILE 131 2HD1 ILE 131 9.887 -7.979 5.027 1002 H ARG 132 HN ARG 132 11.821 -8.230 9.096 1003 HA ARG 132 HA ARG 132 14.081 -10.004 9.281 1004 HB2 ARG 132 2HB ARG 132 12.110 -9.448 10.990 1005 HB3 ARG 132 1HB ARG 132 11.359 -10.818 10.190 1006 HG2 ARG 132 2HG ARG 132 12.531 -11.491 12.217 1007 HG3 ARG 132 1HG ARG 132 13.247 -12.225 10.779 1008 HD2 ARG 132 2HD ARG 132 15.085 -10.730 10.821 1009 HD3 ARG 132 1HD ARG 132 14.308 -9.692 12.016 1010 HE ARG 132 HE ARG 132 14.542 -12.159 13.218 1011 HH11 ARG 132 1HH1 ARG 132 16.778 -9.899 11.760 1012 HH12 ARG 132 2HH1 ARG 132 18.060 -10.245 12.882 1013 HH21 ARG 132 1HH2 ARG 132 16.226 -12.615 14.695 1014 HH22 ARG 132 2HH2 ARG 132 17.741 -11.785 14.550 1015 H GLU 133 HN GLU 133 13.939 -12.318 8.670 1016 HA GLU 133 HA GLU 133 13.230 -12.436 5.921 1017 HB2 GLU 133 2HB GLU 133 13.983 -14.816 6.044 1018 HB3 GLU 133 1HB GLU 133 15.167 -13.642 6.596 1019 HG2 GLU 133 2HG GLU 133 13.386 -15.003 8.566 1020 HG3 GLU 133 1HG GLU 133 14.794 -15.839 7.914 1021 H ASP 134 HN ASP 134 11.546 -13.280 8.798 1022 HA ASP 134 HA ASP 134 9.804 -15.225 7.656 1023 HB2 ASP 134 2HB ASP 134 8.499 -15.022 9.684 1024 HB3 ASP 134 1HB ASP 134 10.206 -15.009 10.108 1025 H LEU 135 HN LEU 135 9.657 -11.736 8.097 1026 HA LEU 135 HA LEU 135 7.021 -11.510 6.969 1027 HB2 LEU 135 2HB LEU 135 7.930 -9.876 8.602 1028 HB3 LEU 135 1HB LEU 135 9.115 -9.376 7.410 1029 HG LEU 135 HG LEU 135 7.157 -8.745 5.917 1030 HD11 LEU 135 1HD1 LEU 135 5.027 -8.319 7.013 1031 HD12 LEU 135 2HD1 LEU 135 5.646 -9.018 8.510 1032 HD13 LEU 135 3HD1 LEU 135 5.442 -10.031 7.080 1033 HD21 LEU 135 3HD2 LEU 135 7.525 -7.278 8.522 1034 HD22 LEU 135 1HD2 LEU 135 6.808 -6.608 7.057 1035 HD23 LEU 135 2HD2 LEU 135 8.505 -7.085 7.069 1036 H ARG 136 HN ARG 136 10.341 -11.102 5.839 1037 HA ARG 136 HA ARG 136 9.779 -9.837 3.407 1038 HB2 ARG 136 2HB ARG 136 12.034 -9.921 4.329 1039 HB3 ARG 136 1HB ARG 136 12.091 -11.663 4.088 1040 HG2 ARG 136 2HG ARG 136 11.961 -11.355 1.681 1041 HG3 ARG 136 1HG ARG 136 11.835 -9.608 1.900 1042 HD2 ARG 136 2HD ARG 136 14.165 -11.250 2.863 1043 HD3 ARG 136 1HD ARG 136 14.117 -10.457 1.290 1044 HE ARG 136 HE ARG 136 13.572 -8.471 3.088 1045 HH11 ARG 136 1HH1 ARG 136 16.166 -10.776 2.646 1046 HH12 ARG 136 2HH1 ARG 136 17.390 -9.710 3.287 1047 HH21 ARG 136 1HH2 ARG 136 15.207 -7.046 3.895 1048 HH22 ARG 136 2HH2 ARG 136 16.846 -7.614 3.979 1049 H THR 137 HN THR 137 9.842 -13.260 4.234 1050 HA THR 137 HA THR 137 9.610 -14.225 1.583 1051 HB THR 137 HB THR 137 8.604 -16.284 2.844 1052 HG1 THR 137 1HG THR 137 9.923 -15.137 5.065 1053 HG21 THR 137 3HG2 THR 137 10.864 -16.177 1.905 1054 HG22 THR 137 1HG2 THR 137 10.864 -17.005 3.463 1055 HG23 THR 137 2HG2 THR 137 11.430 -15.338 3.349 1056 H ARG 138 HN ARG 138 7.273 -13.137 3.963 1057 HA ARG 138 HA ARG 138 4.962 -14.042 2.557 1058 HB2 ARG 138 2HB ARG 138 5.295 -11.906 4.667 1059 HB3 ARG 138 1HB ARG 138 3.754 -12.562 4.123 1060 HG2 ARG 138 2HG ARG 138 5.927 -14.274 5.278 1061 HG3 ARG 138 1HG ARG 138 4.684 -13.509 6.263 1062 HD2 ARG 138 2HD ARG 138 2.960 -14.735 5.220 1063 HD3 ARG 138 1HD ARG 138 4.013 -15.232 3.897 1064 HE ARG 138 HE ARG 138 5.261 -16.434 5.841 1065 HH11 ARG 138 1HH1 ARG 138 1.798 -16.055 5.512 1066 HH12 ARG 138 2HH1 ARG 138 1.425 -17.597 6.217 1067 HH21 ARG 138 1HH2 ARG 138 4.785 -18.445 6.789 1068 HH22 ARG 138 2HH2 ARG 138 3.131 -18.947 6.981 1069 H MET 139 HN MET 139 6.988 -11.231 2.397 1070 HA MET 139 HA MET 139 5.215 -9.463 1.110 1071 HB2 MET 139 2HB MET 139 8.228 -9.638 0.977 1072 HB3 MET 139 1HB MET 139 7.279 -8.281 0.389 1073 HG2 MET 139 2HG MET 139 7.373 -9.238 3.237 1074 HG3 MET 139 1HG MET 139 8.269 -7.867 2.587 1075 HE1 MET 139 3HE MET 139 5.385 -5.399 1.628 1076 HE2 MET 139 1HE MET 139 6.154 -6.597 0.588 1077 HE3 MET 139 2HE MET 139 7.130 -5.640 1.703 1078 H ALA 140 HN ALA 140 6.813 -12.268 0.017 1079 HA ALA 140 HA ALA 140 6.997 -11.603 -2.753 1080 HB1 ALA 140 1HB ALA 140 6.985 -14.327 -1.463 1081 HB2 ALA 140 2HB ALA 140 8.411 -13.316 -1.699 1082 HB3 ALA 140 3HB ALA 140 7.532 -13.940 -3.096 1083 H TYR 141 HN TYR 141 4.403 -12.501 -0.728 1084 HA TYR 141 HA TYR 141 2.821 -13.795 -2.759 1085 HB2 TYR 141 2HB TYR 141 2.141 -12.775 0.000 1086 HB3 TYR 141 1HB TYR 141 0.978 -13.565 -1.053 1087 HD1 TYR 141 1HD TYR 141 1.799 -15.919 -1.987 1088 HD2 TYR 141 2HD TYR 141 3.239 -14.067 1.559 1089 HE1 TYR 141 1HE TYR 141 2.506 -18.114 -1.135 1090 HE2 TYR 141 2HE TYR 141 3.954 -16.256 2.420 1091 HH TYR 141 HH TYR 141 4.225 -18.986 0.520 1092 H CYS 142 HN CYS 142 3.602 -10.603 -2.052 1093 HA CYS 142 HA CYS 142 1.142 -9.519 -3.161 1094 HB2 CYS 142 2HB CYS 142 3.584 -8.108 -2.054 1095 HB3 CYS 142 1HB CYS 142 2.099 -7.322 -2.584 1096 HG CYS 142 HG CYS 142 1.441 -9.647 -0.333 1097 H LEU 143 HN LEU 143 1.050 -8.580 -5.114 1098 HA LEU 143 HA LEU 143 3.130 -9.227 -6.991 1099 HB2 LEU 143 2HB LEU 143 0.425 -7.976 -7.214 1100 HB3 LEU 143 1HB LEU 143 1.550 -7.874 -8.552 1101 HG LEU 143 HG LEU 143 0.989 -10.530 -7.347 1102 HD11 LEU 143 1HD1 LEU 143 -0.884 -10.833 -8.920 1103 HD12 LEU 143 2HD1 LEU 143 -0.787 -9.123 -9.339 1104 HD13 LEU 143 3HD1 LEU 143 -1.228 -9.609 -7.701 1105 HD21 LEU 143 3HD2 LEU 143 1.440 -11.296 -9.604 1106 HD22 LEU 143 1HD2 LEU 143 2.758 -10.288 -9.008 1107 HD23 LEU 143 2HD2 LEU 143 1.591 -9.626 -10.154 1108 H VAL 144 HN VAL 144 4.119 -7.772 -8.364 1109 HA VAL 144 HA VAL 144 4.591 -5.136 -7.146 1110 HB VAL 144 HB VAL 144 6.389 -6.673 -9.038 1111 HG11 VAL 144 1HG1 VAL 144 6.851 -4.091 -7.549 1112 HG12 VAL 144 2HG1 VAL 144 6.625 -4.264 -9.288 1113 HG13 VAL 144 3HG1 VAL 144 8.054 -4.948 -8.513 1114 HG21 VAL 144 3HG2 VAL 144 7.859 -6.982 -7.115 1115 HG22 VAL 144 1HG2 VAL 144 6.282 -7.714 -6.828 1116 HG23 VAL 144 2HG2 VAL 144 6.687 -6.170 -6.079 1117 H TYR 145 HN TYR 145 3.592 -3.557 -8.147 1118 HA TYR 145 HA TYR 145 3.147 -3.799 -11.041 1119 HB2 TYR 145 2HB TYR 145 1.258 -3.211 -8.873 1120 HB3 TYR 145 1HB TYR 145 1.143 -2.130 -10.254 1121 HD1 TYR 145 1HD TYR 145 0.953 -5.683 -9.214 1122 HD2 TYR 145 2HD TYR 145 0.199 -2.842 -12.293 1123 HE1 TYR 145 1HE TYR 145 -0.365 -7.366 -10.437 1124 HE2 TYR 145 2HE TYR 145 -1.117 -4.512 -13.522 1125 HH TYR 145 HH TYR 145 -1.336 -6.923 -13.689 1126 H GLU 146 HN GLU 146 4.110 -2.369 -12.172 1127 HA GLU 146 HA GLU 146 4.569 0.317 -11.071 1128 HB2 GLU 146 2HB GLU 146 5.969 -1.085 -13.366 1129 HB3 GLU 146 1HB GLU 146 6.308 0.550 -12.815 1130 HG2 GLU 146 2HG GLU 146 7.036 -0.330 -10.652 1131 HG3 GLU 146 1HG GLU 146 6.697 -1.968 -11.207 1132 H VAL 147 HN VAL 147 3.588 2.020 -12.100 1133 HA VAL 147 HA VAL 147 1.584 1.285 -14.086 1134 HB VAL 147 HB VAL 147 1.078 2.749 -12.084 1135 HG11 VAL 147 1HG1 VAL 147 2.544 4.819 -13.703 1136 HG12 VAL 147 2HG1 VAL 147 3.034 4.169 -12.141 1137 HG13 VAL 147 3HG1 VAL 147 1.566 5.137 -12.271 1138 HG21 VAL 147 3HG2 VAL 147 0.398 3.841 -14.811 1139 HG22 VAL 147 1HG2 VAL 147 -0.455 4.213 -13.312 1140 HG23 VAL 147 2HG2 VAL 147 -0.466 2.568 -13.947 1141 H LYS 148 HN LYS 148 4.684 1.964 -14.255 1142 HA LYS 148 HA LYS 148 4.923 3.916 -16.280 1143 HB2 LYS 148 2HB LYS 148 6.760 1.559 -15.825 1144 HB3 LYS 148 1HB LYS 148 7.166 3.108 -16.554 1145 HG2 LYS 148 2HG LYS 148 6.808 4.219 -14.407 1146 HG3 LYS 148 1HG LYS 148 6.393 2.669 -13.674 1147 HD2 LYS 148 2HD LYS 148 8.659 1.845 -14.279 1148 HD3 LYS 148 1HD LYS 148 9.053 3.463 -14.862 1149 HE2 LYS 148 2HE LYS 148 9.917 3.238 -12.640 1150 HE3 LYS 148 1HE LYS 148 8.537 4.333 -12.583 1151 HZ1 LYS 148 3HZ LYS 148 8.548 2.713 -10.761 1152 HZ2 LYS 148 1HZ LYS 148 8.439 1.443 -11.884 1153 HZ3 LYS 148 2HZ LYS 148 7.166 2.564 -11.732 1154 HA PRO 149 HA PRO 149 3.033 1.867 -19.689 1155 HB2 PRO 149 2HB PRO 149 4.617 3.024 -21.670 1156 HB3 PRO 149 1HB PRO 149 3.135 3.710 -21.000 1157 HG2 PRO 149 2HG PRO 149 5.976 4.312 -20.337 1158 HG3 PRO 149 1HG PRO 149 4.582 5.405 -20.414 1159 HD2 PRO 149 2HD PRO 149 5.578 4.574 -18.069 1160 HD3 PRO 149 1HD PRO 149 3.832 4.803 -18.303 Start of MODEL 2 1 H1 MET 1 H1 MET 1 -10.335 -40.512 13.324 2 H2 MET 1 H2 MET 1 -10.722 -38.897 12.997 3 H3 MET 1 H3 MET 1 -11.100 -39.562 14.504 4 HA MET 1 HA MET 1 -8.717 -39.907 14.919 5 HB2 MET 1 2HB MET 1 -7.102 -38.728 13.529 6 HB3 MET 1 1HB MET 1 -7.998 -39.886 12.561 7 HG2 MET 1 2HG MET 1 -9.408 -38.066 11.712 8 HG3 MET 1 1HG MET 1 -8.466 -36.918 12.658 9 HE1 MET 1 2HE MET 1 -5.499 -38.051 12.345 10 HE2 MET 1 3HE MET 1 -5.928 -36.347 12.204 11 HE3 MET 1 1HE MET 1 -4.952 -37.118 10.954 12 H GLY 2 HN GLY 2 -10.778 -37.247 13.951 13 HA2 GLY 2 2HA GLY 2 -11.300 -35.898 16.039 14 HA3 GLY 2 1HA GLY 2 -9.564 -35.642 16.108 15 H HIS 3 HN HIS 3 -12.065 -33.929 15.667 16 HA HIS 3 HA HIS 3 -10.778 -32.142 13.780 17 HB2 HIS 3 2HB HIS 3 -12.317 -33.572 12.402 18 HB3 HIS 3 1HB HIS 3 -13.659 -32.977 13.370 19 HD1 HIS 3 1HD HIS 3 -14.779 -30.925 12.534 20 HD2 HIS 3 2HD HIS 3 -10.986 -31.426 10.897 21 HE1 HIS 3 1HE HIS 3 -14.546 -29.128 10.793 22 HE2 HIS 3 2HE HIS 3 -12.348 -29.603 9.656 23 H HIS 4 HN HIS 4 -10.507 -30.595 15.283 24 HA HIS 4 HA HIS 4 -12.732 -29.924 17.075 25 HB2 HIS 4 2HB HIS 4 -9.814 -29.114 17.103 26 HB3 HIS 4 1HB HIS 4 -11.010 -28.549 18.265 27 HD1 HIS 4 1HD HIS 4 -11.391 -29.985 20.283 28 HD2 HIS 4 2HD HIS 4 -9.361 -31.999 17.256 29 HE1 HIS 4 1HE HIS 4 -10.698 -32.187 21.275 30 HE2 HIS 4 2HE HIS 4 -9.337 -33.328 19.482 31 H HIS 5 HN HIS 5 -13.243 -27.618 17.431 32 HA HIS 5 HA HIS 5 -12.503 -25.791 15.306 33 HB2 HIS 5 2HB HIS 5 -14.405 -27.208 14.410 34 HB3 HIS 5 1HB HIS 5 -15.420 -26.499 15.663 35 HD1 HIS 5 1HD HIS 5 -13.850 -25.786 12.379 36 HD2 HIS 5 2HD HIS 5 -16.051 -23.762 15.270 37 HE1 HIS 5 1HE HIS 5 -14.609 -23.650 11.283 38 HE2 HIS 5 2HE HIS 5 -16.024 -22.487 13.016 39 H HIS 6 HN HIS 6 -12.384 -23.804 16.062 40 HA HIS 6 HA HIS 6 -14.108 -23.004 18.325 41 HB2 HIS 6 2HB HIS 6 -11.187 -22.374 17.884 42 HB3 HIS 6 1HB HIS 6 -12.208 -21.403 18.935 43 HD1 HIS 6 1HD HIS 6 -13.208 -22.688 21.069 44 HD2 HIS 6 2HD HIS 6 -10.141 -24.614 19.026 45 HE1 HIS 6 1HE HIS 6 -12.338 -24.441 22.650 46 HE2 HIS 6 2HE HIS 6 -10.514 -25.626 21.375 47 H HIS 7 HN HIS 7 -14.013 -20.453 18.452 48 HA HIS 7 HA HIS 7 -13.421 -19.054 16.045 49 HB2 HIS 7 2HB HIS 7 -15.627 -18.370 15.366 50 HB3 HIS 7 1HB HIS 7 -15.589 -20.126 15.402 51 HD1 HIS 7 1HD HIS 7 -17.502 -17.277 16.562 52 HD2 HIS 7 2HD HIS 7 -16.914 -21.202 17.822 53 HE1 HIS 7 1HE HIS 7 -19.403 -17.782 18.130 54 HE2 HIS 7 2HE HIS 7 -19.005 -20.140 18.928 55 H HIS 8 HN HIS 8 -12.858 -17.053 16.604 56 HA HIS 8 HA HIS 8 -13.833 -15.998 19.167 57 HB2 HIS 8 2HB HIS 8 -11.360 -16.099 18.739 58 HB3 HIS 8 1HB HIS 8 -11.589 -14.957 17.422 59 HD1 HIS 8 1HD HIS 8 -11.654 -15.190 21.170 60 HD2 HIS 8 2HD HIS 8 -11.867 -12.303 18.185 61 HE1 HIS 8 1HE HIS 8 -11.418 -12.980 22.348 62 HE2 HIS 8 2HE HIS 8 -11.291 -11.278 20.492 63 H SER 9 HN SER 9 -15.803 -15.146 18.711 64 HA SER 9 HA SER 9 -15.959 -13.263 16.444 65 HB2 SER 9 2HB SER 9 -18.250 -14.875 17.591 66 HB3 SER 9 1HB SER 9 -18.249 -13.920 16.107 67 HG SER 9 HG SER 9 -16.475 -15.434 15.447 68 H HIS 10 HN HIS 10 -15.731 -11.310 17.382 69 HA HIS 10 HA HIS 10 -17.866 -10.479 19.183 70 HB2 HIS 10 2HB HIS 10 -15.957 -11.107 20.658 71 HB3 HIS 10 1HB HIS 10 -14.957 -9.925 19.821 72 HD1 HIS 10 1HD HIS 10 -14.781 -7.782 21.048 73 HD2 HIS 10 2HD HIS 10 -18.410 -9.693 21.763 74 HE1 HIS 10 1HE HIS 10 -16.034 -6.296 22.646 75 HE2 HIS 10 2HE HIS 10 -18.249 -7.436 23.024 76 H MET 11 HN MET 11 -18.749 -9.152 17.693 77 HA MET 11 HA MET 11 -17.068 -6.950 16.721 78 HB2 MET 11 2HB MET 11 -18.339 -7.068 14.544 79 HB3 MET 11 1HB MET 11 -17.187 -8.363 14.829 80 HG2 MET 11 2HG MET 11 -19.031 -9.828 15.523 81 HG3 MET 11 1HG MET 11 -20.171 -8.530 15.171 82 HE1 MET 11 3HE MET 11 -20.057 -11.615 13.954 83 HE2 MET 11 1HE MET 11 -20.645 -11.257 12.328 84 HE3 MET 11 2HE MET 11 -21.390 -10.483 13.727 85 H ASP 12 HN ASP 12 -17.839 -5.102 17.330 86 HA ASP 12 HA ASP 12 -20.697 -4.567 17.186 87 HB2 ASP 12 2HB ASP 12 -20.356 -5.303 19.518 88 HB3 ASP 12 1HB ASP 12 -19.094 -4.091 19.715 89 H TYR 13 HN TYR 13 -20.842 -2.792 15.996 90 HA TYR 13 HA TYR 13 -18.516 -1.136 15.593 91 HB2 TYR 13 2HB TYR 13 -19.929 0.008 13.895 92 HB3 TYR 13 1HB TYR 13 -19.829 -1.732 13.648 93 HD1 TYR 13 2HD TYR 13 -21.783 -3.158 14.072 94 HD2 TYR 13 1HD TYR 13 -22.010 1.072 14.475 95 HE1 TYR 13 2HE TYR 13 -24.236 -3.292 14.052 96 HE2 TYR 13 1HE TYR 13 -24.467 0.947 14.451 97 HH TYR 13 HH TYR 13 -26.144 -2.010 14.809 98 HA PRO 14 HA PRO 14 -19.633 2.088 18.426 99 HB2 PRO 14 2HB PRO 14 -18.303 4.158 17.265 100 HB3 PRO 14 1HB PRO 14 -17.496 2.897 18.203 101 HG2 PRO 14 2HG PRO 14 -17.761 3.181 15.238 102 HG3 PRO 14 1HG PRO 14 -16.350 2.690 16.194 103 HD2 PRO 14 2HD PRO 14 -17.927 0.911 14.896 104 HD3 PRO 14 1HD PRO 14 -17.103 0.522 16.420 105 H SER 15 HN SER 15 -21.471 3.179 18.564 106 HA SER 15 HA SER 15 -22.898 3.892 16.150 107 HB2 SER 15 2HB SER 15 -23.729 4.297 19.031 108 HB3 SER 15 1HB SER 15 -24.774 4.337 17.609 109 HG SER 15 HG SER 15 -23.974 2.225 19.082 110 H PHE 16 HN PHE 16 -22.937 5.845 15.266 111 HA PHE 16 HA PHE 16 -22.330 8.187 16.920 112 HB2 PHE 16 2HB PHE 16 -20.795 9.087 15.283 113 HB3 PHE 16 1HB PHE 16 -20.249 7.474 15.723 114 HD1 PHE 16 1HD PHE 16 -20.794 5.556 14.150 115 HD2 PHE 16 2HD PHE 16 -21.219 9.649 13.059 116 HE1 PHE 16 1HE PHE 16 -20.758 4.926 11.773 117 HE2 PHE 16 2HE PHE 16 -21.188 9.023 10.681 118 HZ PHE 16 HZ PHE 16 -20.958 6.661 10.034 119 H ASP 17 HN ASP 17 -22.779 10.251 15.500 120 HA ASP 17 HA ASP 17 -24.869 9.788 13.534 121 HB2 ASP 17 2HB ASP 17 -26.550 11.080 14.615 122 HB3 ASP 17 1HB ASP 17 -25.980 9.914 15.802 123 H LYS 18 HN LYS 18 -25.045 11.346 12.054 124 HA LYS 18 HA LYS 18 -24.486 14.035 12.187 125 HB2 LYS 18 2HB LYS 18 -22.091 13.143 12.595 126 HB3 LYS 18 1HB LYS 18 -22.128 12.615 10.919 127 HG2 LYS 18 2HG LYS 18 -22.701 15.039 10.350 128 HG3 LYS 18 1HG LYS 18 -22.206 15.414 12.000 129 HD2 LYS 18 2HD LYS 18 -20.494 14.048 9.925 130 HD3 LYS 18 1HD LYS 18 -20.397 15.752 10.365 131 HE2 LYS 18 2HE LYS 18 -19.830 15.094 12.671 132 HE3 LYS 18 1HE LYS 18 -19.861 13.402 12.175 133 HZ1 LYS 18 3HZ LYS 18 -17.984 15.511 11.272 134 HZ2 LYS 18 1HZ LYS 18 -18.118 14.007 10.505 135 HZ3 LYS 18 2HZ LYS 18 -17.612 14.091 12.120 136 H PHE 19 HN PHE 19 -24.308 14.962 9.883 137 HA PHE 19 HA PHE 19 -24.840 12.957 7.842 138 HB2 PHE 19 2HB PHE 19 -27.000 14.150 8.616 139 HB3 PHE 19 1HB PHE 19 -26.347 15.575 7.819 140 HD1 PHE 19 1HD PHE 19 -27.338 12.058 7.250 141 HD2 PHE 19 2HD PHE 19 -26.592 15.866 5.511 142 HE1 PHE 19 1HE PHE 19 -28.261 11.258 5.115 143 HE2 PHE 19 2HE PHE 19 -27.507 15.074 3.371 144 HZ PHE 19 HZ PHE 19 -28.347 12.767 3.168 145 H LEU 20 HN LEU 20 -22.862 16.506 7.367 146 HA LEU 20 HA LEU 20 -25.610 16.395 8.350 147 HB2 LEU 20 2HB LEU 20 -23.424 18.475 8.527 148 HB3 LEU 20 1HB LEU 20 -25.082 18.822 8.968 149 HG LEU 20 HG LEU 20 -23.378 16.702 10.281 150 HD11 LEU 20 1HD1 LEU 20 -24.100 19.474 11.226 151 HD12 LEU 20 2HD1 LEU 20 -22.500 18.932 10.724 152 HD13 LEU 20 3HD1 LEU 20 -23.249 18.251 12.168 153 HD21 LEU 20 3HD2 LEU 20 -25.145 16.686 11.968 154 HD22 LEU 20 1HD2 LEU 20 -25.777 16.250 10.379 155 HD23 LEU 20 2HD2 LEU 20 -26.060 17.864 11.028 156 H GLY 21 HN GLY 21 -23.886 16.772 5.651 157 HA2 GLY 21 2HA GLY 21 -26.008 17.668 4.017 158 HA3 GLY 21 1HA GLY 21 -24.822 18.959 4.231 159 H THR 22 HN THR 22 -25.622 16.545 2.175 160 HA THR 22 HA THR 22 -23.286 14.985 2.046 161 HB THR 22 HB THR 22 -25.237 15.420 -0.198 162 HG1 THR 22 1HG THR 22 -26.455 14.770 1.536 163 HG21 THR 22 3HG2 THR 22 -23.446 13.090 0.489 164 HG22 THR 22 1HG2 THR 22 -23.209 14.220 -0.842 165 HG23 THR 22 2HG2 THR 22 -24.602 13.140 -0.841 166 H GLU 23 HN GLU 23 -21.376 15.558 1.469 167 HA GLU 23 HA GLU 23 -20.901 16.705 -1.135 168 HB2 GLU 23 2HB GLU 23 -20.959 18.713 0.312 169 HB3 GLU 23 1HB GLU 23 -19.720 17.999 1.337 170 HG2 GLU 23 2HG GLU 23 -18.135 18.047 -0.488 171 HG3 GLU 23 1HG GLU 23 -19.374 18.662 -1.581 172 H ASN 24 HN ASN 24 -19.783 15.033 -1.903 173 HA ASN 24 HA ASN 24 -17.767 13.762 -0.177 174 HB2 ASN 24 2HB ASN 24 -19.667 12.396 -1.171 175 HB3 ASN 24 1HB ASN 24 -18.944 12.681 -2.748 176 HD21 ASN 24 1HD2 ASN 24 -18.640 11.032 0.295 177 HD22 ASN 24 2HD2 ASN 24 -17.386 9.948 -0.191 178 H ALA 25 HN ALA 25 -17.847 16.180 -2.217 179 HA ALA 25 HA ALA 25 -16.306 15.666 -4.443 180 HB1 ALA 25 1HB ALA 25 -17.542 17.755 -4.037 181 HB2 ALA 25 2HB ALA 25 -15.880 18.037 -4.553 182 HB3 ALA 25 3HB ALA 25 -16.319 18.227 -2.855 183 H GLU 26 HN GLU 26 -15.213 16.321 -1.164 184 HA GLU 26 HA GLU 26 -12.501 16.747 -1.778 185 HB2 GLU 26 2HB GLU 26 -13.655 15.636 0.778 186 HB3 GLU 26 1HB GLU 26 -12.067 16.372 0.585 187 HG2 GLU 26 2HG GLU 26 -13.226 18.480 -0.093 188 HG3 GLU 26 1HG GLU 26 -14.746 17.710 0.355 189 H LEU 27 HN LEU 27 -14.320 13.838 -0.999 190 HA LEU 27 HA LEU 27 -12.027 12.135 -1.008 191 HB2 LEU 27 2HB LEU 27 -13.977 11.616 0.352 192 HB3 LEU 27 1HB LEU 27 -14.982 11.538 -1.084 193 HG LEU 27 HG LEU 27 -13.656 9.623 -1.873 194 HD11 LEU 27 1HD1 LEU 27 -12.155 8.473 -0.321 195 HD12 LEU 27 2HD1 LEU 27 -12.363 9.781 0.843 196 HD13 LEU 27 3HD1 LEU 27 -11.577 10.094 -0.703 197 HD21 LEU 27 3HD2 LEU 27 -15.745 9.259 -0.686 198 HD22 LEU 27 1HD2 LEU 27 -14.889 9.290 0.857 199 HD23 LEU 27 2HD2 LEU 27 -14.579 7.994 -0.298 200 H VAL 28 HN VAL 28 -14.593 13.011 -3.258 201 HA VAL 28 HA VAL 28 -14.138 11.202 -5.313 202 HB VAL 28 HB VAL 28 -14.980 14.104 -5.487 203 HG11 VAL 28 1HG1 VAL 28 -14.119 13.371 -7.655 204 HG12 VAL 28 2HG1 VAL 28 -15.871 13.572 -7.705 205 HG13 VAL 28 3HG1 VAL 28 -15.171 11.956 -7.600 206 HG21 VAL 28 3HG2 VAL 28 -16.567 11.539 -5.491 207 HG22 VAL 28 1HG2 VAL 28 -17.237 13.152 -5.732 208 HG23 VAL 28 2HG2 VAL 28 -16.498 12.726 -4.188 209 H TYR 29 HN TYR 29 -12.443 14.191 -4.536 210 HA TYR 29 HA TYR 29 -10.852 14.392 -6.833 211 HB2 TYR 29 2HB TYR 29 -11.029 16.241 -5.273 212 HB3 TYR 29 1HB TYR 29 -10.288 15.282 -3.994 213 HD1 TYR 29 2HD TYR 29 -9.642 16.922 -7.252 214 HD2 TYR 29 1HD TYR 29 -7.939 15.128 -3.788 215 HE1 TYR 29 2HE TYR 29 -7.417 17.714 -7.940 216 HE2 TYR 29 1HE TYR 29 -5.710 15.905 -4.469 217 HH TYR 29 HH TYR 29 -5.208 18.222 -6.863 218 H VAL 30 HN VAL 30 -10.437 12.513 -3.884 219 HA VAL 30 HA VAL 30 -7.713 11.811 -4.422 220 HB VAL 30 HB VAL 30 -9.662 10.462 -2.543 221 HG11 VAL 30 1HG1 VAL 30 -7.696 9.106 -3.008 222 HG12 VAL 30 2HG1 VAL 30 -7.659 9.716 -1.353 223 HG13 VAL 30 3HG1 VAL 30 -6.646 10.460 -2.589 224 HG21 VAL 30 3HG2 VAL 30 -9.490 12.836 -2.047 225 HG22 VAL 30 1HG2 VAL 30 -7.731 12.715 -2.013 226 HG23 VAL 30 2HG2 VAL 30 -8.698 11.879 -0.795 227 H LEU 31 HN LEU 31 -10.851 10.360 -5.004 228 HA LEU 31 HA LEU 31 -10.116 7.728 -5.531 229 HB2 LEU 31 2HB LEU 31 -12.366 9.345 -6.727 230 HB3 LEU 31 1HB LEU 31 -12.227 7.600 -6.826 231 HG LEU 31 HG LEU 31 -12.518 9.172 -4.264 232 HD11 LEU 31 1HD1 LEU 31 -14.544 9.275 -5.591 233 HD12 LEU 31 2HD1 LEU 31 -14.775 8.222 -4.195 234 HD13 LEU 31 3HD1 LEU 31 -14.522 7.525 -5.795 235 HD21 LEU 31 3HD2 LEU 31 -11.280 7.083 -3.981 236 HD22 LEU 31 1HD2 LEU 31 -12.581 6.200 -4.777 237 HD23 LEU 31 2HD2 LEU 31 -12.871 6.992 -3.228 238 H ARG 32 HN ARG 32 -8.487 7.236 -6.859 239 HA ARG 32 HA ARG 32 -8.852 7.851 -9.693 240 HB2 ARG 32 2HB ARG 32 -6.537 8.637 -8.047 241 HB3 ARG 32 1HB ARG 32 -6.119 7.793 -9.530 242 HG2 ARG 32 2HG ARG 32 -6.074 9.996 -10.177 243 HG3 ARG 32 1HG ARG 32 -7.692 9.499 -10.669 244 HD2 ARG 32 2HD ARG 32 -8.591 10.471 -8.599 245 HD3 ARG 32 1HD ARG 32 -6.968 11.003 -8.157 246 HE ARG 32 HE ARG 32 -8.527 12.007 -10.458 247 HH11 ARG 32 1HH1 ARG 32 -5.966 12.388 -8.098 248 HH12 ARG 32 2HH1 ARG 32 -5.625 14.031 -8.544 249 HH21 ARG 32 1HH2 ARG 32 -8.084 14.190 -11.023 250 HH22 ARG 32 2HH2 ARG 32 -6.827 15.047 -10.178 251 H HIS 33 HN HIS 33 -9.611 5.756 -9.952 252 HA HIS 33 HA HIS 33 -9.412 3.603 -10.658 253 HB2 HIS 33 2HB HIS 33 -6.428 4.020 -10.372 254 HB3 HIS 33 1HB HIS 33 -7.201 2.674 -11.198 255 HD1 HIS 33 1HD HIS 33 -5.759 5.910 -11.802 256 HD2 HIS 33 2HD HIS 33 -8.785 3.629 -13.524 257 HE1 HIS 33 1HE HIS 33 -6.121 6.879 -14.095 258 HE2 HIS 33 2HE HIS 33 -7.814 5.366 -15.186 259 H LYS 34 HN LYS 34 -8.456 1.388 -9.991 260 HA LYS 34 HA LYS 34 -8.046 1.323 -7.071 261 HB2 LYS 34 2HB LYS 34 -9.256 -0.781 -6.961 262 HB3 LYS 34 1HB LYS 34 -10.279 0.456 -7.677 263 HG2 LYS 34 2HG LYS 34 -9.926 -0.452 -9.874 264 HG3 LYS 34 1HG LYS 34 -8.752 -1.612 -9.246 265 HD2 LYS 34 2HD LYS 34 -10.526 -2.631 -7.877 266 HD3 LYS 34 1HD LYS 34 -11.688 -1.490 -8.555 267 HE2 LYS 34 2HE LYS 34 -11.837 -3.635 -9.687 268 HE3 LYS 34 1HE LYS 34 -11.267 -2.387 -10.791 269 HZ1 LYS 34 3HZ LYS 34 -9.465 -4.279 -9.375 270 HZ2 LYS 34 1HZ LYS 34 -9.051 -3.210 -10.625 271 HZ3 LYS 34 2HZ LYS 34 -10.058 -4.541 -10.939 272 H HIS 35 HN HIS 35 -7.295 -1.229 -6.661 273 HA HIS 35 HA HIS 35 -5.101 -1.766 -8.533 274 HB2 HIS 35 2HB HIS 35 -4.697 -1.664 -5.533 275 HB3 HIS 35 1HB HIS 35 -3.466 -1.970 -6.753 276 HD1 HIS 35 1HD HIS 35 -3.132 0.207 -8.471 277 HD2 HIS 35 2HD HIS 35 -4.823 0.910 -4.740 278 HE1 HIS 35 1HE HIS 35 -2.865 2.675 -8.061 279 HE2 HIS 35 2HE HIS 35 -4.006 3.093 -5.847 280 H GLY 36 HN GLY 36 -3.940 -3.903 -7.644 281 HA2 GLY 36 2HA GLY 36 -5.980 -5.923 -7.783 282 HA3 GLY 36 1HA GLY 36 -4.247 -6.189 -7.724 283 H GLN 37 HN GLN 37 -4.894 -7.989 -6.309 284 HA GLN 37 HA GLN 37 -6.017 -7.372 -3.739 285 HB2 GLN 37 2HB GLN 37 -6.315 -9.555 -5.013 286 HB3 GLN 37 1HB GLN 37 -4.680 -9.960 -4.506 287 HG2 GLN 37 2HG GLN 37 -5.383 -9.698 -2.156 288 HG3 GLN 37 1HG GLN 37 -7.028 -9.397 -2.708 289 HE21 GLN 37 1HE2 GLN 37 -6.123 -11.476 -0.966 290 HE22 GLN 37 2HE2 GLN 37 -6.482 -12.983 -1.745 291 H PHE 38 HN PHE 38 -3.047 -9.223 -4.327 292 HA PHE 38 HA PHE 38 -1.787 -7.793 -2.105 293 HB2 PHE 38 2HB PHE 38 -0.860 -10.242 -3.627 294 HB3 PHE 38 1HB PHE 38 -0.031 -9.528 -2.251 295 HD1 PHE 38 2HD PHE 38 -1.476 -9.321 -0.064 296 HD2 PHE 38 1HD PHE 38 -2.304 -11.983 -3.278 297 HE1 PHE 38 2HE PHE 38 -2.786 -10.749 1.457 298 HE2 PHE 38 1HE PHE 38 -3.618 -13.410 -1.768 299 HZ PHE 38 HZ PHE 38 -3.859 -12.795 0.603 300 H ILE 39 HN ILE 39 -1.059 -5.874 -2.895 301 HA ILE 39 HA ILE 39 0.667 -5.990 -5.289 302 HB ILE 39 HB ILE 39 -1.215 -3.750 -4.520 303 HG12 ILE 39 2HG1 ILE 39 -2.372 -5.682 -5.496 304 HG13 ILE 39 1HG1 ILE 39 -2.400 -4.308 -6.589 305 HG21 ILE 39 1HG2 ILE 39 -0.520 -2.759 -6.694 306 HG22 ILE 39 2HG2 ILE 39 0.741 -3.988 -6.797 307 HG23 ILE 39 3HG2 ILE 39 0.762 -2.813 -5.484 308 HD11 ILE 39 3HD1 ILE 39 -0.533 -5.318 -7.850 309 HD12 ILE 39 1HD1 ILE 39 -1.995 -6.306 -7.837 310 HD13 ILE 39 2HD1 ILE 39 -0.637 -6.730 -6.798 311 H TYR 40 HN TYR 40 2.686 -5.542 -4.782 312 HA TYR 40 HA TYR 40 3.207 -3.538 -2.692 313 HB2 TYR 40 2HB TYR 40 4.187 -5.836 -2.352 314 HB3 TYR 40 1HB TYR 40 5.137 -5.586 -3.812 315 HD1 TYR 40 1HD TYR 40 6.969 -3.938 -3.834 316 HD2 TYR 40 2HD TYR 40 4.764 -4.751 -0.289 317 HE1 TYR 40 1HE TYR 40 8.728 -2.859 -2.500 318 HE2 TYR 40 2HE TYR 40 6.516 -3.677 1.056 319 HH TYR 40 HH TYR 40 9.163 -1.935 -0.421 320 H VAL 41 HN VAL 41 3.609 -1.604 -3.513 321 HA VAL 41 HA VAL 41 4.922 -1.448 -6.140 322 HB VAL 41 HB VAL 41 4.039 0.877 -6.266 323 HG11 VAL 41 1HG1 VAL 41 2.875 -0.942 -7.376 324 HG12 VAL 41 2HG1 VAL 41 1.732 0.254 -6.768 325 HG13 VAL 41 3HG1 VAL 41 1.956 -1.270 -5.909 326 HG21 VAL 41 3HG2 VAL 41 2.257 1.578 -4.765 327 HG22 VAL 41 1HG2 VAL 41 3.747 1.289 -3.868 328 HG23 VAL 41 2HG2 VAL 41 2.444 0.099 -3.825 329 H TRP 42 HN TRP 42 6.865 -0.524 -6.309 330 HA TRP 42 HA TRP 42 7.892 0.821 -3.914 331 HB2 TRP 42 2HB TRP 42 10.151 0.118 -4.569 332 HB3 TRP 42 1HB TRP 42 9.093 -1.260 -4.311 333 HD1 TRP 42 1HD TRP 42 7.952 -2.153 -6.859 334 HE1 TRP 42 1HE TRP 42 9.314 -2.632 -8.992 335 HE3 TRP 42 3HE TRP 42 12.129 0.603 -5.801 336 HZ2 TRP 42 2HZ TRP 42 11.816 -1.936 -10.080 337 HZ3 TRP 42 3HZ TRP 42 13.965 0.639 -7.441 338 HH2 TRP 42 2HH TRP 42 13.809 -0.606 -9.537 339 H GLY 43 HN GLY 43 8.267 2.854 -4.065 340 HA2 GLY 43 2HA GLY 43 9.472 4.104 -6.325 341 HA3 GLY 43 1HA GLY 43 7.751 4.470 -6.224 342 H GLU 44 HN GLU 44 10.626 5.719 -5.516 343 HA GLU 44 HA GLU 44 10.479 6.366 -2.774 344 HB2 GLU 44 2HB GLU 44 12.501 6.445 -4.320 345 HB3 GLU 44 1HB GLU 44 11.888 7.994 -4.881 346 HG2 GLU 44 2HG GLU 44 12.084 8.923 -2.672 347 HG3 GLU 44 1HG GLU 44 12.560 7.355 -2.022 348 H GLU 45 HN GLU 45 9.352 8.014 -5.678 349 HA GLU 45 HA GLU 45 7.204 9.215 -4.267 350 HB2 GLU 45 2HB GLU 45 9.278 10.739 -3.797 351 HB3 GLU 45 1HB GLU 45 9.061 11.259 -5.464 352 HG2 GLU 45 2HG GLU 45 6.758 11.930 -4.941 353 HG3 GLU 45 1HG GLU 45 7.013 11.452 -3.265 354 H GLY 46 HN GLY 46 6.048 10.840 -5.896 355 HA2 GLY 46 2HA GLY 46 6.392 11.007 -8.550 356 HA3 GLY 46 1HA GLY 46 5.823 9.353 -8.379 357 H ALA 47 HN ALA 47 3.700 8.990 -7.559 358 HA ALA 47 HA ALA 47 1.911 11.256 -8.106 359 HB1 ALA 47 1HB ALA 47 1.595 9.280 -9.510 360 HB2 ALA 47 2HB ALA 47 0.179 9.591 -8.504 361 HB3 ALA 47 3HB ALA 47 1.304 8.304 -8.069 362 H GLY 48 HN GLY 48 3.333 9.999 -5.524 363 HA2 GLY 48 2HA GLY 48 2.846 10.397 -3.278 364 HA3 GLY 48 1HA GLY 48 1.190 10.781 -3.732 365 H LYS 49 HN LYS 49 3.142 8.564 -2.231 366 HA LYS 49 HA LYS 49 2.072 6.073 -2.945 367 HB2 LYS 49 2HB LYS 49 2.963 6.785 -0.156 368 HB3 LYS 49 1HB LYS 49 3.090 5.235 -0.974 369 HG2 LYS 49 2HG LYS 49 4.868 5.996 -2.338 370 HG3 LYS 49 1HG LYS 49 4.607 7.675 -1.852 371 HD2 LYS 49 2HD LYS 49 5.152 6.971 0.499 372 HD3 LYS 49 1HD LYS 49 5.635 5.405 -0.156 373 HE2 LYS 49 2HE LYS 49 7.367 6.414 -1.462 374 HE3 LYS 49 1HE LYS 49 6.803 8.033 -1.051 375 HZ1 LYS 49 3HZ LYS 49 8.051 6.043 0.776 376 HZ2 LYS 49 1HZ LYS 49 7.336 7.492 1.299 377 HZ3 LYS 49 2HZ LYS 49 8.689 7.539 0.287 378 H SER 50 HN SER 50 1.344 8.145 -0.170 379 HA SER 50 HA SER 50 -0.723 6.629 0.913 380 HB2 SER 50 2HB SER 50 -0.670 9.623 1.127 381 HB3 SER 50 1HB SER 50 -1.041 8.422 2.368 382 HG SER 50 HG SER 50 1.289 7.769 2.007 383 H HIS 51 HN HIS 51 -0.748 9.102 -1.576 384 HA HIS 51 HA HIS 51 -3.533 9.557 -1.658 385 HB2 HIS 51 2HB HIS 51 -1.353 9.962 -3.709 386 HB3 HIS 51 1HB HIS 51 -3.034 10.374 -4.030 387 HD1 HIS 51 1HD HIS 51 -0.124 12.070 -3.251 388 HD2 HIS 51 2HD HIS 51 -3.914 12.061 -1.532 389 HE1 HIS 51 1HE HIS 51 -0.306 14.238 -1.999 390 HE2 HIS 51 2HE HIS 51 -2.665 14.293 -1.117 391 H LEU 52 HN LEU 52 -1.445 7.348 -3.494 392 HA LEU 52 HA LEU 52 -3.535 6.330 -5.129 393 HB2 LEU 52 2HB LEU 52 -0.867 5.113 -4.417 394 HB3 LEU 52 1HB LEU 52 -1.924 4.553 -5.700 395 HG LEU 52 HG LEU 52 -0.578 7.257 -5.595 396 HD11 LEU 52 1HD1 LEU 52 -0.020 4.831 -7.296 397 HD12 LEU 52 2HD1 LEU 52 1.002 5.449 -5.999 398 HD13 LEU 52 3HD1 LEU 52 0.757 6.404 -7.460 399 HD21 LEU 52 3HD2 LEU 52 -1.399 7.496 -7.893 400 HD22 LEU 52 1HD2 LEU 52 -2.724 7.355 -6.738 401 HD23 LEU 52 2HD2 LEU 52 -2.272 5.973 -7.737 402 H LEU 53 HN LEU 53 -2.296 5.501 -1.988 403 HA LEU 53 HA LEU 53 -3.574 2.958 -1.791 404 HB2 LEU 53 2HB LEU 53 -2.122 4.771 0.058 405 HB3 LEU 53 1HB LEU 53 -3.180 3.574 0.774 406 HG LEU 53 HG LEU 53 -1.919 1.777 -0.299 407 HD11 LEU 53 1HD1 LEU 53 0.168 2.230 -1.476 408 HD12 LEU 53 2HD1 LEU 53 -0.146 3.964 -1.371 409 HD13 LEU 53 3HD1 LEU 53 -1.213 2.932 -2.321 410 HD21 LEU 53 3HD2 LEU 53 -1.235 2.503 1.897 411 HD22 LEU 53 1HD2 LEU 53 -0.203 3.748 1.193 412 HD23 LEU 53 2HD2 LEU 53 0.176 2.043 0.946 413 H GLN 54 HN GLN 54 -4.370 6.200 -0.589 414 HA GLN 54 HA GLN 54 -6.625 5.392 0.904 415 HB2 GLN 54 2HB GLN 54 -5.816 8.076 -0.211 416 HB3 GLN 54 1HB GLN 54 -7.198 7.845 0.851 417 HG2 GLN 54 2HG GLN 54 -5.805 7.120 2.639 418 HG3 GLN 54 1HG GLN 54 -4.394 7.042 1.585 419 HE21 GLN 54 1HE2 GLN 54 -3.223 8.430 2.897 420 HE22 GLN 54 2HE2 GLN 54 -3.552 10.123 2.985 421 H ALA 55 HN ALA 55 -6.276 6.523 -2.418 422 HA ALA 55 HA ALA 55 -8.991 6.774 -3.081 423 HB1 ALA 55 1HB ALA 55 -7.188 7.569 -4.533 424 HB2 ALA 55 2HB ALA 55 -8.256 6.466 -5.402 425 HB3 ALA 55 3HB ALA 55 -6.687 5.905 -4.829 426 H TRP 56 HN TRP 56 -6.829 4.016 -3.063 427 HA TRP 56 HA TRP 56 -8.553 2.137 -4.273 428 HB2 TRP 56 2HB TRP 56 -6.149 1.819 -4.153 429 HB3 TRP 56 1HB TRP 56 -6.202 1.816 -2.398 430 HD1 TRP 56 1HD TRP 56 -7.622 -0.341 -5.302 431 HE1 TRP 56 1HE TRP 56 -7.504 -2.804 -4.557 432 HE3 TRP 56 3HE TRP 56 -5.875 0.334 -0.547 433 HZ2 TRP 56 2HZ TRP 56 -6.793 -4.249 -2.263 434 HZ3 TRP 56 3HZ TRP 56 -5.510 -1.649 0.864 435 HH2 TRP 56 2HH TRP 56 -5.962 -3.893 0.018 436 H VAL 57 HN VAL 57 -7.858 2.975 -0.923 437 HA VAL 57 HA VAL 57 -9.450 1.025 0.316 438 HB VAL 57 HB VAL 57 -8.537 3.747 1.251 439 HG11 VAL 57 1HG1 VAL 57 -9.908 1.607 2.880 440 HG12 VAL 57 2HG1 VAL 57 -10.564 3.195 2.478 441 HG13 VAL 57 3HG1 VAL 57 -9.150 3.063 3.523 442 HG21 VAL 57 3HG2 VAL 57 -7.606 0.935 1.783 443 HG22 VAL 57 1HG2 VAL 57 -7.033 2.350 2.664 444 HG23 VAL 57 2HG2 VAL 57 -6.741 2.217 0.932 445 H ALA 58 HN ALA 58 -10.199 4.385 -0.595 446 HA ALA 58 HA ALA 58 -12.817 4.391 0.471 447 HB1 ALA 58 1HB ALA 58 -13.163 6.404 -0.842 448 HB2 ALA 58 2HB ALA 58 -11.708 6.063 -1.779 449 HB3 ALA 58 3HB ALA 58 -11.582 6.439 -0.060 450 H GLN 59 HN GLN 59 -11.539 3.458 -2.681 451 HA GLN 59 HA GLN 59 -13.985 3.176 -4.040 452 HB2 GLN 59 2HB GLN 59 -11.720 3.148 -5.101 453 HB3 GLN 59 1HB GLN 59 -11.460 1.549 -4.425 454 HG2 GLN 59 2HG GLN 59 -13.821 2.055 -6.188 455 HG3 GLN 59 1HG GLN 59 -12.222 1.816 -6.889 456 HE21 GLN 59 1HE2 GLN 59 -14.669 0.188 -7.048 457 HE22 GLN 59 2HE2 GLN 59 -14.215 -1.388 -6.491 458 H ALA 60 HN ALA 60 -12.094 0.881 -2.117 459 HA ALA 60 HA ALA 60 -13.844 -1.311 -2.437 460 HB1 ALA 60 1HB ALA 60 -12.644 -2.287 -0.542 461 HB2 ALA 60 2HB ALA 60 -11.898 -0.724 -0.209 462 HB3 ALA 60 3HB ALA 60 -11.535 -1.574 -1.711 463 H LEU 61 HN LEU 61 -13.643 1.268 -0.033 464 HA LEU 61 HA LEU 61 -15.500 0.297 1.809 465 HB2 LEU 61 2HB LEU 61 -14.762 3.114 1.042 466 HB3 LEU 61 1HB LEU 61 -15.856 2.748 2.360 467 HG LEU 61 HG LEU 61 -12.977 1.859 2.201 468 HD11 LEU 61 1HD1 LEU 61 -12.577 3.489 3.956 469 HD12 LEU 61 2HD1 LEU 61 -14.265 3.994 3.897 470 HD13 LEU 61 3HD1 LEU 61 -13.208 4.278 2.512 471 HD21 LEU 61 3HD2 LEU 61 -15.000 1.626 4.426 472 HD22 LEU 61 1HD2 LEU 61 -13.298 1.175 4.524 473 HD23 LEU 61 2HD2 LEU 61 -14.382 0.298 3.443 474 H GLU 62 HN GLU 62 -16.017 2.417 -1.004 475 HA GLU 62 HA GLU 62 -18.824 2.611 -0.556 476 HB2 GLU 62 2HB GLU 62 -17.206 3.206 -3.031 477 HB3 GLU 62 1HB GLU 62 -18.903 3.618 -2.814 478 HG2 GLU 62 2HG GLU 62 -18.221 4.934 -0.799 479 HG3 GLU 62 1HG GLU 62 -16.550 4.677 -1.289 480 H ALA 63 HN ALA 63 -16.804 0.320 -2.154 481 HA ALA 63 HA ALA 63 -18.839 -0.867 -3.779 482 HB1 ALA 63 1HB ALA 63 -17.224 -2.623 -4.198 483 HB2 ALA 63 2HB ALA 63 -16.207 -2.033 -2.884 484 HB3 ALA 63 3HB ALA 63 -16.448 -1.044 -4.324 485 H GLY 64 HN GLY 64 -18.275 -0.872 -0.479 486 HA2 GLY 64 2HA GLY 64 -19.746 -1.890 1.064 487 HA3 GLY 64 1HA GLY 64 -20.153 -3.089 -0.153 488 H LYS 65 HN LYS 65 -16.826 -2.352 0.341 489 HA LYS 65 HA LYS 65 -16.454 -4.977 1.600 490 HB2 LYS 65 2HB LYS 65 -14.453 -3.210 0.170 491 HB3 LYS 65 1HB LYS 65 -14.137 -4.822 0.795 492 HG2 LYS 65 2HG LYS 65 -16.123 -4.187 -1.377 493 HG3 LYS 65 1HG LYS 65 -14.474 -4.754 -1.648 494 HD2 LYS 65 2HD LYS 65 -15.007 -6.782 -0.327 495 HD3 LYS 65 1HD LYS 65 -16.677 -6.225 -0.210 496 HE2 LYS 65 2HE LYS 65 -16.898 -6.307 -2.626 497 HE3 LYS 65 1HE LYS 65 -15.207 -6.777 -2.784 498 HZ1 LYS 65 3HZ LYS 65 -17.393 -8.354 -1.543 499 HZ2 LYS 65 1HZ LYS 65 -15.751 -8.788 -1.473 500 HZ3 LYS 65 2HZ LYS 65 -16.547 -8.719 -2.969 501 H ASN 66 HN ASN 66 -14.308 -4.939 2.965 502 HA ASN 66 HA ASN 66 -14.430 -2.630 4.781 503 HB2 ASN 66 2HB ASN 66 -14.543 -5.153 5.575 504 HB3 ASN 66 1HB ASN 66 -12.806 -5.072 5.374 505 HD21 ASN 66 1HD2 ASN 66 -14.243 -5.417 7.855 506 HD22 ASN 66 2HD2 ASN 66 -13.837 -4.072 8.855 507 H ALA 67 HN ALA 67 -12.671 -1.327 5.026 508 HA ALA 67 HA ALA 67 -10.145 -2.026 3.801 509 HB1 ALA 67 1HB ALA 67 -11.437 -1.299 1.874 510 HB2 ALA 67 2HB ALA 67 -10.139 -0.156 2.227 511 HB3 ALA 67 3HB ALA 67 -11.801 0.227 2.678 512 H ALA 68 HN ALA 68 -8.491 -1.035 4.756 513 HA ALA 68 HA ALA 68 -8.942 1.488 6.184 514 HB1 ALA 68 1HB ALA 68 -9.156 -0.296 7.843 515 HB2 ALA 68 2HB ALA 68 -7.719 0.684 8.137 516 HB3 ALA 68 3HB ALA 68 -7.566 -0.907 7.393 517 H TYR 69 HN TYR 69 -7.215 2.858 6.202 518 HA TYR 69 HA TYR 69 -4.794 1.961 4.799 519 HB2 TYR 69 2HB TYR 69 -4.513 4.268 3.999 520 HB3 TYR 69 1HB TYR 69 -6.056 3.616 3.476 521 HD1 TYR 69 1HD TYR 69 -8.147 4.309 4.757 522 HD2 TYR 69 2HD TYR 69 -4.398 6.258 5.237 523 HE1 TYR 69 1HE TYR 69 -9.292 6.256 5.728 524 HE2 TYR 69 2HE TYR 69 -5.530 8.210 6.211 525 HH TYR 69 HH TYR 69 -7.867 9.236 6.097 526 H ILE 70 HN ILE 70 -2.922 2.167 5.843 527 HA ILE 70 HA ILE 70 -2.792 3.923 8.205 528 HB ILE 70 HB ILE 70 -1.647 1.125 8.032 529 HG12 ILE 70 2HG1 ILE 70 -3.842 2.248 9.794 530 HG13 ILE 70 1HG1 ILE 70 -4.093 1.185 8.413 531 HG21 ILE 70 1HG2 ILE 70 -0.925 1.481 10.339 532 HG22 ILE 70 2HG2 ILE 70 -1.538 3.134 10.280 533 HG23 ILE 70 3HG2 ILE 70 -0.185 2.659 9.253 534 HD11 ILE 70 3HD1 ILE 70 -4.227 -0.004 10.540 535 HD12 ILE 70 1HD1 ILE 70 -2.571 0.475 10.911 536 HD13 ILE 70 2HD1 ILE 70 -2.898 -0.593 9.544 537 H ASP 71 HN ASP 71 -1.279 5.410 7.878 538 HA ASP 71 HA ASP 71 1.001 4.737 6.163 539 HB2 ASP 71 2HB ASP 71 1.321 7.188 5.919 540 HB3 ASP 71 1HB ASP 71 -0.237 6.642 5.321 541 H ALA 72 HN ALA 72 2.724 4.153 7.197 542 HA ALA 72 HA ALA 72 2.911 4.088 9.971 543 HB1 ALA 72 1HB ALA 72 4.076 2.541 8.486 544 HB2 ALA 72 2HB ALA 72 5.177 3.278 9.650 545 HB3 ALA 72 3HB ALA 72 5.155 3.841 7.979 546 H ALA 73 HN ALA 73 3.917 6.574 7.774 547 HA ALA 73 HA ALA 73 5.756 7.778 9.626 548 HB1 ALA 73 1HB ALA 73 6.031 9.525 7.975 549 HB2 ALA 73 2HB ALA 73 4.636 8.926 7.078 550 HB3 ALA 73 3HB ALA 73 6.094 7.942 7.199 551 H SER 74 HN SER 74 2.462 7.708 9.540 552 HA SER 74 HA SER 74 2.342 10.177 11.133 553 HB2 SER 74 2HB SER 74 1.408 10.699 8.954 554 HB3 SER 74 1HB SER 74 0.351 9.294 9.033 555 HG SER 74 HG SER 74 -1.023 10.560 9.946 556 H MET 75 HN MET 75 1.249 6.937 10.543 557 HA MET 75 HA MET 75 -0.117 6.921 13.145 558 HB2 MET 75 2HB MET 75 -1.193 5.812 10.546 559 HB3 MET 75 1HB MET 75 -1.850 5.400 12.119 560 HG2 MET 75 2HG MET 75 -2.259 7.850 12.473 561 HG3 MET 75 1HG MET 75 -1.823 8.088 10.783 562 HE1 MET 75 3HE MET 75 -3.047 5.322 9.570 563 HE2 MET 75 1HE MET 75 -3.170 6.884 8.756 564 HE3 MET 75 2HE MET 75 -4.615 5.903 9.009 565 HA PRO 76 HA PRO 76 2.178 3.112 13.531 566 HB2 PRO 76 2HB PRO 76 1.151 2.237 15.852 567 HB3 PRO 76 1HB PRO 76 2.206 3.654 15.788 568 HG2 PRO 76 2HG PRO 76 -0.765 3.510 16.027 569 HG3 PRO 76 1HG PRO 76 0.371 4.621 16.813 570 HD2 PRO 76 2HD PRO 76 -1.147 5.221 14.576 571 HD3 PRO 76 1HD PRO 76 0.335 6.066 15.055 572 H LEU 77 HN LEU 77 1.821 0.792 13.608 573 HA LEU 77 HA LEU 77 -0.579 -0.004 12.234 574 HB2 LEU 77 2HB LEU 77 1.672 -0.945 11.710 575 HB3 LEU 77 1HB LEU 77 1.674 -1.716 13.282 576 HG LEU 77 HG LEU 77 -0.284 -3.059 12.625 577 HD11 LEU 77 1HD1 LEU 77 -1.043 -3.079 10.318 578 HD12 LEU 77 2HD1 LEU 77 0.085 -1.784 9.918 579 HD13 LEU 77 3HD1 LEU 77 -1.255 -1.477 11.021 580 HD21 LEU 77 3HD2 LEU 77 0.871 -4.485 10.988 581 HD22 LEU 77 1HD2 LEU 77 1.937 -3.979 12.300 582 HD23 LEU 77 2HD2 LEU 77 2.051 -3.201 10.722 583 H THR 78 HN THR 78 -2.190 -1.399 13.062 584 HA THR 78 HA THR 78 -2.170 -1.748 15.971 585 HB THR 78 HB THR 78 -4.605 -1.098 15.974 586 HG1 THR 78 1HG THR 78 -4.344 0.454 13.728 587 HG21 THR 78 3HG2 THR 78 -4.187 1.318 15.953 588 HG22 THR 78 1HG2 THR 78 -2.640 1.041 15.151 589 HG23 THR 78 2HG2 THR 78 -2.904 0.446 16.791 590 H ASP 79 HN ASP 79 -3.658 -3.348 16.743 591 HA ASP 79 HA ASP 79 -3.842 -5.632 15.033 592 HB2 ASP 79 2HB ASP 79 -4.775 -6.761 16.971 593 HB3 ASP 79 1HB ASP 79 -3.389 -5.799 17.468 594 H ALA 80 HN ALA 80 -5.787 -2.934 15.591 595 HA ALA 80 HA ALA 80 -8.371 -4.006 15.150 596 HB1 ALA 80 1HB ALA 80 -8.006 -1.769 16.091 597 HB2 ALA 80 2HB ALA 80 -9.037 -1.711 14.662 598 HB3 ALA 80 3HB ALA 80 -7.346 -1.227 14.547 599 H ALA 81 HN ALA 81 -5.715 -3.268 13.063 600 HA ALA 81 HA ALA 81 -7.046 -2.902 10.625 601 HB1 ALA 81 1HB ALA 81 -4.908 -3.433 9.576 602 HB2 ALA 81 2HB ALA 81 -4.308 -4.071 11.109 603 HB3 ALA 81 3HB ALA 81 -4.691 -2.355 10.955 604 H PHE 82 HN PHE 82 -6.660 -5.722 12.513 605 HA PHE 82 HA PHE 82 -6.620 -7.717 10.539 606 HB2 PHE 82 2HB PHE 82 -7.398 -7.625 13.418 607 HB3 PHE 82 1HB PHE 82 -7.832 -9.044 12.474 608 HD1 PHE 82 2HD PHE 82 -5.024 -7.039 13.760 609 HD2 PHE 82 1HD PHE 82 -6.211 -10.621 11.798 610 HE1 PHE 82 2HE PHE 82 -2.771 -7.967 14.100 611 HE2 PHE 82 1HE PHE 82 -3.964 -11.559 12.137 612 HZ PHE 82 HZ PHE 82 -2.240 -10.235 13.285 613 H GLU 83 HN GLU 83 -9.195 -5.684 11.643 614 HA GLU 83 HA GLU 83 -11.315 -7.453 10.876 615 HB2 GLU 83 2HB GLU 83 -11.476 -4.483 11.367 616 HB3 GLU 83 1HB GLU 83 -12.790 -5.638 11.404 617 HG2 GLU 83 2HG GLU 83 -11.832 -6.723 13.347 618 HG3 GLU 83 1HG GLU 83 -10.467 -5.614 13.302 619 H ALA 84 HN ALA 84 -9.487 -4.909 9.371 620 HA ALA 84 HA ALA 84 -11.324 -4.629 7.145 621 HB1 ALA 84 1HB ALA 84 -10.130 -2.671 8.028 622 HB2 ALA 84 2HB ALA 84 -9.772 -2.957 6.325 623 HB3 ALA 84 3HB ALA 84 -8.599 -3.411 7.558 624 H GLU 85 HN GLU 85 -11.300 -5.926 5.462 625 HA GLU 85 HA GLU 85 -9.224 -7.827 5.057 626 HB2 GLU 85 2HB GLU 85 -10.566 -8.619 3.211 627 HB3 GLU 85 1HB GLU 85 -11.598 -8.294 4.576 628 HG2 GLU 85 2HG GLU 85 -12.149 -6.122 3.509 629 HG3 GLU 85 1HG GLU 85 -11.291 -6.677 2.085 630 H TYR 86 HN TYR 86 -10.248 -4.861 3.434 631 HA TYR 86 HA TYR 86 -7.911 -4.914 1.690 632 HB2 TYR 86 2HB TYR 86 -10.124 -2.899 2.097 633 HB3 TYR 86 1HB TYR 86 -8.721 -2.555 1.098 634 HD1 TYR 86 2HD TYR 86 -11.518 -5.008 1.444 635 HD2 TYR 86 1HD TYR 86 -8.763 -3.086 -1.153 636 HE1 TYR 86 2HE TYR 86 -12.653 -6.011 -0.493 637 HE2 TYR 86 1HE TYR 86 -9.893 -4.075 -3.097 638 HH TYR 86 HH TYR 86 -12.935 -5.583 -2.879 639 H LEU 87 HN LEU 87 -5.980 -4.457 2.603 640 HA LEU 87 HA LEU 87 -5.915 -2.319 4.628 641 HB2 LEU 87 2HB LEU 87 -5.382 -4.933 5.100 642 HB3 LEU 87 1HB LEU 87 -3.786 -4.363 4.657 643 HG LEU 87 HG LEU 87 -4.139 -4.342 7.084 644 HD11 LEU 87 1HD1 LEU 87 -3.891 -1.588 5.892 645 HD12 LEU 87 2HD1 LEU 87 -2.581 -2.744 6.133 646 HD13 LEU 87 3HD1 LEU 87 -3.414 -2.052 7.525 647 HD21 LEU 87 3HD2 LEU 87 -6.281 -2.309 6.487 648 HD22 LEU 87 1HD2 LEU 87 -5.701 -2.759 8.091 649 HD23 LEU 87 2HD2 LEU 87 -6.540 -3.945 7.091 650 H ALA 88 HN ALA 88 -4.808 -0.605 3.996 651 HA ALA 88 HA ALA 88 -2.669 -0.954 1.991 652 HB1 ALA 88 1HB ALA 88 -4.569 0.398 1.224 653 HB2 ALA 88 2HB ALA 88 -3.077 1.334 1.307 654 HB3 ALA 88 3HB ALA 88 -4.302 1.516 2.565 655 H VAL 89 HN VAL 89 -0.667 -0.675 2.724 656 HA VAL 89 HA VAL 89 -0.302 0.923 5.180 657 HB VAL 89 HB VAL 89 1.411 -1.382 4.228 658 HG11 VAL 89 1HG1 VAL 89 2.436 -1.212 6.467 659 HG12 VAL 89 2HG1 VAL 89 1.485 0.243 6.769 660 HG13 VAL 89 3HG1 VAL 89 2.697 0.233 5.489 661 HG21 VAL 89 3HG2 VAL 89 -0.767 -2.173 4.977 662 HG22 VAL 89 1HG2 VAL 89 -0.590 -1.271 6.482 663 HG23 VAL 89 2HG2 VAL 89 0.491 -2.618 6.129 664 H ASP 90 HN ASP 90 0.753 2.733 4.911 665 HA ASP 90 HA ASP 90 2.362 3.169 2.510 666 HB2 ASP 90 2HB ASP 90 0.672 4.856 3.130 667 HB3 ASP 90 1HB ASP 90 1.483 5.103 4.671 668 H GLN 91 HN GLN 91 4.496 3.118 2.516 669 HA GLN 91 HA GLN 91 6.650 3.016 3.176 670 HB2 GLN 91 2HB GLN 91 5.520 4.762 5.343 671 HB3 GLN 91 1HB GLN 91 7.216 4.309 5.342 672 HG2 GLN 91 2HG GLN 91 7.564 5.359 3.222 673 HG3 GLN 91 1HG GLN 91 5.837 5.641 3.028 674 HE21 GLN 91 1HE2 GLN 91 4.838 7.257 4.178 675 HE22 GLN 91 2HE2 GLN 91 5.741 8.522 4.957 676 H VAL 92 HN VAL 92 5.901 0.725 3.397 677 HA VAL 92 HA VAL 92 5.478 -0.475 5.921 678 HB VAL 92 HB VAL 92 6.632 -1.795 3.460 679 HG11 VAL 92 1HG1 VAL 92 5.563 -3.813 4.354 680 HG12 VAL 92 2HG1 VAL 92 5.062 -2.903 5.780 681 HG13 VAL 92 3HG1 VAL 92 6.776 -3.160 5.454 682 HG21 VAL 92 3HG2 VAL 92 4.334 -2.316 2.820 683 HG22 VAL 92 1HG2 VAL 92 4.598 -0.573 2.883 684 HG23 VAL 92 2HG2 VAL 92 3.734 -1.381 4.191 685 H GLU 93 HN GLU 93 8.348 0.310 4.098 686 HA GLU 93 HA GLU 93 10.183 -1.297 5.539 687 HB2 GLU 93 2HB GLU 93 11.899 0.179 4.504 688 HB3 GLU 93 1HB GLU 93 10.748 -0.471 3.346 689 HG2 GLU 93 2HG GLU 93 9.500 1.665 3.464 690 HG3 GLU 93 1HG GLU 93 10.769 2.303 4.506 691 H LYS 94 HN LYS 94 8.490 1.461 6.468 692 HA LYS 94 HA LYS 94 10.519 2.454 8.276 693 HB2 LYS 94 2HB LYS 94 8.168 3.504 7.059 694 HB3 LYS 94 1HB LYS 94 7.981 3.621 8.803 695 HG2 LYS 94 2HG LYS 94 8.982 5.630 7.782 696 HG3 LYS 94 1HG LYS 94 10.009 4.877 9.003 697 HD2 LYS 94 2HD LYS 94 11.401 5.471 7.170 698 HD3 LYS 94 1HD LYS 94 11.229 3.725 7.139 699 HE2 LYS 94 2HE LYS 94 9.518 3.934 5.396 700 HE3 LYS 94 1HE LYS 94 9.709 5.688 5.427 701 HZ1 LYS 94 3HZ LYS 94 10.973 4.760 3.611 702 HZ2 LYS 94 1HZ LYS 94 11.790 3.706 4.663 703 HZ3 LYS 94 2HZ LYS 94 12.041 5.373 4.775 704 H LEU 95 HN LEU 95 8.451 -0.109 8.370 705 HA LEU 95 HA LEU 95 7.569 0.155 11.109 706 HB2 LEU 95 2HB LEU 95 7.467 -2.196 9.213 707 HB3 LEU 95 1HB LEU 95 6.693 -2.129 10.782 708 HG LEU 95 HG LEU 95 6.013 -0.391 8.408 709 HD11 LEU 95 1HD1 LEU 95 4.468 -2.623 9.718 710 HD12 LEU 95 2HD1 LEU 95 5.316 -2.734 8.176 711 HD13 LEU 95 3HD1 LEU 95 3.939 -1.645 8.348 712 HD21 LEU 95 3HD2 LEU 95 4.140 0.387 9.778 713 HD22 LEU 95 1HD2 LEU 95 5.690 0.798 10.515 714 HD23 LEU 95 2HD2 LEU 95 4.746 -0.553 11.142 715 H GLY 96 HN GLY 96 8.477 -0.772 12.884 716 HA2 GLY 96 2HA GLY 96 11.224 -1.674 12.507 717 HA3 GLY 96 1HA GLY 96 10.503 -1.137 14.012 718 H ASN 97 HN ASN 97 9.864 -2.616 15.446 719 HA ASN 97 HA ASN 97 10.559 -5.370 14.749 720 HB2 ASN 97 2HB ASN 97 11.756 -4.390 16.616 721 HB3 ASN 97 1HB ASN 97 10.245 -3.983 17.417 722 HD21 ASN 97 1HD2 ASN 97 10.923 -5.123 19.232 723 HD22 ASN 97 2HD2 ASN 97 10.878 -6.854 19.284 724 H GLU 98 HN GLU 98 8.147 -3.882 16.929 725 HA GLU 98 HA GLU 98 6.575 -6.237 17.031 726 HB2 GLU 98 2HB GLU 98 5.813 -3.399 17.738 727 HB3 GLU 98 1HB GLU 98 4.924 -4.844 18.204 728 HG2 GLU 98 2HG GLU 98 6.868 -5.611 19.486 729 HG3 GLU 98 1HG GLU 98 7.725 -4.135 19.045 730 H GLU 99 HN GLU 99 6.436 -3.303 15.132 731 HA GLU 99 HA GLU 99 3.917 -3.632 13.959 732 HB2 GLU 99 2HB GLU 99 6.331 -2.410 12.612 733 HB3 GLU 99 1HB GLU 99 4.639 -2.045 12.304 734 HG2 GLU 99 2HG GLU 99 5.178 -0.251 13.577 735 HG3 GLU 99 1HG GLU 99 4.689 -1.361 14.854 736 H GLN 100 HN GLN 100 7.089 -4.858 13.008 737 HA GLN 100 HA GLN 100 6.278 -6.004 10.553 738 HB2 GLN 100 2HB GLN 100 8.590 -5.599 10.874 739 HB3 GLN 100 1HB GLN 100 8.620 -6.492 12.384 740 HG2 GLN 100 2HG GLN 100 8.432 -8.570 11.260 741 HG3 GLN 100 1HG GLN 100 8.084 -7.781 9.724 742 HE21 GLN 100 1HE2 GLN 100 10.464 -6.468 11.847 743 HE22 GLN 100 2HE2 GLN 100 11.852 -6.923 10.926 744 H ALA 101 HN ALA 101 6.518 -7.301 13.841 745 HA ALA 101 HA ALA 101 5.835 -9.965 13.174 746 HB1 ALA 101 1HB ALA 101 5.424 -10.255 15.566 747 HB2 ALA 101 2HB ALA 101 5.490 -8.505 15.793 748 HB3 ALA 101 3HB ALA 101 6.927 -9.382 15.271 749 H LEU 102 HN LEU 102 3.946 -7.148 14.103 750 HA LEU 102 HA LEU 102 1.436 -8.411 14.332 751 HB2 LEU 102 2HB LEU 102 2.253 -6.023 14.999 752 HB3 LEU 102 1HB LEU 102 1.790 -5.591 13.368 753 HG LEU 102 HG LEU 102 0.081 -5.049 15.080 754 HD11 LEU 102 1HD1 LEU 102 -0.590 -5.355 12.767 755 HD12 LEU 102 2HD1 LEU 102 -1.839 -5.928 13.872 756 HD13 LEU 102 3HD1 LEU 102 -0.794 -7.084 13.046 757 HD21 LEU 102 3HD2 LEU 102 -1.263 -6.890 16.021 758 HD22 LEU 102 1HD2 LEU 102 0.405 -6.894 16.595 759 HD23 LEU 102 2HD2 LEU 102 -0.102 -8.040 15.357 760 H LEU 103 HN LEU 103 2.960 -6.665 11.642 761 HA LEU 103 HA LEU 103 0.947 -6.953 9.744 762 HB2 LEU 103 2HB LEU 103 2.925 -5.501 9.501 763 HB3 LEU 103 1HB LEU 103 3.929 -6.920 9.271 764 HG LEU 103 HG LEU 103 2.654 -7.452 7.209 765 HD11 LEU 103 1HD1 LEU 103 0.560 -6.336 7.812 766 HD12 LEU 103 2HD1 LEU 103 1.168 -5.784 6.251 767 HD13 LEU 103 3HD1 LEU 103 1.360 -4.770 7.680 768 HD21 LEU 103 3HD2 LEU 103 3.627 -5.688 5.845 769 HD22 LEU 103 1HD2 LEU 103 4.746 -6.195 7.110 770 HD23 LEU 103 2HD2 LEU 103 3.849 -4.687 7.281 771 H PHE 104 HN PHE 104 3.555 -9.168 10.609 772 HA PHE 104 HA PHE 104 3.244 -11.077 8.603 773 HB2 PHE 104 2HB PHE 104 5.097 -11.103 10.196 774 HB3 PHE 104 1HB PHE 104 3.987 -11.462 11.511 775 HD1 PHE 104 2HD PHE 104 5.037 -12.846 8.204 776 HD2 PHE 104 1HD PHE 104 3.750 -13.652 12.183 777 HE1 PHE 104 2HE PHE 104 5.338 -15.259 7.812 778 HE2 PHE 104 1HE PHE 104 4.060 -16.063 11.799 779 HZ PHE 104 HZ PHE 104 4.854 -16.868 9.614 780 H SER 105 HN SER 105 1.623 -10.823 11.745 781 HA SER 105 HA SER 105 0.026 -13.113 11.461 782 HB2 SER 105 2HB SER 105 -0.307 -10.622 13.135 783 HB3 SER 105 1HB SER 105 -1.277 -12.077 13.313 784 HG SER 105 HG SER 105 0.997 -13.086 13.437 785 H ILE 106 HN ILE 106 -0.415 -9.779 10.448 786 HA ILE 106 HA ILE 106 -3.133 -9.888 9.760 787 HB ILE 106 HB ILE 106 -0.915 -8.300 8.450 788 HG12 ILE 106 2HG1 ILE 106 -2.906 -7.541 10.601 789 HG13 ILE 106 1HG1 ILE 106 -1.191 -7.849 10.854 790 HG21 ILE 106 1HG2 ILE 106 -2.846 -8.457 6.981 791 HG22 ILE 106 2HG2 ILE 106 -2.694 -6.826 7.634 792 HG23 ILE 106 3HG2 ILE 106 -3.904 -7.929 8.289 793 HD11 ILE 106 3HD1 ILE 106 -1.669 -5.468 10.812 794 HD12 ILE 106 1HD1 ILE 106 -2.356 -5.624 9.194 795 HD13 ILE 106 2HD1 ILE 106 -0.639 -5.928 9.457 796 H PHE 107 HN PHE 107 -0.249 -10.513 7.757 797 HA PHE 107 HA PHE 107 -1.578 -11.381 5.452 798 HB2 PHE 107 2HB PHE 107 1.135 -11.905 6.618 799 HB3 PHE 107 1HB PHE 107 0.612 -12.812 5.209 800 HD1 PHE 107 1HD PHE 107 1.445 -9.468 6.490 801 HD2 PHE 107 2HD PHE 107 0.519 -11.813 3.061 802 HE1 PHE 107 1HE PHE 107 2.197 -7.633 5.035 803 HE2 PHE 107 2HE PHE 107 1.262 -9.980 1.602 804 HZ PHE 107 HZ PHE 107 2.105 -7.888 2.585 805 H ASN 108 HN ASN 108 -0.644 -13.059 8.390 806 HA ASN 108 HA ASN 108 -1.147 -15.692 7.555 807 HB2 ASN 108 2HB ASN 108 0.136 -15.031 9.584 808 HB3 ASN 108 1HB ASN 108 -1.375 -14.561 10.352 809 HD21 ASN 108 1HD2 ASN 108 -1.017 -16.045 12.005 810 HD22 ASN 108 2HD2 ASN 108 -1.245 -17.745 11.769 811 H ARG 109 HN ARG 109 -3.256 -13.349 9.229 812 HA ARG 109 HA ARG 109 -5.475 -15.080 9.463 813 HB2 ARG 109 2HB ARG 109 -5.313 -13.041 10.797 814 HB3 ARG 109 1HB ARG 109 -5.401 -12.053 9.347 815 HG2 ARG 109 2HG ARG 109 -7.638 -13.937 9.876 816 HG3 ARG 109 1HG ARG 109 -7.514 -12.495 10.883 817 HD2 ARG 109 2HD ARG 109 -7.868 -11.059 9.094 818 HD3 ARG 109 1HD ARG 109 -7.339 -12.249 7.905 819 HE ARG 109 HE ARG 109 -9.489 -13.454 8.536 820 HH11 ARG 109 1HH1 ARG 109 -9.169 -9.956 8.639 821 HH12 ARG 109 2HH1 ARG 109 -10.857 -9.680 8.333 822 HH21 ARG 109 1HH2 ARG 109 -11.712 -13.055 8.113 823 HH22 ARG 109 2HH2 ARG 109 -12.273 -11.411 8.026 824 H PHE 110 HN PHE 110 -4.568 -12.754 6.938 825 HA PHE 110 HA PHE 110 -6.941 -13.029 5.445 826 HB2 PHE 110 2HB PHE 110 -4.170 -12.145 4.661 827 HB3 PHE 110 1HB PHE 110 -5.530 -12.131 3.544 828 HD1 PHE 110 1HD PHE 110 -7.564 -11.387 5.791 829 HD2 PHE 110 2HD PHE 110 -3.842 -9.765 4.524 830 HE1 PHE 110 1HE PHE 110 -8.244 -9.180 6.633 831 HE2 PHE 110 2HE PHE 110 -4.517 -7.553 5.359 832 HZ PHE 110 HZ PHE 110 -6.721 -7.257 6.420 833 H ARG 111 HN ARG 111 -3.830 -14.711 5.236 834 HA ARG 111 HA ARG 111 -4.430 -16.379 3.061 835 HB2 ARG 111 2HB ARG 111 -2.601 -16.646 5.428 836 HB3 ARG 111 1HB ARG 111 -2.781 -17.972 4.292 837 HG2 ARG 111 2HG ARG 111 -2.062 -15.212 3.385 838 HG3 ARG 111 1HG ARG 111 -0.843 -16.356 3.955 839 HD2 ARG 111 2HD ARG 111 -2.818 -16.966 1.768 840 HD3 ARG 111 1HD ARG 111 -1.205 -16.327 1.479 841 HE ARG 111 HE ARG 111 -0.512 -18.441 2.814 842 HH11 ARG 111 1HH1 ARG 111 -3.205 -18.257 0.569 843 HH12 ARG 111 2HH1 ARG 111 -3.041 -19.906 0.055 844 HH21 ARG 111 1HH2 ARG 111 -0.309 -20.608 2.150 845 HH22 ARG 111 2HH2 ARG 111 -1.418 -21.242 0.959 846 H ASN 112 HN ASN 112 -5.328 -16.524 6.418 847 HA ASN 112 HA ASN 112 -6.222 -19.236 6.363 848 HB2 ASN 112 2HB ASN 112 -6.261 -17.004 8.336 849 HB3 ASN 112 1HB ASN 112 -7.348 -18.360 8.592 850 HD21 ASN 112 1HD2 ASN 112 -5.002 -17.447 10.103 851 HD22 ASN 112 2HD2 ASN 112 -3.953 -18.817 10.195 852 H SER 113 HN SER 113 -7.853 -16.077 6.288 853 HA SER 113 HA SER 113 -10.466 -17.261 6.231 854 HB2 SER 113 2HB SER 113 -9.615 -14.419 5.620 855 HB3 SER 113 1HB SER 113 -11.264 -14.963 5.927 856 HG SER 113 HG SER 113 -10.363 -15.743 8.018 857 H GLY 114 HN GLY 114 -8.385 -15.678 3.812 858 HA2 GLY 114 2HA GLY 114 -8.352 -16.854 1.614 859 HA3 GLY 114 1HA GLY 114 -10.110 -16.879 1.727 860 H LYS 115 HN LYS 115 -10.203 -14.262 2.931 861 HA LYS 115 HA LYS 115 -9.937 -12.627 0.558 862 HB2 LYS 115 2HB LYS 115 -11.410 -12.484 3.118 863 HB3 LYS 115 1HB LYS 115 -10.922 -10.958 2.416 864 HG2 LYS 115 2HG LYS 115 -11.991 -11.806 0.258 865 HG3 LYS 115 1HG LYS 115 -12.708 -13.056 1.263 866 HD2 LYS 115 2HD LYS 115 -13.056 -10.088 1.629 867 HD3 LYS 115 1HD LYS 115 -14.238 -11.186 0.918 868 HE2 LYS 115 2HE LYS 115 -14.335 -12.414 3.055 869 HE3 LYS 115 1HE LYS 115 -13.215 -11.239 3.752 870 HZ1 LYS 115 3HZ LYS 115 -15.509 -10.707 4.293 871 HZ2 LYS 115 1HZ LYS 115 -15.902 -10.622 2.644 872 HZ3 LYS 115 2HZ LYS 115 -14.826 -9.492 3.320 873 H GLY 116 HN GLY 116 -9.517 -10.128 1.719 874 HA2 GLY 116 2HA GLY 116 -7.833 -8.973 2.979 875 HA3 GLY 116 1HA GLY 116 -6.848 -10.425 2.923 876 H PHE 117 HN PHE 117 -7.110 -7.417 1.818 877 HA PHE 117 HA PHE 117 -5.610 -7.982 -0.656 878 HB2 PHE 117 2HB PHE 117 -7.579 -5.750 -0.080 879 HB3 PHE 117 1HB PHE 117 -6.521 -5.785 -1.482 880 HD1 PHE 117 2HD PHE 117 -8.993 -8.051 0.191 881 HD2 PHE 117 1HD PHE 117 -7.464 -6.452 -3.440 882 HE1 PHE 117 2HE PHE 117 -10.696 -9.301 -1.067 883 HE2 PHE 117 1HE PHE 117 -9.166 -7.696 -4.709 884 HZ PHE 117 HZ PHE 117 -10.785 -9.124 -3.523 885 H LEU 118 HN LEU 118 -3.554 -7.299 -0.467 886 HA LEU 118 HA LEU 118 -2.970 -5.277 1.584 887 HB2 LEU 118 2HB LEU 118 -1.442 -7.628 0.569 888 HB3 LEU 118 1HB LEU 118 -0.554 -6.246 1.162 889 HG LEU 118 HG LEU 118 -0.728 -7.847 2.921 890 HD11 LEU 118 1HD1 LEU 118 -1.825 -6.529 4.650 891 HD12 LEU 118 2HD1 LEU 118 -2.641 -5.572 3.412 892 HD13 LEU 118 3HD1 LEU 118 -0.884 -5.505 3.566 893 HD21 LEU 118 3HD2 LEU 118 -2.895 -8.554 3.810 894 HD22 LEU 118 1HD2 LEU 118 -2.638 -9.103 2.156 895 HD23 LEU 118 2HD2 LEU 118 -3.702 -7.733 2.475 896 H LEU 119 HN LEU 119 -2.808 -3.340 0.702 897 HA LEU 119 HA LEU 119 -1.235 -3.066 -1.768 898 HB2 LEU 119 2HB LEU 119 -3.466 -2.010 -1.772 899 HB3 LEU 119 1HB LEU 119 -3.001 -1.040 -0.387 900 HG LEU 119 HG LEU 119 -1.251 0.047 -1.751 901 HD11 LEU 119 1HD1 LEU 119 -0.818 -1.741 -3.328 902 HD12 LEU 119 2HD1 LEU 119 -1.266 -0.264 -4.180 903 HD13 LEU 119 3HD1 LEU 119 -2.441 -1.567 -3.999 904 HD21 LEU 119 3HD2 LEU 119 -4.018 0.148 -2.937 905 HD22 LEU 119 1HD2 LEU 119 -2.763 1.372 -3.135 906 HD23 LEU 119 2HD2 LEU 119 -3.451 1.063 -1.541 907 H LEU 120 HN LEU 120 0.829 -2.968 -1.239 908 HA LEU 120 HA LEU 120 1.600 -1.416 1.140 909 HB2 LEU 120 2HB LEU 120 3.164 -3.560 -0.295 910 HB3 LEU 120 1HB LEU 120 3.621 -2.762 1.196 911 HG LEU 120 HG LEU 120 1.248 -4.593 0.840 912 HD11 LEU 120 1HD1 LEU 120 3.877 -5.003 2.248 913 HD12 LEU 120 2HD1 LEU 120 3.331 -5.813 0.778 914 HD13 LEU 120 3HD1 LEU 120 2.501 -6.106 2.307 915 HD21 LEU 120 3HD2 LEU 120 0.787 -2.880 2.493 916 HD22 LEU 120 1HD2 LEU 120 2.318 -3.224 3.302 917 HD23 LEU 120 2HD2 LEU 120 1.040 -4.440 3.276 918 H GLY 121 HN GLY 121 2.261 0.549 0.640 919 HA2 GLY 121 2HA GLY 121 3.757 0.937 -1.875 920 HA3 GLY 121 1HA GLY 121 2.853 2.193 -1.036 921 H SER 122 HN SER 122 5.891 1.087 -1.657 922 HA SER 122 HA SER 122 6.975 2.517 0.659 923 HB2 SER 122 2HB SER 122 6.874 -0.164 0.790 924 HB3 SER 122 1HB SER 122 8.368 0.001 -0.130 925 HG SER 122 HG SER 122 9.332 0.942 1.545 926 H GLU 123 HN GLU 123 9.571 2.524 0.270 927 HA GLU 123 HA GLU 123 9.842 3.836 -2.292 928 HB2 GLU 123 2HB GLU 123 11.757 3.487 0.015 929 HB3 GLU 123 1HB GLU 123 12.185 4.308 -1.478 930 HG2 GLU 123 2HG GLU 123 11.600 6.097 -0.219 931 HG3 GLU 123 1HG GLU 123 10.034 5.720 -0.930 932 H TYR 124 HN TYR 124 11.335 1.066 -0.636 933 HA TYR 124 HA TYR 124 12.390 0.242 -3.262 934 HB2 TYR 124 2HB TYR 124 13.642 -0.316 -0.567 935 HB3 TYR 124 1HB TYR 124 14.307 -0.750 -2.140 936 HD1 TYR 124 1HD TYR 124 14.352 1.446 -3.802 937 HD2 TYR 124 2HD TYR 124 14.662 1.483 0.448 938 HE1 TYR 124 1HE TYR 124 15.477 3.630 -3.909 939 HE2 TYR 124 2HE TYR 124 15.790 3.667 0.349 940 HH TYR 124 HH TYR 124 15.762 5.636 -2.318 941 H THR 125 HN THR 125 13.131 -2.284 -2.899 942 HA THR 125 HA THR 125 10.528 -3.556 -2.651 943 HB THR 125 HB THR 125 11.807 -5.506 -3.715 944 HG1 THR 125 1HG THR 125 13.721 -4.612 -4.888 945 HG21 THR 125 3HG2 THR 125 11.552 -2.881 -5.187 946 HG22 THR 125 1HG2 THR 125 10.275 -4.075 -4.957 947 HG23 THR 125 2HG2 THR 125 11.682 -4.470 -5.944 948 HA PRO 126 HA PRO 126 11.112 -5.498 1.144 949 HB2 PRO 126 2HB PRO 126 10.067 -8.065 0.210 950 HB3 PRO 126 1HB PRO 126 9.336 -6.893 1.310 951 HG2 PRO 126 2HG PRO 126 8.399 -7.331 -1.188 952 HG3 PRO 126 1HG PRO 126 8.294 -5.752 -0.389 953 HD2 PRO 126 2HD PRO 126 10.210 -6.695 -2.479 954 HD3 PRO 126 1HD PRO 126 9.426 -5.111 -2.298 955 H GLN 127 HN GLN 127 12.277 -7.417 -1.577 956 HA GLN 127 HA GLN 127 13.795 -9.152 0.186 957 HB2 GLN 127 2HB GLN 127 13.686 -9.054 -2.837 958 HB3 GLN 127 1HB GLN 127 14.449 -10.318 -1.876 959 HG2 GLN 127 2HG GLN 127 12.296 -10.920 -0.927 960 HG3 GLN 127 1HG GLN 127 11.518 -9.623 -1.835 961 HE21 GLN 127 1HE2 GLN 127 11.286 -9.832 -4.069 962 HE22 GLN 127 2HE2 GLN 127 11.415 -11.363 -4.863 963 H GLN 128 HN GLN 128 14.229 -6.117 -0.907 964 HA GLN 128 HA GLN 128 17.165 -6.389 -0.953 965 HB2 GLN 128 2HB GLN 128 16.036 -5.334 -2.969 966 HB3 GLN 128 1HB GLN 128 15.557 -4.013 -1.914 967 HG2 GLN 128 2HG GLN 128 17.946 -3.598 -1.427 968 HG3 GLN 128 1HG GLN 128 18.364 -4.843 -2.603 969 HE21 GLN 128 1HE2 GLN 128 17.183 -1.630 -2.115 970 HE22 GLN 128 2HE2 GLN 128 17.262 -1.133 -3.776 971 H LEU 129 HN LEU 129 14.576 -5.592 0.943 972 HA LEU 129 HA LEU 129 15.922 -3.503 2.466 973 HB2 LEU 129 2HB LEU 129 13.171 -4.726 2.666 974 HB3 LEU 129 1HB LEU 129 13.778 -3.516 3.774 975 HG LEU 129 HG LEU 129 13.426 -3.105 0.805 976 HD11 LEU 129 1HD1 LEU 129 11.514 -1.708 1.433 977 HD12 LEU 129 2HD1 LEU 129 11.721 -2.189 3.118 978 HD13 LEU 129 3HD1 LEU 129 11.279 -3.391 1.906 979 HD21 LEU 129 3HD2 LEU 129 13.764 -0.735 1.355 980 HD22 LEU 129 1HD2 LEU 129 15.180 -1.710 1.741 981 HD23 LEU 129 2HD2 LEU 129 14.099 -1.179 3.028 982 H VAL 130 HN VAL 130 16.116 -3.741 4.800 983 HA VAL 130 HA VAL 130 17.013 -6.407 5.504 984 HB VAL 130 HB VAL 130 17.109 -3.891 7.172 985 HG11 VAL 130 1HG1 VAL 130 18.622 -6.490 7.443 986 HG12 VAL 130 2HG1 VAL 130 17.323 -5.927 8.494 987 HG13 VAL 130 3HG1 VAL 130 18.853 -5.052 8.437 988 HG21 VAL 130 3HG2 VAL 130 19.224 -5.061 5.363 989 HG22 VAL 130 1HG2 VAL 130 19.456 -3.698 6.459 990 HG23 VAL 130 2HG2 VAL 130 18.338 -3.559 5.101 991 H ILE 131 HN ILE 131 15.036 -7.475 5.601 992 HA ILE 131 HA ILE 131 13.529 -6.975 8.076 993 HB ILE 131 HB ILE 131 11.483 -7.841 6.956 994 HG12 ILE 131 2HG1 ILE 131 13.073 -7.477 4.403 995 HG13 ILE 131 1HG1 ILE 131 12.620 -9.032 5.095 996 HG21 ILE 131 1HG2 ILE 131 11.781 -5.465 7.274 997 HG22 ILE 131 2HG2 ILE 131 10.969 -5.769 5.737 998 HG23 ILE 131 3HG2 ILE 131 12.682 -5.348 5.763 999 HD11 ILE 131 3HD1 ILE 131 10.261 -8.458 4.804 1000 HD12 ILE 131 1HD1 ILE 131 11.145 -8.428 3.277 1001 HD13 ILE 131 2HD1 ILE 131 10.736 -6.917 4.089 1002 H ARG 132 HN ARG 132 12.170 -9.042 8.591 1003 HA ARG 132 HA ARG 132 14.152 -11.140 8.807 1004 HB2 ARG 132 2HB ARG 132 11.409 -10.814 10.017 1005 HB3 ARG 132 1HB ARG 132 12.437 -12.216 10.293 1006 HG2 ARG 132 2HG ARG 132 14.173 -10.723 11.208 1007 HG3 ARG 132 1HG ARG 132 13.068 -9.363 11.019 1008 HD2 ARG 132 2HD ARG 132 11.534 -10.298 12.590 1009 HD3 ARG 132 1HD ARG 132 12.430 -11.817 12.638 1010 HE ARG 132 HE ARG 132 13.481 -9.254 13.678 1011 HH11 ARG 132 1HH1 ARG 132 13.105 -12.739 13.841 1012 HH12 ARG 132 2HH1 ARG 132 14.077 -12.898 15.278 1013 HH21 ARG 132 1HH2 ARG 132 14.730 -9.467 15.590 1014 HH22 ARG 132 2HH2 ARG 132 14.975 -11.044 16.283 1015 H GLU 133 HN GLU 133 13.722 -13.348 8.361 1016 HA GLU 133 HA GLU 133 12.904 -13.873 5.766 1017 HB2 GLU 133 2HB GLU 133 12.905 -15.862 8.041 1018 HB3 GLU 133 1HB GLU 133 13.063 -16.221 6.327 1019 HG2 GLU 133 2HG GLU 133 15.047 -14.754 8.045 1020 HG3 GLU 133 1HG GLU 133 15.197 -16.394 7.420 1021 H ASP 134 HN ASP 134 11.105 -14.138 8.771 1022 HA ASP 134 HA ASP 134 8.868 -15.531 7.899 1023 HB2 ASP 134 2HB ASP 134 9.046 -13.338 9.975 1024 HB3 ASP 134 1HB ASP 134 7.687 -14.440 9.793 1025 H LEU 135 HN LEU 135 9.517 -12.055 7.838 1026 HA LEU 135 HA LEU 135 6.942 -11.461 6.697 1027 HB2 LEU 135 2HB LEU 135 8.132 -9.885 8.210 1028 HB3 LEU 135 1HB LEU 135 9.362 -9.674 6.977 1029 HG LEU 135 HG LEU 135 7.562 -8.800 5.450 1030 HD11 LEU 135 1HD1 LEU 135 5.482 -8.031 6.488 1031 HD12 LEU 135 2HD1 LEU 135 5.952 -8.813 7.997 1032 HD13 LEU 135 3HD1 LEU 135 5.640 -9.786 6.560 1033 HD21 LEU 135 3HD2 LEU 135 7.516 -6.594 6.465 1034 HD22 LEU 135 1HD2 LEU 135 9.108 -7.324 6.662 1035 HD23 LEU 135 2HD2 LEU 135 7.985 -7.279 8.020 1036 H ARG 136 HN ARG 136 10.282 -11.681 5.562 1037 HA ARG 136 HA ARG 136 9.870 -10.571 3.017 1038 HB2 ARG 136 2HB ARG 136 12.100 -10.868 4.028 1039 HB3 ARG 136 1HB ARG 136 11.947 -12.610 3.838 1040 HG2 ARG 136 2HG ARG 136 12.004 -12.452 1.476 1041 HG3 ARG 136 1HG ARG 136 11.821 -10.699 1.522 1042 HD2 ARG 136 2HD ARG 136 14.109 -11.280 1.015 1043 HD3 ARG 136 1HD ARG 136 14.022 -10.516 2.599 1044 HE ARG 136 HE ARG 136 13.998 -13.022 3.355 1045 HH11 ARG 136 1HH1 ARG 136 15.838 -11.640 0.727 1046 HH12 ARG 136 2HH1 ARG 136 17.189 -12.710 0.929 1047 HH21 ARG 136 1HH2 ARG 136 15.765 -14.461 3.626 1048 HH22 ARG 136 2HH2 ARG 136 17.148 -14.314 2.566 1049 H THR 137 HN THR 137 9.526 -13.888 4.172 1050 HA THR 137 HA THR 137 9.182 -15.031 1.595 1051 HB THR 137 HB THR 137 8.092 -16.933 2.908 1052 HG1 THR 137 1HG THR 137 9.165 -15.614 5.179 1053 HG21 THR 137 3HG2 THR 137 10.873 -16.046 3.684 1054 HG22 THR 137 1HG2 THR 137 10.444 -16.964 2.240 1055 HG23 THR 137 2HG2 THR 137 10.232 -17.684 3.836 1056 H ARG 138 HN ARG 138 6.948 -13.658 3.961 1057 HA ARG 138 HA ARG 138 4.597 -14.427 2.530 1058 HB2 ARG 138 2HB ARG 138 5.046 -12.391 4.713 1059 HB3 ARG 138 1HB ARG 138 3.465 -12.902 4.124 1060 HG2 ARG 138 2HG ARG 138 5.498 -14.807 5.239 1061 HG3 ARG 138 1HG ARG 138 4.266 -14.022 6.220 1062 HD2 ARG 138 2HD ARG 138 2.509 -15.067 4.993 1063 HD3 ARG 138 1HD ARG 138 3.632 -15.639 3.763 1064 HE ARG 138 HE ARG 138 4.593 -16.891 5.892 1065 HH11 ARG 138 1HH1 ARG 138 1.281 -16.464 4.854 1066 HH12 ARG 138 2HH1 ARG 138 0.729 -17.975 5.506 1067 HH21 ARG 138 1HH2 ARG 138 3.875 -18.891 6.770 1068 HH22 ARG 138 2HH2 ARG 138 2.205 -19.347 6.623 1069 H MET 139 HN MET 139 6.842 -11.841 2.266 1070 HA MET 139 HA MET 139 5.175 -9.968 0.933 1071 HB2 MET 139 2HB MET 139 8.158 -10.382 1.017 1072 HB3 MET 139 1HB MET 139 7.420 -9.108 0.056 1073 HG2 MET 139 2HG MET 139 7.078 -9.440 3.025 1074 HG3 MET 139 1HG MET 139 8.224 -8.346 2.250 1075 HE1 MET 139 3HE MET 139 7.206 -6.302 3.639 1076 HE2 MET 139 1HE MET 139 6.083 -7.418 4.411 1077 HE3 MET 139 2HE MET 139 5.483 -5.927 3.685 1078 H ALA 140 HN ALA 140 6.654 -12.907 -0.017 1079 HA ALA 140 HA ALA 140 6.916 -12.416 -2.795 1080 HB1 ALA 140 1HB ALA 140 6.578 -15.049 -1.370 1081 HB2 ALA 140 2HB ALA 140 8.108 -14.215 -1.639 1082 HB3 ALA 140 3HB ALA 140 7.181 -14.819 -3.012 1083 H TYR 141 HN TYR 141 4.186 -12.989 -0.822 1084 HA TYR 141 HA TYR 141 2.489 -14.138 -2.821 1085 HB2 TYR 141 2HB TYR 141 1.921 -12.784 -0.182 1086 HB3 TYR 141 1HB TYR 141 0.651 -13.403 -1.227 1087 HD1 TYR 141 1HD TYR 141 0.395 -15.822 -1.571 1088 HD2 TYR 141 2HD TYR 141 3.291 -14.272 1.131 1089 HE1 TYR 141 1HE TYR 141 0.598 -18.039 -0.525 1090 HE2 TYR 141 2HE TYR 141 3.505 -16.486 2.180 1091 HH TYR 141 HH TYR 141 2.301 -19.305 0.804 1092 H CYS 142 HN CYS 142 3.637 -10.999 -2.158 1093 HA CYS 142 HA CYS 142 1.381 -9.679 -3.409 1094 HB2 CYS 142 2HB CYS 142 3.881 -8.543 -2.145 1095 HB3 CYS 142 1HB CYS 142 2.524 -7.597 -2.745 1096 HG CYS 142 HG CYS 142 2.970 -8.663 0.239 1097 H LEU 143 HN LEU 143 1.390 -8.965 -5.398 1098 HA LEU 143 HA LEU 143 3.524 -9.546 -7.200 1099 HB2 LEU 143 2HB LEU 143 1.019 -7.901 -7.533 1100 HB3 LEU 143 1HB LEU 143 2.151 -8.195 -8.834 1101 HG LEU 143 HG LEU 143 1.688 -10.683 -8.349 1102 HD11 LEU 143 1HD1 LEU 143 -0.535 -11.158 -7.463 1103 HD12 LEU 143 2HD1 LEU 143 -0.746 -9.448 -7.085 1104 HD13 LEU 143 3HD1 LEU 143 0.492 -10.390 -6.253 1105 HD21 LEU 143 3HD2 LEU 143 1.028 -9.556 -10.387 1106 HD22 LEU 143 1HD2 LEU 143 -0.405 -8.912 -9.585 1107 HD23 LEU 143 2HD2 LEU 143 -0.249 -10.648 -9.850 1108 H VAL 144 HN VAL 144 4.710 -7.947 -8.447 1109 HA VAL 144 HA VAL 144 5.297 -5.590 -6.786 1110 HB VAL 144 HB VAL 144 7.172 -7.038 -8.671 1111 HG11 VAL 144 1HG1 VAL 144 7.674 -4.665 -8.498 1112 HG12 VAL 144 2HG1 VAL 144 8.903 -5.622 -7.670 1113 HG13 VAL 144 3HG1 VAL 144 7.665 -4.780 -6.739 1114 HG21 VAL 144 3HG2 VAL 144 8.334 -7.767 -6.639 1115 HG22 VAL 144 1HG2 VAL 144 6.680 -8.379 -6.696 1116 HG23 VAL 144 2HG2 VAL 144 7.077 -7.010 -5.659 1117 H TYR 145 HN TYR 145 4.563 -3.797 -7.629 1118 HA TYR 145 HA TYR 145 4.715 -3.437 -10.550 1119 HB2 TYR 145 2HB TYR 145 2.777 -2.379 -8.522 1120 HB3 TYR 145 1HB TYR 145 3.062 -1.487 -10.011 1121 HD1 TYR 145 1HD TYR 145 2.632 -2.661 -12.212 1122 HD2 TYR 145 2HD TYR 145 1.327 -4.225 -8.481 1123 HE1 TYR 145 1HE TYR 145 0.991 -4.067 -13.382 1124 HE2 TYR 145 2HE TYR 145 -0.318 -5.639 -9.642 1125 HH TYR 145 HH TYR 145 -0.240 -6.197 -12.958 1126 H GLU 146 HN GLU 146 6.227 -2.120 -11.222 1127 HA GLU 146 HA GLU 146 7.458 -0.274 -9.340 1128 HB2 GLU 146 2HB GLU 146 9.133 0.046 -11.193 1129 HB3 GLU 146 1HB GLU 146 9.034 -1.589 -10.554 1130 HG2 GLU 146 2HG GLU 146 7.589 -2.197 -12.473 1131 HG3 GLU 146 1HG GLU 146 7.849 -0.581 -13.131 1132 H VAL 147 HN VAL 147 6.864 1.772 -9.249 1133 HA VAL 147 HA VAL 147 5.143 2.945 -11.220 1134 HB VAL 147 HB VAL 147 6.627 4.286 -8.945 1135 HG11 VAL 147 1HG1 VAL 147 4.245 5.211 -10.546 1136 HG12 VAL 147 2HG1 VAL 147 5.879 5.868 -10.639 1137 HG13 VAL 147 3HG1 VAL 147 4.940 6.045 -9.157 1138 HG21 VAL 147 3HG2 VAL 147 3.822 3.176 -9.034 1139 HG22 VAL 147 1HG2 VAL 147 4.519 4.101 -7.705 1140 HG23 VAL 147 2HG2 VAL 147 5.175 2.517 -8.115 1141 H LYS 148 HN LYS 148 8.353 3.831 -10.013 1142 HA LYS 148 HA LYS 148 9.685 3.856 -12.447 1143 HB2 LYS 148 2HB LYS 148 8.297 5.754 -13.088 1144 HB3 LYS 148 1HB LYS 148 8.688 6.586 -11.587 1145 HG2 LYS 148 2HG LYS 148 10.972 6.852 -12.260 1146 HG3 LYS 148 1HG LYS 148 10.710 5.857 -13.693 1147 HD2 LYS 148 2HD LYS 148 9.318 7.503 -14.686 1148 HD3 LYS 148 1HD LYS 148 9.224 8.424 -13.183 1149 HE2 LYS 148 2HE LYS 148 11.784 7.945 -14.694 1150 HE3 LYS 148 1HE LYS 148 10.773 9.372 -14.913 1151 HZ1 LYS 148 3HZ LYS 148 11.197 10.096 -12.755 1152 HZ2 LYS 148 1HZ LYS 148 12.706 9.557 -13.306 1153 HZ3 LYS 148 2HZ LYS 148 11.797 8.596 -12.242 1154 HA PRO 149 HA PRO 149 12.532 4.004 -8.979 1155 HB2 PRO 149 2HB PRO 149 14.511 2.935 -10.802 1156 HB3 PRO 149 1HB PRO 149 13.725 2.140 -9.438 1157 HG2 PRO 149 2HG PRO 149 13.293 1.449 -12.045 1158 HG3 PRO 149 1HG PRO 149 12.112 1.200 -10.748 1159 HD2 PRO 149 2HD PRO 149 12.229 3.361 -12.817 1160 HD3 PRO 149 1HD PRO 149 10.821 2.487 -12.174 Start of MODEL 3 1 H1 MET 1 H1 MET 1 28.503 -6.875 9.700 2 H2 MET 1 H2 MET 1 28.977 -8.214 10.619 3 H3 MET 1 H3 MET 1 30.085 -7.484 9.562 4 HA MET 1 HA MET 1 28.898 -6.261 11.979 5 HB2 MET 1 2HB MET 1 31.651 -7.356 11.402 6 HB3 MET 1 1HB MET 1 31.319 -6.265 12.740 7 HG2 MET 1 2HG MET 1 31.313 -8.451 13.624 8 HG3 MET 1 1HG MET 1 29.632 -7.929 13.554 9 HE1 MET 1 2HE MET 1 31.603 -11.019 10.763 10 HE2 MET 1 3HE MET 1 32.375 -10.290 12.171 11 HE3 MET 1 1HE MET 1 32.057 -9.315 10.734 12 H GLY 2 HN GLY 2 28.574 -4.227 11.663 13 HA2 GLY 2 2HA GLY 2 30.277 -2.205 11.232 14 HA3 GLY 2 1HA GLY 2 29.977 -2.757 9.586 15 H HIS 3 HN HIS 3 28.415 -1.581 12.516 16 HA HIS 3 HA HIS 3 26.084 -0.819 10.895 17 HB2 HIS 3 2HB HIS 3 25.598 -2.948 12.003 18 HB3 HIS 3 1HB HIS 3 26.040 -2.259 13.558 19 HD1 HIS 3 1HD HIS 3 24.223 -1.178 14.864 20 HD2 HIS 3 2HD HIS 3 23.164 -1.809 10.892 21 HE1 HIS 3 1HE HIS 3 21.774 -0.621 14.717 22 HE2 HIS 3 2HE HIS 3 21.112 -1.240 12.364 23 H HIS 4 HN HIS 4 26.255 1.361 10.970 24 HA HIS 4 HA HIS 4 26.384 2.575 13.654 25 HB2 HIS 4 2HB HIS 4 27.351 3.735 11.031 26 HB3 HIS 4 1HB HIS 4 27.280 4.623 12.548 27 HD1 HIS 4 1HD HIS 4 28.692 3.189 14.565 28 HD2 HIS 4 2HD HIS 4 29.820 2.763 10.584 29 HE1 HIS 4 1HE HIS 4 31.068 2.360 14.617 30 HE2 HIS 4 2HE HIS 4 31.795 2.346 12.202 31 H HIS 5 HN HIS 5 24.185 2.521 13.973 32 HA HIS 5 HA HIS 5 22.496 3.925 12.018 33 HB2 HIS 5 2HB HIS 5 21.825 1.633 12.767 34 HB3 HIS 5 1HB HIS 5 21.679 2.246 14.407 35 HD1 HIS 5 1HD HIS 5 19.838 1.876 11.256 36 HD2 HIS 5 2HD HIS 5 19.479 4.086 14.763 37 HE1 HIS 5 1HE HIS 5 17.471 2.726 11.285 38 HE2 HIS 5 2HE HIS 5 17.218 3.810 13.544 39 H HIS 6 HN HIS 6 23.222 6.023 12.599 40 HA HIS 6 HA HIS 6 22.038 6.986 15.100 41 HB2 HIS 6 2HB HIS 6 24.449 6.700 15.493 42 HB3 HIS 6 1HB HIS 6 24.801 7.722 14.104 43 HD1 HIS 6 1HD HIS 6 24.991 10.183 14.538 44 HD2 HIS 6 2HD HIS 6 23.166 8.144 17.681 45 HE1 HIS 6 1HE HIS 6 24.739 11.869 16.396 46 HE2 HIS 6 2HE HIS 6 23.565 10.637 18.259 47 H HIS 7 HN HIS 7 20.345 7.636 13.668 48 HA HIS 7 HA HIS 7 20.363 10.361 13.095 49 HB2 HIS 7 2HB HIS 7 21.323 8.723 10.883 50 HB3 HIS 7 1HB HIS 7 19.863 9.605 10.450 51 HD1 HIS 7 1HD HIS 7 20.122 12.326 11.343 52 HD2 HIS 7 2HD HIS 7 23.517 10.169 10.287 53 HE1 HIS 7 1HE HIS 7 21.884 14.043 10.829 54 HE2 HIS 7 2HE HIS 7 23.909 12.721 10.109 55 H HIS 8 HN HIS 8 18.293 11.099 12.753 56 HA HIS 8 HA HIS 8 16.266 9.513 11.559 57 HB2 HIS 8 2HB HIS 8 14.776 9.163 13.408 58 HB3 HIS 8 1HB HIS 8 16.331 8.475 13.846 59 HD1 HIS 8 1HD HIS 8 17.541 9.490 15.875 60 HD2 HIS 8 2HD HIS 8 13.981 11.412 14.900 61 HE1 HIS 8 1HE HIS 8 17.035 11.010 17.815 62 HE2 HIS 8 2HE HIS 8 14.767 11.995 17.291 63 H SER 9 HN SER 9 14.799 10.851 10.669 64 HA SER 9 HA SER 9 14.999 13.682 11.355 65 HB2 SER 9 2HB SER 9 13.528 12.368 9.057 66 HB3 SER 9 1HB SER 9 13.862 14.089 9.243 67 HG SER 9 HG SER 9 15.314 12.583 7.889 68 H HIS 10 HN HIS 10 13.075 14.971 11.655 69 HA HIS 10 HA HIS 10 10.704 13.414 12.456 70 HB2 HIS 10 2HB HIS 10 12.007 14.325 14.426 71 HB3 HIS 10 1HB HIS 10 11.652 15.942 13.831 72 HD1 HIS 10 1HD HIS 10 10.374 16.420 16.062 73 HD2 HIS 10 2HD HIS 10 8.740 13.370 13.747 74 HE1 HIS 10 1HE HIS 10 8.090 15.986 17.021 75 HE2 HIS 10 2HE HIS 10 7.049 14.282 15.483 76 H MET 11 HN MET 11 11.182 16.900 12.492 77 HA MET 11 HA MET 11 9.947 18.578 11.529 78 HB2 MET 11 2HB MET 11 11.887 18.070 10.016 79 HB3 MET 11 1HB MET 11 10.782 17.140 9.014 80 HG2 MET 11 2HG MET 11 9.447 19.143 8.620 81 HG3 MET 11 1HG MET 11 10.553 20.079 9.627 82 HE1 MET 11 3HE MET 11 10.983 21.844 7.811 83 HE2 MET 11 1HE MET 11 9.860 21.049 6.714 84 HE3 MET 11 2HE MET 11 11.474 21.491 6.153 85 H ASP 12 HN ASP 12 7.832 18.033 12.205 86 HA ASP 12 HA ASP 12 6.136 16.987 10.040 87 HB2 ASP 12 2HB ASP 12 4.791 15.753 11.645 88 HB3 ASP 12 1HB ASP 12 6.471 15.244 11.770 89 H TYR 13 HN TYR 13 4.281 18.062 9.678 90 HA TYR 13 HA TYR 13 3.321 19.978 11.662 91 HB2 TYR 13 2HB TYR 13 3.975 20.673 8.790 92 HB3 TYR 13 1HB TYR 13 2.966 21.672 9.829 93 HD1 TYR 13 1HD TYR 13 3.960 22.776 11.817 94 HD2 TYR 13 2HD TYR 13 6.355 20.702 8.976 95 HE1 TYR 13 1HE TYR 13 5.958 23.928 12.670 96 HE2 TYR 13 2HE TYR 13 8.359 21.846 9.824 97 HH TYR 13 HH TYR 13 8.355 23.660 12.740 98 HA PRO 14 HA PRO 14 -0.259 17.643 10.051 99 HB2 PRO 14 2HB PRO 14 -1.436 18.518 12.598 100 HB3 PRO 14 1HB PRO 14 -1.231 16.883 11.962 101 HG2 PRO 14 2HG PRO 14 0.226 17.792 14.032 102 HG3 PRO 14 1HG PRO 14 0.892 16.663 12.837 103 HD2 PRO 14 2HD PRO 14 1.274 19.629 13.061 104 HD3 PRO 14 1HD PRO 14 2.466 18.365 12.689 105 H SER 15 HN SER 15 -2.034 18.451 9.030 106 HA SER 15 HA SER 15 -2.309 21.335 8.971 107 HB2 SER 15 2HB SER 15 -4.032 20.771 7.166 108 HB3 SER 15 1HB SER 15 -2.360 20.318 6.829 109 HG SER 15 HG SER 15 -4.265 18.539 7.963 110 H PHE 16 HN PHE 16 -3.350 22.090 10.748 111 HA PHE 16 HA PHE 16 -5.691 20.695 11.757 112 HB2 PHE 16 2HB PHE 16 -3.915 21.650 13.276 113 HB3 PHE 16 1HB PHE 16 -4.456 23.253 12.794 114 HD1 PHE 16 2HD PHE 16 -5.834 20.070 14.160 115 HD2 PHE 16 1HD PHE 16 -6.005 24.322 14.122 116 HE1 PHE 16 2HE PHE 16 -7.537 20.017 15.935 117 HE2 PHE 16 1HE PHE 16 -7.710 24.275 15.895 118 HZ PHE 16 HZ PHE 16 -8.478 22.121 16.806 119 H ASP 17 HN ASP 17 -6.535 21.281 9.465 120 HA ASP 17 HA ASP 17 -8.697 23.044 9.802 121 HB2 ASP 17 2HB ASP 17 -7.030 24.814 9.480 122 HB3 ASP 17 1HB ASP 17 -6.516 24.074 7.967 123 H LYS 18 HN LYS 18 -9.946 21.435 9.009 124 HA LYS 18 HA LYS 18 -10.258 21.210 6.200 125 HB2 LYS 18 2HB LYS 18 -9.722 18.845 5.907 126 HB3 LYS 18 1HB LYS 18 -8.290 19.720 6.434 127 HG2 LYS 18 2HG LYS 18 -8.649 18.921 8.721 128 HG3 LYS 18 1HG LYS 18 -10.072 18.031 8.181 129 HD2 LYS 18 2HD LYS 18 -7.244 17.586 7.218 130 HD3 LYS 18 1HD LYS 18 -8.104 16.579 8.381 131 HE2 LYS 18 2HE LYS 18 -9.802 16.097 6.638 132 HE3 LYS 18 1HE LYS 18 -8.832 17.012 5.484 133 HZ1 LYS 18 3HZ LYS 18 -8.088 14.493 6.871 134 HZ2 LYS 18 1HZ LYS 18 -6.983 15.435 5.990 135 HZ3 LYS 18 2HZ LYS 18 -8.308 14.731 5.206 136 H PHE 19 HN PHE 19 -12.022 19.528 5.695 137 HA PHE 19 HA PHE 19 -13.443 18.540 7.990 138 HB2 PHE 19 2HB PHE 19 -14.334 20.901 7.574 139 HB3 PHE 19 1HB PHE 19 -14.987 20.288 6.061 140 HD1 PHE 19 2HD PHE 19 -16.786 18.603 6.087 141 HD2 PHE 19 1HD PHE 19 -15.331 20.401 9.658 142 HE1 PHE 19 2HE PHE 19 -18.794 17.842 7.282 143 HE2 PHE 19 1HE PHE 19 -17.338 19.641 10.859 144 HZ PHE 19 HZ PHE 19 -19.071 18.360 9.671 145 H LEU 20 HN LEU 20 -13.947 17.417 4.084 146 HA LEU 20 HA LEU 20 -14.751 20.064 5.058 147 HB2 LEU 20 2HB LEU 20 -13.245 19.189 2.628 148 HB3 LEU 20 1HB LEU 20 -14.278 20.599 2.511 149 HG LEU 20 HG LEU 20 -11.989 20.286 4.457 150 HD11 LEU 20 1HD1 LEU 20 -10.852 21.940 3.053 151 HD12 LEU 20 2HD1 LEU 20 -12.193 21.887 1.908 152 HD13 LEU 20 3HD1 LEU 20 -11.193 20.457 2.163 153 HD21 LEU 20 3HD2 LEU 20 -13.741 22.655 3.801 154 HD22 LEU 20 1HD2 LEU 20 -12.332 22.682 4.862 155 HD23 LEU 20 2HD2 LEU 20 -13.752 21.736 5.307 156 H GLY 21 HN GLY 21 -16.836 20.588 4.707 157 HA2 GLY 21 2HA GLY 21 -18.424 18.632 3.180 158 HA3 GLY 21 1HA GLY 21 -19.031 19.666 4.464 159 H THR 22 HN THR 22 -17.019 21.434 2.494 160 HA THR 22 HA THR 22 -19.128 22.981 1.401 161 HB THR 22 HB THR 22 -16.280 23.014 0.417 162 HG1 THR 22 1HG THR 22 -17.367 24.086 2.836 163 HG21 THR 22 3HG2 THR 22 -18.370 25.170 0.763 164 HG22 THR 22 1HG2 THR 22 -17.869 24.447 -0.764 165 HG23 THR 22 2HG2 THR 22 -16.729 25.421 0.167 166 H GLU 23 HN GLU 23 -16.634 21.004 -0.219 167 HA GLU 23 HA GLU 23 -18.626 20.203 -2.210 168 HB2 GLU 23 2HB GLU 23 -15.827 21.131 -2.888 169 HB3 GLU 23 1HB GLU 23 -16.992 20.472 -4.027 170 HG2 GLU 23 2HG GLU 23 -18.489 22.392 -3.513 171 HG3 GLU 23 1HG GLU 23 -17.196 23.070 -2.523 172 H ASN 24 HN ASN 24 -17.741 18.309 -3.540 173 HA ASN 24 HA ASN 24 -16.206 16.564 -1.725 174 HB2 ASN 24 2HB ASN 24 -18.405 15.922 -3.686 175 HB3 ASN 24 1HB ASN 24 -17.357 14.682 -3.005 176 HD21 ASN 24 1HD2 ASN 24 -19.913 16.936 -2.374 177 HD22 ASN 24 2HD2 ASN 24 -20.343 16.321 -0.813 178 H ALA 25 HN ALA 25 -15.094 18.395 -3.707 179 HA ALA 25 HA ALA 25 -14.340 17.061 -6.069 180 HB1 ALA 25 1HB ALA 25 -14.124 19.489 -5.750 181 HB2 ALA 25 2HB ALA 25 -12.619 18.751 -6.298 182 HB3 ALA 25 3HB ALA 25 -12.812 19.208 -4.605 183 H GLU 26 HN GLU 26 -12.974 17.080 -2.835 184 HA GLU 26 HA GLU 26 -10.556 15.757 -3.370 185 HB2 GLU 26 2HB GLU 26 -12.287 15.646 -0.895 186 HB3 GLU 26 1HB GLU 26 -10.639 15.048 -0.988 187 HG2 GLU 26 2HG GLU 26 -9.842 17.307 -1.450 188 HG3 GLU 26 1HG GLU 26 -11.498 17.907 -1.358 189 H LEU 27 HN LEU 27 -13.789 14.562 -2.698 190 HA LEU 27 HA LEU 27 -13.098 11.861 -2.360 191 HB2 LEU 27 2HB LEU 27 -15.146 12.816 -1.471 192 HB3 LEU 27 1HB LEU 27 -15.718 13.164 -3.092 193 HG LEU 27 HG LEU 27 -15.717 10.733 -3.550 194 HD11 LEU 27 1HD1 LEU 27 -15.627 9.182 -1.661 195 HD12 LEU 27 2HD1 LEU 27 -15.211 10.518 -0.588 196 HD13 LEU 27 3HD1 LEU 27 -14.100 10.038 -1.872 197 HD21 LEU 27 3HD2 LEU 27 -17.417 11.673 -1.249 198 HD22 LEU 27 1HD2 LEU 27 -17.753 10.264 -2.256 199 HD23 LEU 27 2HD2 LEU 27 -17.767 11.879 -2.964 200 H VAL 28 HN VAL 28 -14.265 13.707 -5.150 201 HA VAL 28 HA VAL 28 -14.527 11.568 -6.945 202 HB VAL 28 HB VAL 28 -13.754 14.423 -7.586 203 HG11 VAL 28 1HG1 VAL 28 -14.719 13.979 -9.791 204 HG12 VAL 28 2HG1 VAL 28 -15.007 12.301 -9.327 205 HG13 VAL 28 3HG1 VAL 28 -13.355 12.909 -9.458 206 HG21 VAL 28 3HG2 VAL 28 -16.158 14.770 -7.969 207 HG22 VAL 28 1HG2 VAL 28 -15.804 14.349 -6.292 208 HG23 VAL 28 2HG2 VAL 28 -16.473 13.136 -7.385 209 H TYR 29 HN TYR 29 -11.769 13.555 -6.060 210 HA TYR 29 HA TYR 29 -9.960 12.479 -7.976 211 HB2 TYR 29 2HB TYR 29 -9.608 14.662 -6.931 212 HB3 TYR 29 1HB TYR 29 -9.466 13.903 -5.350 213 HD1 TYR 29 1HD TYR 29 -7.859 14.039 -8.703 214 HD2 TYR 29 2HD TYR 29 -7.387 13.205 -4.560 215 HE1 TYR 29 1HE TYR 29 -5.432 13.830 -9.028 216 HE2 TYR 29 2HE TYR 29 -4.961 12.993 -4.874 217 HH TYR 29 HH TYR 29 -3.369 14.040 -7.662 218 H VAL 30 HN VAL 30 -10.953 11.588 -4.754 219 HA VAL 30 HA VAL 30 -8.926 9.725 -4.149 220 HB VAL 30 HB VAL 30 -11.765 10.033 -3.177 221 HG11 VAL 30 1HG1 VAL 30 -11.209 7.666 -3.030 222 HG12 VAL 30 2HG1 VAL 30 -11.279 8.403 -1.429 223 HG13 VAL 30 3HG1 VAL 30 -9.717 8.062 -2.176 224 HG21 VAL 30 3HG2 VAL 30 -10.664 10.761 -1.112 225 HG22 VAL 30 1HG2 VAL 30 -10.176 11.749 -2.488 226 HG23 VAL 30 2HG2 VAL 30 -9.089 10.508 -1.865 227 H LEU 31 HN LEU 31 -11.982 9.445 -5.881 228 HA LEU 31 HA LEU 31 -12.111 6.651 -6.107 229 HB2 LEU 31 2HB LEU 31 -13.058 8.709 -8.111 230 HB3 LEU 31 1HB LEU 31 -13.601 7.044 -8.001 231 HG LEU 31 HG LEU 31 -14.065 9.185 -5.925 232 HD11 LEU 31 1HD1 LEU 31 -15.954 7.873 -7.875 233 HD12 LEU 31 2HD1 LEU 31 -15.370 9.535 -7.954 234 HD13 LEU 31 3HD1 LEU 31 -16.402 9.027 -6.618 235 HD21 LEU 31 3HD2 LEU 31 -13.841 6.968 -4.934 236 HD22 LEU 31 1HD2 LEU 31 -15.041 6.337 -6.063 237 HD23 LEU 31 2HD2 LEU 31 -15.509 7.535 -4.857 238 H ARG 32 HN ARG 32 -10.271 5.594 -6.710 239 HA ARG 32 HA ARG 32 -9.208 6.251 -9.376 240 HB2 ARG 32 2HB ARG 32 -7.799 6.805 -7.164 241 HB3 ARG 32 1HB ARG 32 -7.345 5.115 -7.349 242 HG2 ARG 32 2HG ARG 32 -5.697 6.050 -8.588 243 HG3 ARG 32 1HG ARG 32 -6.921 5.904 -9.851 244 HD2 ARG 32 2HD ARG 32 -6.104 8.347 -8.298 245 HD3 ARG 32 1HD ARG 32 -6.078 8.098 -10.041 246 HE ARG 32 HE ARG 32 -8.672 8.100 -8.690 247 HH11 ARG 32 1HH1 ARG 32 -6.394 9.727 -10.797 248 HH12 ARG 32 2HH1 ARG 32 -7.544 10.921 -11.323 249 HH21 ARG 32 1HH2 ARG 32 -10.176 9.660 -9.368 250 HH22 ARG 32 2HH2 ARG 32 -9.705 10.884 -10.512 251 H HIS 33 HN HIS 33 -11.123 4.209 -8.225 252 HA HIS 33 HA HIS 33 -11.779 2.124 -8.815 253 HB2 HIS 33 2HB HIS 33 -10.631 2.865 -11.007 254 HB3 HIS 33 1HB HIS 33 -9.309 1.816 -10.509 255 HD1 HIS 33 1HD HIS 33 -9.444 -0.365 -11.631 256 HD2 HIS 33 2HD HIS 33 -13.223 1.198 -10.847 257 HE1 HIS 33 1HE HIS 33 -11.084 -2.081 -12.476 258 HE2 HIS 33 2HE HIS 33 -13.358 -1.178 -11.872 259 H LYS 34 HN LYS 34 -10.435 -0.277 -9.190 260 HA LYS 34 HA LYS 34 -9.331 -0.638 -6.488 261 HB2 LYS 34 2HB LYS 34 -10.730 -2.598 -8.316 262 HB3 LYS 34 1HB LYS 34 -10.118 -2.974 -6.713 263 HG2 LYS 34 2HG LYS 34 -11.715 -1.547 -5.682 264 HG3 LYS 34 1HG LYS 34 -12.210 -0.880 -7.241 265 HD2 LYS 34 2HD LYS 34 -13.041 -3.089 -7.914 266 HD3 LYS 34 1HD LYS 34 -12.553 -3.746 -6.350 267 HE2 LYS 34 2HE LYS 34 -14.143 -2.385 -5.202 268 HE3 LYS 34 1HE LYS 34 -14.506 -1.476 -6.670 269 HZ1 LYS 34 3HZ LYS 34 -16.210 -3.135 -6.138 270 HZ2 LYS 34 1HZ LYS 34 -15.061 -4.375 -6.291 271 HZ3 LYS 34 2HZ LYS 34 -15.478 -3.436 -7.640 272 H HIS 35 HN HIS 35 -8.277 -3.147 -6.689 273 HA HIS 35 HA HIS 35 -6.508 -3.423 -8.913 274 HB2 HIS 35 2HB HIS 35 -4.396 -3.102 -7.772 275 HB3 HIS 35 1HB HIS 35 -5.345 -1.632 -7.626 276 HD1 HIS 35 1HD HIS 35 -6.136 -0.968 -5.243 277 HD2 HIS 35 2HD HIS 35 -3.859 -4.439 -5.372 278 HE1 HIS 35 1HE HIS 35 -5.474 -1.435 -2.862 279 HE2 HIS 35 2HE HIS 35 -4.186 -3.602 -2.949 280 H GLY 36 HN GLY 36 -4.665 -5.160 -8.015 281 HA2 GLY 36 2HA GLY 36 -6.150 -7.520 -7.518 282 HA3 GLY 36 1HA GLY 36 -4.401 -7.386 -7.531 283 H GLN 37 HN GLN 37 -4.674 -9.034 -5.787 284 HA GLN 37 HA GLN 37 -5.751 -8.084 -3.275 285 HB2 GLN 37 2HB GLN 37 -4.345 -10.654 -4.004 286 HB3 GLN 37 1HB GLN 37 -4.948 -10.292 -2.395 287 HG2 GLN 37 2HG GLN 37 -7.220 -10.009 -3.426 288 HG3 GLN 37 1HG GLN 37 -6.537 -10.657 -4.917 289 HE21 GLN 37 1HE2 GLN 37 -7.428 -11.346 -1.627 290 HE22 GLN 37 2HE2 GLN 37 -7.388 -13.070 -1.767 291 H PHE 38 HN PHE 38 -2.548 -9.411 -4.140 292 HA PHE 38 HA PHE 38 -1.422 -7.822 -1.944 293 HB2 PHE 38 2HB PHE 38 -0.215 -10.132 -3.485 294 HB3 PHE 38 1HB PHE 38 0.541 -9.301 -2.129 295 HD1 PHE 38 2HD PHE 38 -0.566 -9.436 0.133 296 HD2 PHE 38 1HD PHE 38 -1.714 -11.895 -3.144 297 HE1 PHE 38 2HE PHE 38 -1.653 -10.999 1.691 298 HE2 PHE 38 1HE PHE 38 -2.811 -13.457 -1.590 299 HZ PHE 38 HZ PHE 38 -2.779 -13.010 0.827 300 H ILE 39 HN ILE 39 -1.130 -5.821 -2.846 301 HA ILE 39 HA ILE 39 0.708 -5.701 -5.146 302 HB ILE 39 HB ILE 39 -1.632 -3.861 -4.616 303 HG12 ILE 39 2HG1 ILE 39 -2.270 -6.047 -5.571 304 HG13 ILE 39 1HG1 ILE 39 -2.549 -4.726 -6.707 305 HG21 ILE 39 1HG2 ILE 39 0.220 -2.592 -5.496 306 HG22 ILE 39 2HG2 ILE 39 -1.010 -2.782 -6.744 307 HG23 ILE 39 3HG2 ILE 39 0.451 -3.766 -6.793 308 HD11 ILE 39 3HD1 ILE 39 -1.618 -6.671 -7.822 309 HD12 ILE 39 1HD1 ILE 39 -0.221 -6.640 -6.746 310 HD13 ILE 39 2HD1 ILE 39 -0.489 -5.319 -7.880 311 H TYR 40 HN TYR 40 2.523 -4.721 -4.687 312 HA TYR 40 HA TYR 40 2.566 -2.665 -2.582 313 HB2 TYR 40 2HB TYR 40 4.081 -4.167 -1.759 314 HB3 TYR 40 1HB TYR 40 4.444 -4.836 -3.343 315 HD1 TYR 40 1HD TYR 40 4.967 -1.640 -1.442 316 HD2 TYR 40 2HD TYR 40 6.535 -4.491 -4.179 317 HE1 TYR 40 1HE TYR 40 7.096 -0.410 -1.500 318 HE2 TYR 40 2HE TYR 40 8.667 -3.276 -4.239 319 HH TYR 40 HH TYR 40 9.447 -0.829 -2.010 320 H VAL 41 HN VAL 41 2.950 -0.641 -3.199 321 HA VAL 41 HA VAL 41 4.204 -0.196 -5.832 322 HB VAL 41 HB VAL 41 2.836 1.851 -6.060 323 HG11 VAL 41 1HG1 VAL 41 0.737 0.744 -6.642 324 HG12 VAL 41 2HG1 VAL 41 1.219 -0.670 -5.705 325 HG13 VAL 41 3HG1 VAL 41 2.130 -0.216 -7.145 326 HG21 VAL 41 3HG2 VAL 41 2.364 2.296 -3.721 327 HG22 VAL 41 1HG2 VAL 41 1.403 0.823 -3.611 328 HG23 VAL 41 2HG2 VAL 41 0.857 2.156 -4.628 329 H TRP 42 HN TRP 42 5.374 1.826 -6.039 330 HA TRP 42 HA TRP 42 6.877 2.405 -3.648 331 HB2 TRP 42 2HB TRP 42 7.117 3.205 -6.527 332 HB3 TRP 42 1HB TRP 42 8.074 4.015 -5.292 333 HD1 TRP 42 1HD TRP 42 7.395 0.289 -6.236 334 HE1 TRP 42 1HE TRP 42 9.647 -0.952 -6.128 335 HE3 TRP 42 3HE TRP 42 10.388 4.163 -4.780 336 HZ2 TRP 42 2HZ TRP 42 12.342 -0.363 -5.503 337 HZ3 TRP 42 3HZ TRP 42 12.787 3.747 -4.444 338 HH2 TRP 42 2HH TRP 42 13.742 1.527 -4.798 339 H GLY 43 HN GLY 43 5.984 4.854 -6.014 340 HA2 GLY 43 2HA GLY 43 4.788 6.830 -5.756 341 HA3 GLY 43 1HA GLY 43 4.381 6.338 -4.117 342 H GLU 44 HN GLU 44 4.971 8.864 -4.314 343 HA GLU 44 HA GLU 44 6.310 10.580 -3.691 344 HB2 GLU 44 2HB GLU 44 7.388 10.296 -1.525 345 HB3 GLU 44 1HB GLU 44 5.785 9.587 -1.553 346 HG2 GLU 44 2HG GLU 44 6.735 7.370 -1.719 347 HG3 GLU 44 1HG GLU 44 8.360 8.051 -1.802 348 H GLU 45 HN GLU 45 7.518 9.204 -5.860 349 HA GLU 45 HA GLU 45 10.252 8.712 -5.469 350 HB2 GLU 45 2HB GLU 45 8.757 8.228 -7.530 351 HB3 GLU 45 1HB GLU 45 9.134 9.872 -8.018 352 HG2 GLU 45 2HG GLU 45 11.210 7.758 -7.476 353 HG3 GLU 45 1HG GLU 45 10.548 8.110 -9.068 354 H GLY 46 HN GLY 46 8.797 11.610 -6.991 355 HA2 GLY 46 2HA GLY 46 11.092 13.226 -6.467 356 HA3 GLY 46 1HA GLY 46 9.517 13.799 -7.002 357 H ALA 47 HN ALA 47 7.782 13.644 -5.254 358 HA ALA 47 HA ALA 47 8.586 13.691 -2.513 359 HB1 ALA 47 1HB ALA 47 9.391 15.919 -3.160 360 HB2 ALA 47 2HB ALA 47 8.039 16.026 -2.033 361 HB3 ALA 47 3HB ALA 47 7.778 16.326 -3.751 362 H GLY 48 HN GLY 48 6.913 12.493 -1.802 363 HA2 GLY 48 2HA GLY 48 4.249 13.570 -1.982 364 HA3 GLY 48 1HA GLY 48 4.469 12.112 -2.937 365 H LYS 49 HN LYS 49 3.418 10.589 -1.885 366 HA LYS 49 HA LYS 49 4.272 9.569 0.614 367 HB2 LYS 49 2HB LYS 49 2.943 11.663 1.265 368 HB3 LYS 49 1HB LYS 49 1.523 10.844 0.634 369 HG2 LYS 49 2HG LYS 49 1.746 9.104 2.284 370 HG3 LYS 49 1HG LYS 49 3.255 9.809 2.869 371 HD2 LYS 49 2HD LYS 49 2.063 11.816 3.572 372 HD3 LYS 49 1HD LYS 49 0.552 11.154 2.942 373 HE2 LYS 49 2HE LYS 49 0.644 9.341 4.535 374 HE3 LYS 49 1HE LYS 49 2.214 9.890 5.113 375 HZ1 LYS 49 3HZ LYS 49 -0.335 11.400 5.344 376 HZ2 LYS 49 1HZ LYS 49 1.180 11.925 5.898 377 HZ3 LYS 49 2HZ LYS 49 0.451 10.564 6.600 378 H SER 50 HN SER 50 2.145 8.000 1.330 379 HA SER 50 HA SER 50 1.762 6.294 -0.938 380 HB2 SER 50 2HB SER 50 0.355 6.123 1.737 381 HB3 SER 50 1HB SER 50 0.624 4.818 0.581 382 HG SER 50 HG SER 50 2.377 5.989 2.399 383 H HIS 51 HN HIS 51 0.832 8.078 -2.187 384 HA HIS 51 HA HIS 51 -1.493 9.475 -1.559 385 HB2 HIS 51 2HB HIS 51 0.334 9.825 -3.372 386 HB3 HIS 51 1HB HIS 51 -0.694 8.815 -4.379 387 HD1 HIS 51 1HD HIS 51 -0.446 12.198 -2.845 388 HD2 HIS 51 2HD HIS 51 -3.059 10.038 -5.256 389 HE1 HIS 51 1HE HIS 51 -2.036 13.889 -3.809 390 HE2 HIS 51 2HE HIS 51 -3.398 12.592 -5.481 391 H LEU 52 HN LEU 52 -1.094 6.497 -3.442 392 HA LEU 52 HA LEU 52 -3.832 6.384 -4.221 393 HB2 LEU 52 2HB LEU 52 -2.214 5.494 -5.711 394 HB3 LEU 52 1HB LEU 52 -1.494 4.507 -4.454 395 HG LEU 52 HG LEU 52 -3.592 3.192 -4.376 396 HD11 LEU 52 1HD1 LEU 52 -5.155 3.352 -6.246 397 HD12 LEU 52 2HD1 LEU 52 -4.266 4.742 -6.870 398 HD13 LEU 52 3HD1 LEU 52 -5.105 4.852 -5.322 399 HD21 LEU 52 3HD2 LEU 52 -3.136 1.939 -6.434 400 HD22 LEU 52 1HD2 LEU 52 -1.652 2.386 -5.592 401 HD23 LEU 52 2HD2 LEU 52 -2.159 3.283 -7.023 402 H LEU 53 HN LEU 53 -1.948 5.122 -1.577 403 HA LEU 53 HA LEU 53 -3.510 2.841 -1.016 404 HB2 LEU 53 2HB LEU 53 -1.560 4.427 0.631 405 HB3 LEU 53 1HB LEU 53 -2.413 3.047 1.292 406 HG LEU 53 HG LEU 53 -1.420 1.656 -0.555 407 HD11 LEU 53 1HD1 LEU 53 0.554 2.498 -1.697 408 HD12 LEU 53 2HD1 LEU 53 0.317 4.083 -0.960 409 HD13 LEU 53 3HD1 LEU 53 -0.869 3.457 -2.105 410 HD21 LEU 53 3HD2 LEU 53 0.432 3.015 1.388 411 HD22 LEU 53 1HD2 LEU 53 0.785 1.515 0.529 412 HD23 LEU 53 2HD2 LEU 53 -0.546 1.578 1.684 413 H GLN 54 HN GLN 54 -3.394 5.968 0.643 414 HA GLN 54 HA GLN 54 -5.498 5.428 2.422 415 HB2 GLN 54 2HB GLN 54 -5.545 7.952 2.668 416 HB3 GLN 54 1HB GLN 54 -4.017 7.155 2.982 417 HG2 GLN 54 2HG GLN 54 -3.330 7.743 0.647 418 HG3 GLN 54 1HG GLN 54 -4.786 8.730 0.557 419 HE21 GLN 54 1HE2 GLN 54 -1.702 8.309 2.145 420 HE22 GLN 54 2HE2 GLN 54 -1.569 9.932 2.724 421 H ALA 55 HN ALA 55 -5.423 6.971 -0.723 422 HA ALA 55 HA ALA 55 -8.107 7.749 -0.892 423 HB1 ALA 55 1HB ALA 55 -6.397 8.494 -2.468 424 HB2 ALA 55 2HB ALA 55 -7.776 7.794 -3.312 425 HB3 ALA 55 3HB ALA 55 -6.285 6.866 -3.133 426 H TRP 56 HN TRP 56 -6.532 4.706 -1.783 427 HA TRP 56 HA TRP 56 -8.767 3.452 -2.921 428 HB2 TRP 56 2HB TRP 56 -6.574 2.559 -3.265 429 HB3 TRP 56 1HB TRP 56 -6.323 2.349 -1.539 430 HD1 TRP 56 1HD TRP 56 -8.793 0.961 -4.213 431 HE1 TRP 56 1HE TRP 56 -9.206 -1.525 -3.672 432 HE3 TRP 56 3HE TRP 56 -5.953 0.570 0.013 433 HZ2 TRP 56 2HZ TRP 56 -8.399 -3.412 -1.727 434 HZ3 TRP 56 3HZ TRP 56 -5.812 -1.609 1.147 435 HH2 TRP 56 2HH TRP 56 -7.014 -3.555 0.295 436 H VAL 57 HN VAL 57 -7.599 3.566 0.398 437 HA VAL 57 HA VAL 57 -9.361 1.732 1.544 438 HB VAL 57 HB VAL 57 -8.025 4.170 2.726 439 HG11 VAL 57 1HG1 VAL 57 -9.994 3.661 4.057 440 HG12 VAL 57 2HG1 VAL 57 -8.529 3.213 4.933 441 HG13 VAL 57 3HG1 VAL 57 -9.510 1.968 4.158 442 HG21 VAL 57 3HG2 VAL 57 -6.477 2.470 1.992 443 HG22 VAL 57 1HG2 VAL 57 -7.392 1.222 2.839 444 HG23 VAL 57 2HG2 VAL 57 -6.548 2.469 3.754 445 H ALA 58 HN ALA 58 -9.710 5.267 1.160 446 HA ALA 58 HA ALA 58 -12.174 5.484 2.504 447 HB1 ALA 58 1HB ALA 58 -11.058 7.237 0.319 448 HB2 ALA 58 2HB ALA 58 -10.757 7.416 2.047 449 HB3 ALA 58 3HB ALA 58 -12.382 7.659 1.404 450 H GLN 59 HN GLN 59 -11.389 4.823 -0.851 451 HA GLN 59 HA GLN 59 -13.985 5.017 -1.912 452 HB2 GLN 59 2HB GLN 59 -11.982 4.963 -3.305 453 HB3 GLN 59 1HB GLN 59 -11.643 3.318 -2.790 454 HG2 GLN 59 2HG GLN 59 -13.737 2.583 -3.859 455 HG3 GLN 59 1HG GLN 59 -13.996 4.232 -4.428 456 HE21 GLN 59 1HE2 GLN 59 -10.838 2.810 -4.228 457 HE22 GLN 59 2HE2 GLN 59 -10.568 2.659 -5.930 458 H ALA 60 HN ALA 60 -12.211 2.298 -0.502 459 HA ALA 60 HA ALA 60 -14.217 0.335 -0.929 460 HB1 ALA 60 1HB ALA 60 -11.888 -0.254 -0.452 461 HB2 ALA 60 2HB ALA 60 -12.986 -0.993 0.712 462 HB3 ALA 60 3HB ALA 60 -12.049 0.427 1.168 463 H LEU 61 HN LEU 61 -13.547 2.604 1.660 464 HA LEU 61 HA LEU 61 -15.393 1.685 3.558 465 HB2 LEU 61 2HB LEU 61 -14.375 4.469 2.989 466 HB3 LEU 61 1HB LEU 61 -15.333 4.050 4.395 467 HG LEU 61 HG LEU 61 -12.611 2.914 3.744 468 HD11 LEU 61 1HD1 LEU 61 -12.508 5.270 4.363 469 HD12 LEU 61 2HD1 LEU 61 -11.827 4.246 5.627 470 HD13 LEU 61 3HD1 LEU 61 -13.440 4.931 5.822 471 HD21 LEU 61 3HD2 LEU 61 -12.713 1.986 6.011 472 HD22 LEU 61 1HD2 LEU 61 -13.983 1.333 4.978 473 HD23 LEU 61 2HD2 LEU 61 -14.369 2.574 6.171 474 H GLU 62 HN GLU 62 -15.766 3.826 0.783 475 HA GLU 62 HA GLU 62 -18.376 4.719 1.253 476 HB2 GLU 62 2HB GLU 62 -17.049 4.129 -1.393 477 HB3 GLU 62 1HB GLU 62 -18.513 5.078 -1.183 478 HG2 GLU 62 2HG GLU 62 -17.259 6.723 0.110 479 HG3 GLU 62 1HG GLU 62 -15.792 5.769 -0.113 480 H ALA 63 HN ALA 63 -17.214 1.699 -0.097 481 HA ALA 63 HA ALA 63 -19.804 0.885 -1.062 482 HB1 ALA 63 1HB ALA 63 -18.699 -1.215 -1.636 483 HB2 ALA 63 2HB ALA 63 -17.258 -0.704 -0.758 484 HB3 ALA 63 3HB ALA 63 -17.765 0.171 -2.203 485 H GLY 64 HN GLY 64 -18.803 1.265 1.957 486 HA2 GLY 64 2HA GLY 64 -19.786 0.550 3.927 487 HA3 GLY 64 1HA GLY 64 -20.711 -0.624 3.001 488 H LYS 65 HN LYS 65 -17.322 -0.596 2.493 489 HA LYS 65 HA LYS 65 -17.097 -3.140 3.915 490 HB2 LYS 65 2HB LYS 65 -15.022 -1.938 2.091 491 HB3 LYS 65 1HB LYS 65 -15.230 -3.622 2.545 492 HG2 LYS 65 2HG LYS 65 -17.059 -2.038 0.753 493 HG3 LYS 65 1HG LYS 65 -15.863 -3.221 0.230 494 HD2 LYS 65 2HD LYS 65 -17.071 -4.961 1.491 495 HD3 LYS 65 1HD LYS 65 -18.293 -3.763 1.932 496 HE2 LYS 65 2HE LYS 65 -18.697 -3.383 -0.498 497 HE3 LYS 65 1HE LYS 65 -17.593 -4.713 -0.846 498 HZ1 LYS 65 3HZ LYS 65 -20.129 -4.903 0.688 499 HZ2 LYS 65 1HZ LYS 65 -19.057 -6.189 0.408 500 HZ3 LYS 65 2HZ LYS 65 -19.872 -5.463 -0.892 501 H ASN 66 HN ASN 66 -15.184 -3.476 5.231 502 HA ASN 66 HA ASN 66 -14.419 -1.028 6.613 503 HB2 ASN 66 2HB ASN 66 -15.114 -3.257 7.773 504 HB3 ASN 66 1HB ASN 66 -13.466 -3.756 7.429 505 HD21 ASN 66 1HD2 ASN 66 -13.043 -3.844 9.672 506 HD22 ASN 66 2HD2 ASN 66 -12.767 -2.395 10.584 507 H ALA 67 HN ALA 67 -12.461 -0.166 6.567 508 HA ALA 67 HA ALA 67 -10.171 -1.571 5.522 509 HB1 ALA 67 1HB ALA 67 -9.766 -0.046 3.664 510 HB2 ALA 67 2HB ALA 67 -11.275 0.797 4.004 511 HB3 ALA 67 3HB ALA 67 -11.308 -0.877 3.449 512 H ALA 68 HN ALA 68 -8.225 -0.464 5.959 513 HA ALA 68 HA ALA 68 -8.450 2.084 7.362 514 HB1 ALA 68 1HB ALA 68 -7.207 1.292 9.301 515 HB2 ALA 68 2HB ALA 68 -7.183 -0.341 8.634 516 HB3 ALA 68 3HB ALA 68 -8.714 0.396 9.109 517 H TYR 69 HN TYR 69 -6.869 3.401 6.778 518 HA TYR 69 HA TYR 69 -4.377 2.245 5.761 519 HB2 TYR 69 2HB TYR 69 -3.901 4.469 4.811 520 HB3 TYR 69 1HB TYR 69 -5.423 3.828 4.212 521 HD1 TYR 69 1HD TYR 69 -7.575 4.750 5.137 522 HD2 TYR 69 2HD TYR 69 -3.803 6.537 5.945 523 HE1 TYR 69 1HE TYR 69 -8.709 6.832 5.789 524 HE2 TYR 69 2HE TYR 69 -4.924 8.624 6.596 525 HH TYR 69 HH TYR 69 -7.061 9.772 6.203 526 H ILE 70 HN ILE 70 -2.718 2.192 7.085 527 HA ILE 70 HA ILE 70 -2.837 3.872 9.496 528 HB ILE 70 HB ILE 70 -1.401 1.248 9.067 529 HG12 ILE 70 2HG1 ILE 70 -3.818 1.961 10.752 530 HG13 ILE 70 1HG1 ILE 70 -3.855 1.061 9.240 531 HG21 ILE 70 1HG2 ILE 70 -0.900 1.361 11.473 532 HG22 ILE 70 2HG2 ILE 70 -1.604 2.977 11.535 533 HG23 ILE 70 3HG2 ILE 70 -0.150 2.684 10.581 534 HD11 ILE 70 3HD1 ILE 70 -2.541 0.185 11.800 535 HD12 ILE 70 1HD1 ILE 70 -2.543 -0.717 10.285 536 HD13 ILE 70 2HD1 ILE 70 -4.058 -0.421 11.134 537 H ASP 71 HN ASP 71 -1.564 5.542 9.481 538 HA ASP 71 HA ASP 71 0.727 5.703 7.716 539 HB2 ASP 71 2HB ASP 71 -0.855 7.621 7.983 540 HB3 ASP 71 1HB ASP 71 -0.374 7.745 9.670 541 H ALA 72 HN ALA 72 2.517 4.756 8.425 542 HA ALA 72 HA ALA 72 2.990 4.041 11.100 543 HB1 ALA 72 1HB ALA 72 3.971 2.862 9.193 544 HB2 ALA 72 2HB ALA 72 5.196 3.348 10.365 545 HB3 ALA 72 3HB ALA 72 4.999 4.256 8.865 546 H ALA 73 HN ALA 73 3.330 7.081 9.651 547 HA ALA 73 HA ALA 73 5.449 7.880 11.507 548 HB1 ALA 73 1HB ALA 73 5.741 8.524 9.168 549 HB2 ALA 73 2HB ALA 73 5.586 9.938 10.209 550 HB3 ALA 73 3HB ALA 73 4.220 9.418 9.223 551 H SER 74 HN SER 74 2.155 7.719 11.501 552 HA SER 74 HA SER 74 2.005 9.855 13.515 553 HB2 SER 74 2HB SER 74 1.041 10.679 11.385 554 HB3 SER 74 1HB SER 74 -0.094 9.332 11.394 555 HG SER 74 HG SER 74 -0.723 11.533 12.317 556 H MET 75 HN MET 75 1.085 6.710 12.439 557 HA MET 75 HA MET 75 -0.329 6.229 14.963 558 HB2 MET 75 2HB MET 75 -1.311 5.514 12.194 559 HB3 MET 75 1HB MET 75 -1.973 4.816 13.661 560 HG2 MET 75 2HG MET 75 -2.549 7.114 14.409 561 HG3 MET 75 1HG MET 75 -2.032 7.703 12.833 562 HE1 MET 75 3HE MET 75 -4.618 6.074 10.414 563 HE2 MET 75 1HE MET 75 -2.984 5.551 10.819 564 HE3 MET 75 2HE MET 75 -3.326 7.264 10.571 565 HA PRO 76 HA PRO 76 2.098 2.490 14.657 566 HB2 PRO 76 2HB PRO 76 1.305 1.320 16.935 567 HB3 PRO 76 1HB PRO 76 2.314 2.768 16.943 568 HG2 PRO 76 2HG PRO 76 -0.574 2.472 17.547 569 HG3 PRO 76 1HG PRO 76 0.595 3.637 18.186 570 HD2 PRO 76 2HD PRO 76 -1.296 4.073 16.122 571 HD3 PRO 76 1HD PRO 76 0.014 5.161 16.617 572 H LEU 77 HN LEU 77 1.809 0.181 14.414 573 HA LEU 77 HA LEU 77 -0.720 -0.505 13.202 574 HB2 LEU 77 2HB LEU 77 1.456 -1.282 12.287 575 HB3 LEU 77 1HB LEU 77 1.712 -2.228 13.740 576 HG LEU 77 HG LEU 77 -0.188 -3.650 13.188 577 HD11 LEU 77 1HD1 LEU 77 -1.571 -1.970 12.063 578 HD12 LEU 77 2HD1 LEU 77 -1.372 -3.419 11.077 579 HD13 LEU 77 3HD1 LEU 77 -0.448 -1.964 10.703 580 HD21 LEU 77 3HD2 LEU 77 1.697 -3.274 10.868 581 HD22 LEU 77 1HD2 LEU 77 0.725 -4.710 11.187 582 HD23 LEU 77 2HD2 LEU 77 2.004 -4.243 12.309 583 H THR 78 HN THR 78 -2.197 -2.040 13.983 584 HA THR 78 HA THR 78 -1.888 -2.928 16.744 585 HB THR 78 HB THR 78 -4.227 -1.986 17.216 586 HG1 THR 78 1HG THR 78 -3.696 0.070 15.427 587 HG21 THR 78 3HG2 THR 78 -3.352 0.200 17.894 588 HG22 THR 78 1HG2 THR 78 -1.932 -0.048 16.874 589 HG23 THR 78 2HG2 THR 78 -2.208 -1.089 18.272 590 H ASP 79 HN ASP 79 -4.162 -3.936 17.393 591 HA ASP 79 HA ASP 79 -4.520 -6.194 15.699 592 HB2 ASP 79 2HB ASP 79 -4.734 -6.266 18.166 593 HB3 ASP 79 1HB ASP 79 -6.178 -5.269 18.057 594 H ALA 80 HN ALA 80 -5.933 -3.103 15.778 595 HA ALA 80 HA ALA 80 -8.553 -3.540 14.940 596 HB1 ALA 80 1HB ALA 80 -7.703 -1.359 15.680 597 HB2 ALA 80 2HB ALA 80 -8.518 -1.247 14.119 598 HB3 ALA 80 3HB ALA 80 -6.756 -1.229 14.198 599 H ALA 81 HN ALA 81 -5.575 -3.814 13.198 600 HA ALA 81 HA ALA 81 -6.521 -3.498 10.568 601 HB1 ALA 81 1HB ALA 81 -4.203 -5.167 11.533 602 HB2 ALA 81 2HB ALA 81 -4.144 -3.445 11.158 603 HB3 ALA 81 3HB ALA 81 -4.474 -4.613 9.879 604 H PHE 82 HN PHE 82 -6.858 -6.101 12.810 605 HA PHE 82 HA PHE 82 -7.349 -8.119 10.827 606 HB2 PHE 82 2HB PHE 82 -7.684 -8.025 13.815 607 HB3 PHE 82 1HB PHE 82 -8.209 -9.406 12.860 608 HD1 PHE 82 1HD PHE 82 -6.489 -10.574 11.414 609 HD2 PHE 82 2HD PHE 82 -5.464 -7.812 14.481 610 HE1 PHE 82 1HE PHE 82 -4.209 -11.489 11.471 611 HE2 PHE 82 2HE PHE 82 -3.179 -8.723 14.541 612 HZ PHE 82 HZ PHE 82 -2.554 -10.566 13.032 613 H GLU 83 HN GLU 83 -9.170 -5.589 12.134 614 HA GLU 83 HA GLU 83 -11.716 -6.925 11.770 615 HB2 GLU 83 2HB GLU 83 -11.053 -4.082 12.513 616 HB3 GLU 83 1HB GLU 83 -12.667 -4.767 12.479 617 HG2 GLU 83 2HG GLU 83 -11.845 -6.465 14.149 618 HG3 GLU 83 1HG GLU 83 -10.402 -5.472 14.303 619 H ALA 84 HN ALA 84 -9.541 -5.000 10.004 620 HA ALA 84 HA ALA 84 -11.528 -3.957 8.170 621 HB1 ALA 84 1HB ALA 84 -9.679 -2.800 7.122 622 HB2 ALA 84 2HB ALA 84 -8.528 -3.694 8.116 623 HB3 ALA 84 3HB ALA 84 -9.643 -2.553 8.868 624 H GLU 85 HN GLU 85 -12.017 -4.760 6.268 625 HA GLU 85 HA GLU 85 -11.006 -7.248 5.328 626 HB2 GLU 85 2HB GLU 85 -13.246 -6.535 4.740 627 HB3 GLU 85 1HB GLU 85 -12.630 -5.088 3.966 628 HG2 GLU 85 2HG GLU 85 -13.224 -6.602 2.252 629 HG3 GLU 85 1HG GLU 85 -11.465 -6.550 2.320 630 H TYR 86 HN TYR 86 -10.498 -3.887 4.457 631 HA TYR 86 HA TYR 86 -8.345 -4.680 2.609 632 HB2 TYR 86 2HB TYR 86 -9.831 -2.048 2.761 633 HB3 TYR 86 1HB TYR 86 -8.661 -2.519 1.532 634 HD1 TYR 86 2HD TYR 86 -9.252 -4.473 0.007 635 HD2 TYR 86 1HD TYR 86 -12.105 -2.568 2.513 636 HE1 TYR 86 2HE TYR 86 -11.068 -5.405 -1.361 637 HE2 TYR 86 1HE TYR 86 -13.926 -3.502 1.155 638 HH TYR 86 HH TYR 86 -13.533 -6.001 -0.984 639 H LEU 87 HN LEU 87 -6.312 -4.307 3.202 640 HA LEU 87 HA LEU 87 -5.837 -2.367 5.370 641 HB2 LEU 87 2HB LEU 87 -4.442 -4.951 4.716 642 HB3 LEU 87 1HB LEU 87 -3.712 -3.738 5.748 643 HG LEU 87 HG LEU 87 -4.655 -5.303 7.212 644 HD11 LEU 87 1HD1 LEU 87 -5.127 -3.018 7.858 645 HD12 LEU 87 2HD1 LEU 87 -6.441 -4.084 8.353 646 HD13 LEU 87 3HD1 LEU 87 -6.631 -3.046 6.939 647 HD21 LEU 87 3HD2 LEU 87 -6.032 -6.514 5.608 648 HD22 LEU 87 1HD2 LEU 87 -7.197 -5.190 5.593 649 HD23 LEU 87 2HD2 LEU 87 -6.948 -6.129 7.066 650 H ALA 88 HN ALA 88 -4.656 -0.656 4.913 651 HA ALA 88 HA ALA 88 -2.568 -0.871 2.858 652 HB1 ALA 88 1HB ALA 88 -4.473 0.306 1.864 653 HB2 ALA 88 2HB ALA 88 -3.084 1.375 2.056 654 HB3 ALA 88 3HB ALA 88 -4.438 1.476 3.182 655 H VAL 89 HN VAL 89 -0.643 0.047 3.446 656 HA VAL 89 HA VAL 89 -0.613 1.381 6.075 657 HB VAL 89 HB VAL 89 1.522 -0.465 4.989 658 HG11 VAL 89 1HG1 VAL 89 2.399 1.304 6.435 659 HG12 VAL 89 2HG1 VAL 89 2.524 -0.276 7.206 660 HG13 VAL 89 3HG1 VAL 89 1.254 0.847 7.695 661 HG21 VAL 89 3HG2 VAL 89 -0.483 -1.708 5.585 662 HG22 VAL 89 1HG2 VAL 89 -0.515 -0.930 7.167 663 HG23 VAL 89 2HG2 VAL 89 0.807 -2.019 6.746 664 H ASP 90 HN ASP 90 -0.004 3.404 5.922 665 HA ASP 90 HA ASP 90 1.571 4.404 3.717 666 HB2 ASP 90 2HB ASP 90 0.068 5.550 5.989 667 HB3 ASP 90 1HB ASP 90 1.519 6.436 5.549 668 H GLN 91 HN GLN 91 3.724 4.511 3.679 669 HA GLN 91 HA GLN 91 5.899 4.601 4.308 670 HB2 GLN 91 2HB GLN 91 4.687 5.469 6.933 671 HB3 GLN 91 1HB GLN 91 6.418 5.367 6.673 672 HG2 GLN 91 2HG GLN 91 5.673 7.641 6.444 673 HG3 GLN 91 1HG GLN 91 6.243 7.040 4.892 674 HE21 GLN 91 1HE2 GLN 91 3.409 7.898 6.774 675 HE22 GLN 91 2HE2 GLN 91 2.349 8.080 5.420 676 H VAL 92 HN VAL 92 5.087 2.146 4.055 677 HA VAL 92 HA VAL 92 4.987 0.433 6.265 678 HB VAL 92 HB VAL 92 6.068 -0.241 3.523 679 HG11 VAL 92 1HG1 VAL 92 4.879 -2.002 5.665 680 HG12 VAL 92 2HG1 VAL 92 6.571 -1.957 5.171 681 HG13 VAL 92 3HG1 VAL 92 5.339 -2.527 4.044 682 HG21 VAL 92 3HG2 VAL 92 3.781 -0.950 2.994 683 HG22 VAL 92 1HG2 VAL 92 3.863 0.773 3.357 684 HG23 VAL 92 2HG2 VAL 92 3.239 -0.352 4.562 685 H GLU 93 HN GLU 93 7.711 1.807 4.585 686 HA GLU 93 HA GLU 93 9.749 0.077 5.414 687 HB2 GLU 93 2HB GLU 93 9.919 1.843 3.652 688 HB3 GLU 93 1HB GLU 93 9.970 3.052 4.928 689 HG2 GLU 93 2HG GLU 93 11.994 1.759 5.806 690 HG3 GLU 93 1HG GLU 93 12.004 0.974 4.226 691 H LYS 94 HN LYS 94 7.925 2.292 7.285 692 HA LYS 94 HA LYS 94 10.140 2.791 9.117 693 HB2 LYS 94 2HB LYS 94 7.427 4.070 9.207 694 HB3 LYS 94 1HB LYS 94 8.916 4.638 9.931 695 HG2 LYS 94 2HG LYS 94 8.153 4.628 7.036 696 HG3 LYS 94 1HG LYS 94 8.543 6.009 8.061 697 HD2 LYS 94 2HD LYS 94 10.530 3.846 7.411 698 HD3 LYS 94 1HD LYS 94 10.325 5.273 6.412 699 HE2 LYS 94 2HE LYS 94 10.825 6.678 8.389 700 HE3 LYS 94 1HE LYS 94 11.139 5.204 9.307 701 HZ1 LYS 94 3HZ LYS 94 12.580 5.923 6.814 702 HZ2 LYS 94 1HZ LYS 94 12.956 4.671 7.895 703 HZ3 LYS 94 2HZ LYS 94 13.155 6.292 8.365 704 H LEU 95 HN LEU 95 8.129 0.360 8.853 705 HA LEU 95 HA LEU 95 6.838 0.338 11.419 706 HB2 LEU 95 2HB LEU 95 7.251 -1.847 9.379 707 HB3 LEU 95 1HB LEU 95 6.286 -2.014 10.831 708 HG LEU 95 HG LEU 95 5.720 -0.127 8.543 709 HD11 LEU 95 1HD1 LEU 95 5.280 -2.440 7.962 710 HD12 LEU 95 2HD1 LEU 95 3.764 -1.562 8.168 711 HD13 LEU 95 3HD1 LEU 95 4.332 -2.650 9.435 712 HD21 LEU 95 3HD2 LEU 95 3.613 0.328 9.715 713 HD22 LEU 95 1HD2 LEU 95 5.012 0.831 10.665 714 HD23 LEU 95 2HD2 LEU 95 4.161 -0.659 11.072 715 H GLY 96 HN GLY 96 7.271 -1.146 13.146 716 HA2 GLY 96 2HA GLY 96 10.151 -1.659 13.407 717 HA3 GLY 96 1HA GLY 96 9.030 -1.437 14.742 718 H ASN 97 HN ASN 97 9.652 -3.340 15.767 719 HA ASN 97 HA ASN 97 9.866 -5.819 14.368 720 HB2 ASN 97 2HB ASN 97 9.916 -5.120 17.298 721 HB3 ASN 97 1HB ASN 97 10.030 -6.779 16.726 722 HD21 ASN 97 1HD2 ASN 97 12.057 -7.142 17.451 723 HD22 ASN 97 2HD2 ASN 97 13.462 -6.356 16.805 724 H GLU 98 HN GLU 98 7.524 -4.595 16.783 725 HA GLU 98 HA GLU 98 5.937 -6.957 16.676 726 HB2 GLU 98 2HB GLU 98 5.932 -5.328 18.581 727 HB3 GLU 98 1HB GLU 98 5.038 -4.210 17.563 728 HG2 GLU 98 2HG GLU 98 3.206 -5.769 17.383 729 HG3 GLU 98 1HG GLU 98 4.104 -6.974 18.302 730 H GLU 99 HN GLU 99 5.882 -3.876 15.016 731 HA GLU 99 HA GLU 99 3.461 -4.148 13.645 732 HB2 GLU 99 2HB GLU 99 6.028 -2.777 12.826 733 HB3 GLU 99 1HB GLU 99 4.530 -2.650 11.921 734 HG2 GLU 99 2HG GLU 99 4.800 -0.706 13.296 735 HG3 GLU 99 1HG GLU 99 3.446 -1.658 13.896 736 H GLN 100 HN GLN 100 6.717 -5.302 12.828 737 HA GLN 100 HA GLN 100 6.093 -6.486 10.358 738 HB2 GLN 100 2HB GLN 100 8.203 -7.031 12.424 739 HB3 GLN 100 1HB GLN 100 8.055 -8.056 11.005 740 HG2 GLN 100 2HG GLN 100 8.464 -6.188 9.553 741 HG3 GLN 100 1HG GLN 100 8.457 -5.076 10.924 742 HE21 GLN 100 1HE2 GLN 100 10.209 -4.974 12.260 743 HE22 GLN 100 2HE2 GLN 100 11.727 -5.712 11.887 744 H ALA 101 HN ALA 101 6.053 -7.823 13.642 745 HA ALA 101 HA ALA 101 5.292 -10.435 12.910 746 HB1 ALA 101 1HB ALA 101 6.241 -9.871 15.102 747 HB2 ALA 101 2HB ALA 101 4.712 -10.738 15.249 748 HB3 ALA 101 3HB ALA 101 4.763 -8.994 15.504 749 H LEU 102 HN LEU 102 3.408 -7.570 13.734 750 HA LEU 102 HA LEU 102 0.869 -8.839 13.684 751 HB2 LEU 102 2HB LEU 102 1.640 -6.522 14.626 752 HB3 LEU 102 1HB LEU 102 1.299 -5.946 13.010 753 HG LEU 102 HG LEU 102 -0.538 -5.521 14.578 754 HD11 LEU 102 1HD1 LEU 102 -1.038 -5.783 12.209 755 HD12 LEU 102 2HD1 LEU 102 -2.361 -6.349 13.225 756 HD13 LEU 102 3HD1 LEU 102 -1.283 -7.513 12.452 757 HD21 LEU 102 3HD2 LEU 102 -0.718 -8.520 14.753 758 HD22 LEU 102 1HD2 LEU 102 -1.907 -7.384 15.390 759 HD23 LEU 102 2HD2 LEU 102 -0.273 -7.413 16.053 760 H LEU 103 HN LEU 103 2.687 -6.930 11.319 761 HA LEU 103 HA LEU 103 0.978 -7.057 9.140 762 HB2 LEU 103 2HB LEU 103 3.428 -6.037 9.565 763 HB3 LEU 103 1HB LEU 103 3.880 -7.454 8.645 764 HG LEU 103 HG LEU 103 3.704 -5.504 7.213 765 HD11 LEU 103 1HD1 LEU 103 2.151 -6.364 5.524 766 HD12 LEU 103 2HD1 LEU 103 1.496 -7.486 6.716 767 HD13 LEU 103 3HD1 LEU 103 3.176 -7.631 6.200 768 HD21 LEU 103 3HD2 LEU 103 0.831 -5.382 8.102 769 HD22 LEU 103 1HD2 LEU 103 1.549 -4.411 6.817 770 HD23 LEU 103 2HD2 LEU 103 2.096 -4.214 8.482 771 H PHE 104 HN PHE 104 3.502 -9.370 10.108 772 HA PHE 104 HA PHE 104 3.084 -11.322 8.172 773 HB2 PHE 104 2HB PHE 104 4.947 -11.525 9.668 774 HB3 PHE 104 1HB PHE 104 3.891 -11.582 11.073 775 HD1 PHE 104 2HD PHE 104 4.362 -13.429 7.860 776 HD2 PHE 104 1HD PHE 104 3.560 -13.626 12.035 777 HE1 PHE 104 2HE PHE 104 4.283 -15.882 7.726 778 HE2 PHE 104 1HE PHE 104 3.474 -16.082 11.908 779 HZ PHE 104 HZ PHE 104 3.835 -17.211 9.750 780 H SER 105 HN SER 105 1.517 -10.968 11.332 781 HA SER 105 HA SER 105 -0.208 -13.140 11.147 782 HB2 SER 105 2HB SER 105 -0.498 -10.497 12.574 783 HB3 SER 105 1HB SER 105 -1.540 -11.885 12.839 784 HG SER 105 HG SER 105 0.462 -11.493 14.234 785 H ILE 106 HN ILE 106 -0.455 -9.892 9.834 786 HA ILE 106 HA ILE 106 -3.135 -10.061 8.942 787 HB ILE 106 HB ILE 106 -0.852 -8.435 7.810 788 HG12 ILE 106 2HG1 ILE 106 -3.055 -7.670 9.733 789 HG13 ILE 106 1HG1 ILE 106 -1.382 -7.966 10.181 790 HG21 ILE 106 1HG2 ILE 106 -3.819 -8.137 7.388 791 HG22 ILE 106 2HG2 ILE 106 -2.656 -8.692 6.187 792 HG23 ILE 106 3HG2 ILE 106 -2.577 -7.036 6.793 793 HD11 ILE 106 3HD1 ILE 106 -0.686 -6.070 8.803 794 HD12 ILE 106 1HD1 ILE 106 -1.834 -5.596 10.055 795 HD13 ILE 106 2HD1 ILE 106 -2.372 -5.769 8.385 796 H PHE 107 HN PHE 107 -0.039 -10.783 7.331 797 HA PHE 107 HA PHE 107 -1.075 -11.738 4.908 798 HB2 PHE 107 2HB PHE 107 1.439 -12.264 6.451 799 HB3 PHE 107 1HB PHE 107 1.073 -13.246 5.041 800 HD1 PHE 107 2HD PHE 107 0.189 -11.648 2.999 801 HD2 PHE 107 1HD PHE 107 2.933 -10.585 6.068 802 HE1 PHE 107 2HE PHE 107 1.154 -9.930 1.531 803 HE2 PHE 107 1HE PHE 107 3.911 -8.865 4.603 804 HZ PHE 107 HZ PHE 107 3.021 -8.535 2.331 805 H ASN 108 HN ASN 108 -0.457 -13.348 7.987 806 HA ASN 108 HA ASN 108 -1.196 -15.947 7.232 807 HB2 ASN 108 2HB ASN 108 -0.035 -15.345 9.363 808 HB3 ASN 108 1HB ASN 108 -1.551 -14.682 9.960 809 HD21 ASN 108 1HD2 ASN 108 -3.217 -16.082 10.542 810 HD22 ASN 108 2HD2 ASN 108 -2.941 -17.774 10.786 811 H ARG 109 HN ARG 109 -3.111 -13.214 8.396 812 HA ARG 109 HA ARG 109 -5.581 -14.562 8.573 813 HB2 ARG 109 2HB ARG 109 -5.263 -12.384 9.607 814 HB3 ARG 109 1HB ARG 109 -4.982 -11.645 8.037 815 HG2 ARG 109 2HG ARG 109 -7.569 -13.037 8.395 816 HG3 ARG 109 1HG ARG 109 -7.334 -11.544 9.303 817 HD2 ARG 109 2HD ARG 109 -6.935 -10.301 7.308 818 HD3 ARG 109 1HD ARG 109 -6.851 -11.770 6.337 819 HE ARG 109 HE ARG 109 -9.344 -11.925 7.268 820 HH11 ARG 109 1HH1 ARG 109 -7.644 -9.138 5.990 821 HH12 ARG 109 2HH1 ARG 109 -9.050 -8.462 5.238 822 HH21 ARG 109 1HH2 ARG 109 -11.193 -11.048 6.275 823 HH22 ARG 109 2HH2 ARG 109 -11.077 -9.559 5.366 824 H PHE 110 HN PHE 110 -4.070 -12.754 5.909 825 HA PHE 110 HA PHE 110 -6.170 -13.060 4.059 826 HB2 PHE 110 2HB PHE 110 -3.195 -12.698 3.655 827 HB3 PHE 110 1HB PHE 110 -4.356 -12.695 2.334 828 HD1 PHE 110 1HD PHE 110 -6.548 -11.205 3.902 829 HD2 PHE 110 2HD PHE 110 -2.396 -10.474 3.318 830 HE1 PHE 110 1HE PHE 110 -6.929 -8.794 4.206 831 HE2 PHE 110 2HE PHE 110 -2.772 -8.072 3.633 832 HZ PHE 110 HZ PHE 110 -5.039 -7.226 4.074 833 H ARG 111 HN ARG 111 -3.329 -15.054 4.751 834 HA ARG 111 HA ARG 111 -3.816 -16.916 2.646 835 HB2 ARG 111 2HB ARG 111 -1.582 -16.543 3.589 836 HB3 ARG 111 1HB ARG 111 -2.119 -17.178 5.131 837 HG2 ARG 111 2HG ARG 111 -0.823 -18.826 3.971 838 HG3 ARG 111 1HG ARG 111 -2.498 -19.361 4.099 839 HD2 ARG 111 2HD ARG 111 -1.449 -17.958 1.661 840 HD3 ARG 111 1HD ARG 111 -1.311 -19.699 1.873 841 HE ARG 111 HE ARG 111 -3.963 -19.118 2.315 842 HH11 ARG 111 1HH1 ARG 111 -1.699 -18.717 -0.325 843 HH12 ARG 111 2HH1 ARG 111 -2.915 -18.843 -1.563 844 HH21 ARG 111 1HH2 ARG 111 -5.566 -19.269 0.688 845 HH22 ARG 111 2HH2 ARG 111 -5.115 -19.137 -0.981 846 H ASN 112 HN ASN 112 -4.775 -16.721 6.006 847 HA ASN 112 HA ASN 112 -5.576 -19.431 6.296 848 HB2 ASN 112 2HB ASN 112 -5.427 -17.144 7.950 849 HB3 ASN 112 1HB ASN 112 -7.100 -17.697 8.005 850 HD21 ASN 112 1HD2 ASN 112 -3.813 -18.438 8.749 851 HD22 ASN 112 2HD2 ASN 112 -4.126 -19.813 9.749 852 H SER 113 HN SER 113 -7.215 -16.522 5.226 853 HA SER 113 HA SER 113 -9.763 -17.952 5.162 854 HB2 SER 113 2HB SER 113 -10.703 -15.647 4.776 855 HB3 SER 113 1HB SER 113 -9.857 -15.850 6.311 856 HG SER 113 HG SER 113 -8.194 -14.655 5.580 857 H GLY 114 HN GLY 114 -7.449 -16.342 3.049 858 HA2 GLY 114 2HA GLY 114 -7.324 -16.324 0.729 859 HA3 GLY 114 1HA GLY 114 -8.756 -17.353 0.679 860 H LYS 115 HN LYS 115 -8.701 -14.465 2.552 861 HA LYS 115 HA LYS 115 -10.444 -13.098 0.639 862 HB2 LYS 115 2HB LYS 115 -11.724 -14.289 2.406 863 HB3 LYS 115 1HB LYS 115 -10.849 -13.392 3.629 864 HG2 LYS 115 2HG LYS 115 -11.898 -11.359 2.981 865 HG3 LYS 115 1HG LYS 115 -12.594 -12.123 1.551 866 HD2 LYS 115 2HD LYS 115 -13.928 -13.599 2.977 867 HD3 LYS 115 1HD LYS 115 -13.222 -12.852 4.410 868 HE2 LYS 115 2HE LYS 115 -14.790 -11.325 2.346 869 HE3 LYS 115 1HE LYS 115 -15.521 -12.050 3.774 870 HZ1 LYS 115 3HZ LYS 115 -13.374 -9.990 3.790 871 HZ2 LYS 115 1HZ LYS 115 -14.099 -10.680 5.162 872 HZ3 LYS 115 2HZ LYS 115 -15.017 -9.715 4.115 873 H GLY 116 HN GLY 116 -10.738 -10.732 1.492 874 HA2 GLY 116 2HA GLY 116 -9.828 -8.779 2.375 875 HA3 GLY 116 1HA GLY 116 -8.480 -9.717 2.993 876 H PHE 117 HN PHE 117 -8.218 -7.222 1.787 877 HA PHE 117 HA PHE 117 -6.533 -7.945 -0.504 878 HB2 PHE 117 2HB PHE 117 -8.507 -5.666 -0.372 879 HB3 PHE 117 1HB PHE 117 -7.145 -5.658 -1.485 880 HD1 PHE 117 2HD PHE 117 -10.254 -7.439 -0.583 881 HD2 PHE 117 1HD PHE 117 -7.199 -6.886 -3.494 882 HE1 PHE 117 2HE PHE 117 -11.581 -8.713 -2.213 883 HE2 PHE 117 1HE PHE 117 -8.522 -8.160 -5.130 884 HZ PHE 117 HZ PHE 117 -10.714 -9.075 -4.490 885 H LEU 118 HN LEU 118 -4.705 -6.573 -0.803 886 HA LEU 118 HA LEU 118 -4.023 -5.012 1.595 887 HB2 LEU 118 2HB LEU 118 -3.030 -7.300 1.619 888 HB3 LEU 118 1HB LEU 118 -2.202 -6.922 0.121 889 HG LEU 118 HG LEU 118 -0.967 -5.120 1.310 890 HD11 LEU 118 1HD1 LEU 118 -2.287 -6.281 3.754 891 HD12 LEU 118 2HD1 LEU 118 -2.570 -4.675 3.080 892 HD13 LEU 118 3HD1 LEU 118 -0.991 -5.082 3.752 893 HD21 LEU 118 3HD2 LEU 118 0.035 -7.304 0.998 894 HD22 LEU 118 1HD2 LEU 118 -0.730 -7.885 2.478 895 HD23 LEU 118 2HD2 LEU 118 0.507 -6.629 2.558 896 H LEU 119 HN LEU 119 -2.380 -3.404 1.271 897 HA LEU 119 HA LEU 119 -1.368 -2.920 -1.384 898 HB2 LEU 119 2HB LEU 119 -3.588 -1.822 -1.429 899 HB3 LEU 119 1HB LEU 119 -3.121 -0.852 -0.046 900 HG LEU 119 HG LEU 119 -1.417 0.280 -1.359 901 HD11 LEU 119 1HD1 LEU 119 -1.189 -0.144 -3.763 902 HD12 LEU 119 2HD1 LEU 119 -2.314 -1.495 -3.627 903 HD13 LEU 119 3HD1 LEU 119 -0.755 -1.564 -2.807 904 HD21 LEU 119 3HD2 LEU 119 -3.762 1.085 -1.397 905 HD22 LEU 119 1HD2 LEU 119 -4.012 0.179 -2.886 906 HD23 LEU 119 2HD2 LEU 119 -2.852 1.508 -2.849 907 H LEU 120 HN LEU 120 0.691 -2.484 -1.078 908 HA LEU 120 HA LEU 120 1.513 -1.176 1.427 909 HB2 LEU 120 2HB LEU 120 3.126 -2.910 -0.447 910 HB3 LEU 120 1HB LEU 120 3.718 -2.194 1.040 911 HG LEU 120 HG LEU 120 1.534 -4.273 0.854 912 HD11 LEU 120 1HD1 LEU 120 3.167 -5.788 1.823 913 HD12 LEU 120 2HD1 LEU 120 4.392 -4.520 1.781 914 HD13 LEU 120 3HD1 LEU 120 3.733 -5.162 0.275 915 HD21 LEU 120 3HD2 LEU 120 2.911 -3.081 3.259 916 HD22 LEU 120 1HD2 LEU 120 1.727 -4.389 3.283 917 HD23 LEU 120 2HD2 LEU 120 1.248 -2.773 2.762 918 H GLY 121 HN GLY 121 3.071 0.494 1.351 919 HA2 GLY 121 2HA GLY 121 4.135 1.427 -1.132 920 HA3 GLY 121 1HA GLY 121 2.797 2.419 -0.575 921 H SER 122 HN SER 122 5.340 3.430 -0.910 922 HA SER 122 HA SER 122 6.850 4.771 0.094 923 HB2 SER 122 2HB SER 122 4.836 5.631 1.279 924 HB3 SER 122 1HB SER 122 5.159 4.487 2.582 925 HG SER 122 HG SER 122 6.549 6.806 1.837 926 H GLU 123 HN GLU 123 8.337 3.011 -0.192 927 HA GLU 123 HA GLU 123 9.850 2.564 2.153 928 HB2 GLU 123 2HB GLU 123 9.812 0.109 2.173 929 HB3 GLU 123 1HB GLU 123 8.227 0.772 2.540 930 HG2 GLU 123 2HG GLU 123 7.393 0.212 0.405 931 HG3 GLU 123 1HG GLU 123 9.008 -0.144 -0.209 932 H TYR 124 HN TYR 124 11.781 1.132 1.616 933 HA TYR 124 HA TYR 124 12.884 1.906 -0.899 934 HB2 TYR 124 2HB TYR 124 13.941 1.181 1.517 935 HB3 TYR 124 1HB TYR 124 14.226 -0.272 0.566 936 HD1 TYR 124 2HD TYR 124 14.450 1.564 -2.068 937 HD2 TYR 124 1HD TYR 124 16.375 1.470 1.726 938 HE1 TYR 124 2HE TYR 124 16.436 2.629 -3.055 939 HE2 TYR 124 1HE TYR 124 18.363 2.534 0.749 940 HH TYR 124 HH TYR 124 18.388 4.084 -2.167 941 H THR 125 HN THR 125 12.705 -1.373 0.448 942 HA THR 125 HA THR 125 10.941 -2.418 -1.483 943 HB THR 125 HB THR 125 12.998 -4.099 -2.190 944 HG1 THR 125 1HG THR 125 14.005 -1.439 -2.314 945 HG21 THR 125 3HG2 THR 125 11.998 -1.687 -3.703 946 HG22 THR 125 1HG2 THR 125 11.286 -3.300 -3.710 947 HG23 THR 125 2HG2 THR 125 12.883 -3.038 -4.412 948 HA PRO 126 HA PRO 126 10.618 -5.387 1.730 949 HB2 PRO 126 2HB PRO 126 9.969 -7.449 -0.278 950 HB3 PRO 126 1HB PRO 126 8.977 -6.805 1.032 951 HG2 PRO 126 2HG PRO 126 8.456 -6.197 -1.516 952 HG3 PRO 126 1HG PRO 126 8.256 -4.996 -0.224 953 HD2 PRO 126 2HD PRO 126 10.504 -5.314 -2.186 954 HD3 PRO 126 1HD PRO 126 9.684 -3.833 -1.644 955 H GLN 127 HN GLN 127 12.579 -6.151 -1.030 956 HA GLN 127 HA GLN 127 13.792 -8.426 0.319 957 HB2 GLN 127 2HB GLN 127 14.164 -7.337 -2.471 958 HB3 GLN 127 1HB GLN 127 15.010 -8.742 -1.838 959 HG2 GLN 127 2HG GLN 127 12.866 -9.874 -1.500 960 HG3 GLN 127 1HG GLN 127 12.029 -8.468 -2.156 961 HE21 GLN 127 1HE2 GLN 127 12.116 -8.058 -4.351 962 HE22 GLN 127 2HE2 GLN 127 12.666 -9.231 -5.499 963 H GLN 128 HN GLN 128 14.370 -5.099 -0.050 964 HA GLN 128 HA GLN 128 17.254 -5.467 0.350 965 HB2 GLN 128 2HB GLN 128 16.497 -4.022 -1.541 966 HB3 GLN 128 1HB GLN 128 15.801 -2.916 -0.363 967 HG2 GLN 128 2HG GLN 128 17.970 -2.445 0.553 968 HG3 GLN 128 1HG GLN 128 18.710 -3.674 -0.473 969 HE21 GLN 128 1HE2 GLN 128 18.989 -3.268 -2.658 970 HE22 GLN 128 2HE2 GLN 128 18.879 -1.673 -3.326 971 H LEU 129 HN LEU 129 14.360 -4.321 1.891 972 HA LEU 129 HA LEU 129 15.607 -2.868 3.979 973 HB2 LEU 129 2HB LEU 129 12.935 -4.256 3.822 974 HB3 LEU 129 1HB LEU 129 13.442 -3.285 5.188 975 HG LEU 129 HG LEU 129 13.088 -2.279 2.364 976 HD11 LEU 129 1HD1 LEU 129 11.427 -1.857 4.845 977 HD12 LEU 129 2HD1 LEU 129 10.967 -2.806 3.433 978 HD13 LEU 129 3HD1 LEU 129 11.175 -1.061 3.291 979 HD21 LEU 129 3HD2 LEU 129 13.442 -0.066 3.333 980 HD22 LEU 129 1HD2 LEU 129 14.858 -1.094 3.566 981 HD23 LEU 129 2HD2 LEU 129 13.753 -0.798 4.908 982 H VAL 130 HN VAL 130 16.327 -3.504 5.975 983 HA VAL 130 HA VAL 130 16.918 -6.307 6.321 984 HB VAL 130 HB VAL 130 17.448 -4.066 8.280 985 HG11 VAL 130 1HG1 VAL 130 18.665 -6.810 7.953 986 HG12 VAL 130 2HG1 VAL 130 17.624 -6.271 9.270 987 HG13 VAL 130 3HG1 VAL 130 19.238 -5.581 9.082 988 HG21 VAL 130 3HG2 VAL 130 19.242 -5.109 6.086 989 HG22 VAL 130 1HG2 VAL 130 19.694 -3.924 7.312 990 HG23 VAL 130 2HG2 VAL 130 18.459 -3.530 6.116 991 H ILE 131 HN ILE 131 14.727 -7.026 6.419 992 HA ILE 131 HA ILE 131 13.368 -6.470 8.968 993 HB ILE 131 HB ILE 131 11.311 -7.317 7.858 994 HG12 ILE 131 2HG1 ILE 131 13.000 -7.239 5.348 995 HG13 ILE 131 1HG1 ILE 131 12.445 -8.705 6.147 996 HG21 ILE 131 1HG2 ILE 131 12.658 -4.994 6.487 997 HG22 ILE 131 2HG2 ILE 131 11.721 -4.931 7.979 998 HG23 ILE 131 3HG2 ILE 131 10.926 -5.335 6.458 999 HD11 ILE 131 3HD1 ILE 131 11.064 -8.223 4.234 1000 HD12 ILE 131 1HD1 ILE 131 10.715 -6.608 4.854 1001 HD13 ILE 131 2HD1 ILE 131 10.122 -8.032 5.712 1002 H ARG 132 HN ARG 132 11.814 -8.498 9.425 1003 HA ARG 132 HA ARG 132 13.522 -10.645 10.108 1004 HB2 ARG 132 2HB ARG 132 11.351 -9.972 11.248 1005 HB3 ARG 132 1HB ARG 132 10.510 -10.801 9.951 1006 HG2 ARG 132 2HG ARG 132 11.493 -12.892 10.580 1007 HG3 ARG 132 1HG ARG 132 12.535 -12.100 11.759 1008 HD2 ARG 132 2HD ARG 132 10.801 -13.027 13.028 1009 HD3 ARG 132 1HD ARG 132 10.390 -11.320 12.891 1010 HE ARG 132 HE ARG 132 9.142 -12.770 10.817 1011 HH11 ARG 132 1HH1 ARG 132 8.924 -12.185 14.268 1012 HH12 ARG 132 2HH1 ARG 132 7.266 -12.679 14.366 1013 HH21 ARG 132 1HH2 ARG 132 6.960 -13.426 10.942 1014 HH22 ARG 132 2HH2 ARG 132 6.153 -13.386 12.487 1015 H GLU 133 HN GLU 133 13.998 -12.486 9.115 1016 HA GLU 133 HA GLU 133 13.783 -12.819 6.372 1017 HB2 GLU 133 2HB GLU 133 15.412 -14.008 7.762 1018 HB3 GLU 133 1HB GLU 133 14.117 -14.949 8.491 1019 HG2 GLU 133 2HG GLU 133 13.600 -15.802 6.178 1020 HG3 GLU 133 1HG GLU 133 15.111 -15.053 5.659 1021 H ASP 134 HN ASP 134 11.645 -13.844 8.924 1022 HA ASP 134 HA ASP 134 10.059 -15.674 7.477 1023 HB2 ASP 134 2HB ASP 134 9.905 -15.781 9.822 1024 HB3 ASP 134 1HB ASP 134 9.644 -14.049 9.973 1025 H LEU 135 HN LEU 135 9.954 -12.193 7.834 1026 HA LEU 135 HA LEU 135 7.339 -11.965 6.639 1027 HB2 LEU 135 2HB LEU 135 8.112 -10.408 8.392 1028 HB3 LEU 135 1HB LEU 135 9.364 -9.828 7.311 1029 HG LEU 135 HG LEU 135 7.594 -9.020 5.759 1030 HD11 LEU 135 1HD1 LEU 135 5.301 -8.868 6.551 1031 HD12 LEU 135 2HD1 LEU 135 5.736 -9.752 8.014 1032 HD13 LEU 135 3HD1 LEU 135 5.820 -10.550 6.443 1033 HD21 LEU 135 3HD2 LEU 135 7.458 -7.954 8.576 1034 HD22 LEU 135 1HD2 LEU 135 6.936 -7.099 7.124 1035 HD23 LEU 135 2HD2 LEU 135 8.639 -7.503 7.347 1036 H ARG 136 HN ARG 136 10.665 -11.760 5.622 1037 HA ARG 136 HA ARG 136 10.308 -10.250 3.272 1038 HB2 ARG 136 2HB ARG 136 12.503 -10.840 4.439 1039 HB3 ARG 136 1HB ARG 136 12.404 -12.394 3.617 1040 HG2 ARG 136 2HG ARG 136 12.278 -11.146 1.456 1041 HG3 ARG 136 1HG ARG 136 12.604 -9.670 2.361 1042 HD2 ARG 136 2HD ARG 136 14.390 -12.065 2.025 1043 HD3 ARG 136 1HD ARG 136 14.669 -10.424 1.452 1044 HE ARG 136 HE ARG 136 15.248 -11.478 4.043 1045 HH11 ARG 136 1HH1 ARG 136 14.292 -8.528 2.413 1046 HH12 ARG 136 2HH1 ARG 136 15.123 -7.490 3.528 1047 HH21 ARG 136 1HH2 ARG 136 16.370 -10.114 5.497 1048 HH22 ARG 136 2HH2 ARG 136 16.317 -8.396 5.269 1049 H THR 137 HN THR 137 10.041 -13.700 3.920 1050 HA THR 137 HA THR 137 9.802 -14.438 1.171 1051 HB THR 137 HB THR 137 8.947 -16.620 2.175 1052 HG1 THR 137 1HG THR 137 8.935 -16.809 4.345 1053 HG21 THR 137 3HG2 THR 137 11.278 -16.277 1.507 1054 HG22 THR 137 1HG2 THR 137 11.176 -17.261 2.967 1055 HG23 THR 137 2HG2 THR 137 11.628 -15.560 3.079 1056 H ARG 138 HN ARG 138 7.555 -13.568 3.729 1057 HA ARG 138 HA ARG 138 5.191 -14.319 2.359 1058 HB2 ARG 138 2HB ARG 138 5.577 -12.167 4.447 1059 HB3 ARG 138 1HB ARG 138 4.051 -12.923 4.000 1060 HG2 ARG 138 2HG ARG 138 6.408 -14.328 5.238 1061 HG3 ARG 138 1HG ARG 138 4.944 -13.832 6.078 1062 HD2 ARG 138 2HD ARG 138 3.623 -15.290 4.606 1063 HD3 ARG 138 1HD ARG 138 5.106 -15.796 3.798 1064 HE ARG 138 HE ARG 138 5.267 -16.263 6.594 1065 HH11 ARG 138 1HH1 ARG 138 3.922 -17.501 3.625 1066 HH12 ARG 138 2HH1 ARG 138 3.714 -19.118 4.224 1067 HH21 ARG 138 1HH2 ARG 138 5.005 -18.400 7.420 1068 HH22 ARG 138 2HH2 ARG 138 4.301 -19.620 6.398 1069 H MET 139 HN MET 139 7.300 -11.579 2.209 1070 HA MET 139 HA MET 139 5.545 -9.869 0.746 1071 HB2 MET 139 2HB MET 139 8.546 -9.883 1.077 1072 HB3 MET 139 1HB MET 139 7.666 -8.629 0.221 1073 HG2 MET 139 2HG MET 139 7.316 -9.342 3.122 1074 HG3 MET 139 1HG MET 139 8.233 -7.976 2.497 1075 HE1 MET 139 3HE MET 139 6.949 -6.135 3.840 1076 HE2 MET 139 1HE MET 139 6.108 -7.439 4.676 1077 HE3 MET 139 2HE MET 139 5.193 -6.092 3.997 1078 H ALA 140 HN ALA 140 7.391 -12.606 -0.046 1079 HA ALA 140 HA ALA 140 8.163 -11.977 -2.684 1080 HB1 ALA 140 1HB ALA 140 8.634 -14.323 -2.953 1081 HB2 ALA 140 2HB ALA 140 7.669 -14.712 -1.528 1082 HB3 ALA 140 3HB ALA 140 9.162 -13.792 -1.357 1083 H TYR 141 HN TYR 141 5.121 -13.234 -1.392 1084 HA TYR 141 HA TYR 141 4.188 -13.648 -4.123 1085 HB2 TYR 141 2HB TYR 141 2.111 -14.535 -3.028 1086 HB3 TYR 141 1HB TYR 141 3.571 -15.457 -2.731 1087 HD1 TYR 141 1HD TYR 141 1.159 -13.094 -1.211 1088 HD2 TYR 141 2HD TYR 141 4.355 -15.813 -0.538 1089 HE1 TYR 141 1HE TYR 141 0.679 -13.049 1.203 1090 HE2 TYR 141 2HE TYR 141 3.894 -15.773 1.873 1091 HH TYR 141 HH TYR 141 1.068 -14.598 3.191 1092 H CYS 142 HN CYS 142 4.665 -11.038 -2.575 1093 HA CYS 142 HA CYS 142 2.095 -9.792 -3.218 1094 HB2 CYS 142 2HB CYS 142 3.058 -9.286 -0.976 1095 HB3 CYS 142 1HB CYS 142 4.485 -8.623 -1.763 1096 HG CYS 142 HG CYS 142 3.578 -6.247 -2.072 1097 H LEU 143 HN LEU 143 1.930 -8.724 -5.080 1098 HA LEU 143 HA LEU 143 4.055 -8.796 -6.958 1099 HB2 LEU 143 2HB LEU 143 1.371 -7.447 -7.027 1100 HB3 LEU 143 1HB LEU 143 2.496 -7.374 -8.362 1101 HG LEU 143 HG LEU 143 2.401 -9.924 -8.337 1102 HD11 LEU 143 1HD1 LEU 143 1.345 -10.218 -6.166 1103 HD12 LEU 143 2HD1 LEU 143 0.368 -10.923 -7.453 1104 HD13 LEU 143 3HD1 LEU 143 -0.092 -9.374 -6.746 1105 HD21 LEU 143 3HD2 LEU 143 1.407 -8.568 -10.081 1106 HD22 LEU 143 1HD2 LEU 143 -0.040 -8.340 -9.099 1107 HD23 LEU 143 2HD2 LEU 143 0.375 -9.946 -9.699 1108 H VAL 144 HN VAL 144 5.000 -6.988 -8.070 1109 HA VAL 144 HA VAL 144 5.379 -4.677 -6.280 1110 HB VAL 144 HB VAL 144 7.472 -5.995 -8.025 1111 HG11 VAL 144 1HG1 VAL 144 7.804 -3.597 -7.905 1112 HG12 VAL 144 2HG1 VAL 144 9.042 -4.427 -6.962 1113 HG13 VAL 144 3HG1 VAL 144 7.688 -3.643 -6.147 1114 HG21 VAL 144 3HG2 VAL 144 8.569 -6.593 -5.910 1115 HG22 VAL 144 1HG2 VAL 144 6.975 -7.331 -6.053 1116 HG23 VAL 144 2HG2 VAL 144 7.205 -5.923 -5.019 1117 H TYR 145 HN TYR 145 4.582 -2.919 -7.181 1118 HA TYR 145 HA TYR 145 5.065 -2.490 -10.055 1119 HB2 TYR 145 2HB TYR 145 2.651 -1.783 -8.395 1120 HB3 TYR 145 1HB TYR 145 3.001 -0.965 -9.913 1121 HD1 TYR 145 1HD TYR 145 2.134 -4.228 -8.401 1122 HD2 TYR 145 2HD TYR 145 2.587 -2.007 -11.999 1123 HE1 TYR 145 1HE TYR 145 1.009 -6.026 -9.649 1124 HE2 TYR 145 2HE TYR 145 1.463 -3.795 -13.253 1125 HH TYR 145 HH TYR 145 0.996 -6.156 -13.073 1126 H GLU 146 HN GLU 146 6.508 -0.964 -10.357 1127 HA GLU 146 HA GLU 146 7.028 1.003 -8.287 1128 HB2 GLU 146 2HB GLU 146 8.360 0.597 -10.976 1129 HB3 GLU 146 1HB GLU 146 8.915 1.685 -9.710 1130 HG2 GLU 146 2HG GLU 146 9.243 -0.253 -8.224 1131 HG3 GLU 146 1HG GLU 146 8.760 -1.319 -9.541 1132 H VAL 147 HN VAL 147 5.967 2.855 -8.232 1133 HA VAL 147 HA VAL 147 4.083 3.493 -10.269 1134 HB VAL 147 HB VAL 147 4.861 5.192 -7.896 1135 HG11 VAL 147 1HG1 VAL 147 2.620 6.161 -8.163 1136 HG12 VAL 147 2HG1 VAL 147 2.373 5.177 -9.606 1137 HG13 VAL 147 3HG1 VAL 147 3.621 6.423 -9.592 1138 HG21 VAL 147 3HG2 VAL 147 4.176 2.990 -7.151 1139 HG22 VAL 147 1HG2 VAL 147 2.722 3.084 -8.143 1140 HG23 VAL 147 2HG2 VAL 147 2.927 4.177 -6.774 1141 H LYS 148 HN LYS 148 5.322 3.832 -12.085 1142 HA LYS 148 HA LYS 148 5.682 6.515 -12.740 1143 HB2 LYS 148 2HB LYS 148 7.809 6.099 -11.362 1144 HB3 LYS 148 1HB LYS 148 8.323 5.048 -12.674 1145 HG2 LYS 148 2HG LYS 148 9.316 7.237 -12.916 1146 HG3 LYS 148 1HG LYS 148 8.175 6.942 -14.231 1147 HD2 LYS 148 2HD LYS 148 6.475 8.251 -13.027 1148 HD3 LYS 148 1HD LYS 148 7.643 8.567 -11.744 1149 HE2 LYS 148 2HE LYS 148 8.018 9.370 -14.628 1150 HE3 LYS 148 1HE LYS 148 7.381 10.433 -13.377 1151 HZ1 LYS 148 3HZ LYS 148 9.749 10.779 -13.756 1152 HZ2 LYS 148 1HZ LYS 148 10.072 9.169 -13.342 1153 HZ3 LYS 148 2HZ LYS 148 9.456 10.237 -12.178 1154 HA PRO 149 HA PRO 149 4.529 3.680 -16.159 1155 HB2 PRO 149 2HB PRO 149 3.997 6.406 -17.259 1156 HB3 PRO 149 1HB PRO 149 3.005 4.945 -17.347 1157 HG2 PRO 149 2HG PRO 149 2.376 6.884 -15.649 1158 HG3 PRO 149 1HG PRO 149 2.227 5.183 -15.169 1159 HD2 PRO 149 2HD PRO 149 4.303 7.191 -14.418 1160 HD3 PRO 149 1HD PRO 149 3.601 5.877 -13.454 Start of MODEL 4 1 H1 MET 1 H1 MET 1 34.435 1.735 24.914 2 H2 MET 1 H2 MET 1 34.306 2.720 23.537 3 H3 MET 1 H3 MET 1 32.925 1.977 24.180 4 HA MET 1 HA MET 1 33.162 3.276 26.207 5 HB2 MET 1 2HB MET 1 35.631 3.606 25.958 6 HB3 MET 1 1HB MET 1 35.311 4.725 24.642 7 HG2 MET 1 2HG MET 1 34.029 6.137 26.227 8 HG3 MET 1 1HG MET 1 34.525 5.051 27.524 9 HE1 MET 1 2HE MET 1 38.461 5.500 27.364 10 HE2 MET 1 3HE MET 1 37.517 4.346 26.423 11 HE3 MET 1 1HE MET 1 37.139 4.615 28.124 12 H GLY 2 HN GLY 2 31.343 4.424 26.107 13 HA2 GLY 2 2HA GLY 2 30.878 6.710 24.661 14 HA3 GLY 2 1HA GLY 2 30.366 5.405 23.600 15 H HIS 3 HN HIS 3 29.741 7.125 26.552 16 HA HIS 3 HA HIS 3 27.452 5.548 27.283 17 HB2 HIS 3 2HB HIS 3 28.879 6.977 28.853 18 HB3 HIS 3 1HB HIS 3 28.046 8.371 28.176 19 HD1 HIS 3 1HD HIS 3 25.757 8.914 29.094 20 HD2 HIS 3 2HD HIS 3 27.188 5.207 30.340 21 HE1 HIS 3 1HE HIS 3 24.155 8.125 30.873 22 HE2 HIS 3 2HE HIS 3 25.137 5.960 31.726 23 H HIS 4 HN HIS 4 25.952 5.477 25.691 24 HA HIS 4 HA HIS 4 25.148 7.966 24.378 25 HB2 HIS 4 2HB HIS 4 24.561 5.072 23.742 26 HB3 HIS 4 1HB HIS 4 23.833 6.421 22.880 27 HD1 HIS 4 1HD HIS 4 26.564 4.152 22.635 28 HD2 HIS 4 2HD HIS 4 26.024 8.185 21.761 29 HE1 HIS 4 1HE HIS 4 28.391 4.747 21.010 30 HE2 HIS 4 2HE HIS 4 27.919 7.132 20.342 31 H HIS 5 HN HIS 5 22.985 8.607 24.253 32 HA HIS 5 HA HIS 5 21.070 7.252 25.987 33 HB2 HIS 5 2HB HIS 5 20.434 9.405 27.074 34 HB3 HIS 5 1HB HIS 5 22.053 8.864 27.499 35 HD1 HIS 5 1HD HIS 5 23.965 10.432 27.002 36 HD2 HIS 5 2HD HIS 5 20.382 11.663 25.290 37 HE1 HIS 5 1HE HIS 5 24.401 12.737 26.108 38 HE2 HIS 5 2HE HIS 5 22.160 13.543 25.286 39 H HIS 6 HN HIS 6 18.971 7.486 25.358 40 HA HIS 6 HA HIS 6 18.519 8.521 22.707 41 HB2 HIS 6 2HB HIS 6 16.639 7.267 24.721 42 HB3 HIS 6 1HB HIS 6 16.164 7.749 23.100 43 HD1 HIS 6 1HD HIS 6 17.103 4.851 24.898 44 HD2 HIS 6 2HD HIS 6 17.992 6.329 21.110 45 HE1 HIS 6 1HE HIS 6 17.877 2.869 23.556 46 HE2 HIS 6 2HE HIS 6 18.300 3.761 21.236 47 H HIS 7 HN HIS 7 16.775 10.025 22.225 48 HA HIS 7 HA HIS 7 16.479 12.059 24.324 49 HB2 HIS 7 2HB HIS 7 16.546 12.219 21.336 50 HB3 HIS 7 1HB HIS 7 15.671 13.446 22.245 51 HD1 HIS 7 1HD HIS 7 19.147 12.171 21.586 52 HD2 HIS 7 2HD HIS 7 17.251 15.246 23.657 53 HE1 HIS 7 1HE HIS 7 20.966 13.796 22.220 54 HE2 HIS 7 2HE HIS 7 19.778 15.701 23.365 55 H HIS 8 HN HIS 8 14.414 13.192 24.410 56 HA HIS 8 HA HIS 8 12.302 11.419 24.868 57 HB2 HIS 8 2HB HIS 8 10.972 13.344 25.390 58 HB3 HIS 8 1HB HIS 8 12.616 13.692 25.918 59 HD1 HIS 8 1HD HIS 8 9.904 15.264 24.266 60 HD2 HIS 8 2HD HIS 8 14.020 15.238 23.685 61 HE1 HIS 8 1HE HIS 8 10.402 17.288 22.869 62 HE2 HIS 8 2HE HIS 8 12.858 17.111 22.333 63 H SER 9 HN SER 9 10.323 11.087 23.838 64 HA SER 9 HA SER 9 10.331 11.511 20.954 65 HB2 SER 9 2HB SER 9 8.255 10.042 21.088 66 HB3 SER 9 1HB SER 9 9.757 9.279 21.611 67 HG SER 9 HG SER 9 8.210 8.839 23.153 68 H HIS 10 HN HIS 10 8.007 12.045 20.061 69 HA HIS 10 HA HIS 10 6.910 14.229 21.704 70 HB2 HIS 10 2HB HIS 10 8.129 15.085 19.745 71 HB3 HIS 10 1HB HIS 10 7.111 14.117 18.686 72 HD1 HIS 10 1HD HIS 10 5.417 15.505 17.582 73 HD2 HIS 10 2HD HIS 10 6.222 16.855 21.430 74 HE1 HIS 10 1HE HIS 10 3.967 17.534 17.906 75 HE2 HIS 10 2HE HIS 10 4.280 18.168 20.327 76 H MET 11 HN MET 11 5.948 12.419 18.791 77 HA MET 11 HA MET 11 4.006 11.446 18.158 78 HB2 MET 11 2HB MET 11 3.728 10.943 21.124 79 HB3 MET 11 1HB MET 11 2.707 10.220 19.891 80 HG2 MET 11 2HG MET 11 4.671 9.134 18.914 81 HG3 MET 11 1HG MET 11 5.677 9.840 20.177 82 HE1 MET 11 3HE MET 11 5.593 6.061 21.191 83 HE2 MET 11 1HE MET 11 6.613 7.450 20.811 84 HE3 MET 11 2HE MET 11 5.621 6.714 19.553 85 H ASP 12 HN ASP 12 3.140 13.431 17.412 86 HA ASP 12 HA ASP 12 1.231 14.759 19.180 87 HB2 ASP 12 2HB ASP 12 1.026 16.449 17.426 88 HB3 ASP 12 1HB ASP 12 2.712 16.202 17.863 89 H TYR 13 HN TYR 13 -0.929 15.268 18.311 90 HA TYR 13 HA TYR 13 -2.044 12.773 17.297 91 HB2 TYR 13 2HB TYR 13 -3.408 15.194 18.494 92 HB3 TYR 13 1HB TYR 13 -4.203 13.682 18.064 93 HD1 TYR 13 1HD TYR 13 -3.630 11.597 19.328 94 HD2 TYR 13 2HD TYR 13 -2.244 15.431 20.545 95 HE1 TYR 13 1HE TYR 13 -3.140 10.704 21.565 96 HE2 TYR 13 2HE TYR 13 -1.753 14.548 22.786 97 HH TYR 13 HH TYR 13 -2.497 12.684 24.233 98 HA PRO 14 HA PRO 14 -2.764 14.471 13.253 99 HB2 PRO 14 2HB PRO 14 -4.657 12.661 12.465 100 HB3 PRO 14 1HB PRO 14 -2.923 12.327 12.458 101 HG2 PRO 14 2HG PRO 14 -4.993 11.568 14.473 102 HG3 PRO 14 1HG PRO 14 -3.646 10.607 13.836 103 HD2 PRO 14 2HD PRO 14 -3.544 11.806 16.255 104 HD3 PRO 14 1HD PRO 14 -2.105 11.610 15.238 105 H SER 15 HN SER 15 -4.518 15.431 12.031 106 HA SER 15 HA SER 15 -6.784 16.198 13.750 107 HB2 SER 15 2HB SER 15 -5.090 18.014 13.499 108 HB3 SER 15 1HB SER 15 -5.350 17.970 11.757 109 HG SER 15 HG SER 15 -7.177 18.997 11.980 110 H PHE 16 HN PHE 16 -8.351 14.953 12.918 111 HA PHE 16 HA PHE 16 -8.791 14.896 10.029 112 HB2 PHE 16 2HB PHE 16 -10.274 13.485 12.259 113 HB3 PHE 16 1HB PHE 16 -10.522 13.226 10.537 114 HD1 PHE 16 2HD PHE 16 -8.649 12.242 9.177 115 HD2 PHE 16 1HD PHE 16 -8.593 12.339 13.430 116 HE1 PHE 16 2HE PHE 16 -6.922 10.487 9.191 117 HE2 PHE 16 1HE PHE 16 -6.868 10.585 13.452 118 HZ PHE 16 HZ PHE 16 -6.030 9.657 11.332 119 H ASP 17 HN ASP 17 -11.439 14.796 9.723 120 HA ASP 17 HA ASP 17 -13.390 15.956 9.635 121 HB2 ASP 17 2HB ASP 17 -13.428 15.684 12.080 122 HB3 ASP 17 1HB ASP 17 -12.469 17.148 12.262 123 H LYS 18 HN LYS 18 -12.320 16.925 7.794 124 HA LYS 18 HA LYS 18 -12.443 19.778 7.816 125 HB2 LYS 18 2HB LYS 18 -10.171 19.362 8.804 126 HB3 LYS 18 1HB LYS 18 -9.730 18.523 7.325 127 HG2 LYS 18 2HG LYS 18 -8.829 20.689 7.154 128 HG3 LYS 18 1HG LYS 18 -10.238 20.663 6.093 129 HD2 LYS 18 2HD LYS 18 -10.264 22.724 7.319 130 HD3 LYS 18 1HD LYS 18 -11.561 21.700 7.935 131 HE2 LYS 18 2HE LYS 18 -10.484 22.694 9.813 132 HE3 LYS 18 1HE LYS 18 -10.012 20.996 9.771 133 HZ1 LYS 18 3HZ LYS 18 -8.380 23.302 8.845 134 HZ2 LYS 18 1HZ LYS 18 -7.922 21.673 8.696 135 HZ3 LYS 18 2HZ LYS 18 -8.109 22.363 10.228 136 H PHE 19 HN PHE 19 -13.318 20.239 5.849 137 HA PHE 19 HA PHE 19 -12.443 18.655 3.565 138 HB2 PHE 19 2HB PHE 19 -15.224 19.727 3.547 139 HB3 PHE 19 1HB PHE 19 -14.567 18.286 2.802 140 HD1 PHE 19 2HD PHE 19 -13.891 16.360 4.469 141 HD2 PHE 19 1HD PHE 19 -16.594 19.521 5.367 142 HE1 PHE 19 2HE PHE 19 -14.868 15.006 6.281 143 HE2 PHE 19 1HE PHE 19 -17.579 18.177 7.174 144 HZ PHE 19 HZ PHE 19 -16.715 15.917 7.637 145 H LEU 20 HN LEU 20 -13.282 22.665 3.522 146 HA LEU 20 HA LEU 20 -14.810 20.683 5.037 147 HB2 LEU 20 2HB LEU 20 -14.006 23.497 5.543 148 HB3 LEU 20 1HB LEU 20 -15.578 23.005 6.138 149 HG LEU 20 HG LEU 20 -12.977 21.648 6.844 150 HD11 LEU 20 1HD1 LEU 20 -13.107 23.922 7.755 151 HD12 LEU 20 2HD1 LEU 20 -13.220 22.700 9.021 152 HD13 LEU 20 3HD1 LEU 20 -14.672 23.538 8.475 153 HD21 LEU 20 3HD2 LEU 20 -14.908 20.158 6.942 154 HD22 LEU 20 1HD2 LEU 20 -15.761 21.321 7.956 155 HD23 LEU 20 2HD2 LEU 20 -14.307 20.526 8.558 156 H GLY 21 HN GLY 21 -15.054 23.332 2.746 157 HA2 GLY 21 2HA GLY 21 -17.936 22.727 2.498 158 HA3 GLY 21 1HA GLY 21 -17.349 24.381 2.509 159 H THR 22 HN THR 22 -15.997 25.076 0.726 160 HA THR 22 HA THR 22 -17.086 24.028 -1.733 161 HB THR 22 HB THR 22 -15.756 26.012 -2.709 162 HG1 THR 22 1HG THR 22 -15.213 27.592 -1.138 163 HG21 THR 22 3HG2 THR 22 -17.486 27.606 -1.981 164 HG22 THR 22 1HG2 THR 22 -17.977 26.482 -0.713 165 HG23 THR 22 2HG2 THR 22 -18.177 26.041 -2.410 166 H GLU 23 HN GLU 23 -15.924 23.374 -3.515 167 HA GLU 23 HA GLU 23 -14.523 21.923 -4.517 168 HB2 GLU 23 2HB GLU 23 -13.223 24.045 -4.717 169 HB3 GLU 23 1HB GLU 23 -12.322 23.578 -3.277 170 HG2 GLU 23 2HG GLU 23 -11.576 21.538 -4.426 171 HG3 GLU 23 1HG GLU 23 -12.435 22.054 -5.872 172 H ASN 24 HN ASN 24 -15.111 20.119 -3.302 173 HA ASN 24 HA ASN 24 -13.191 19.266 -1.259 174 HB2 ASN 24 2HB ASN 24 -15.666 19.033 -0.874 175 HB3 ASN 24 1HB ASN 24 -15.710 17.869 -2.191 176 HD21 ASN 24 1HD2 ASN 24 -13.041 18.084 0.090 177 HD22 ASN 24 2HD2 ASN 24 -13.370 16.578 0.874 178 H ALA 25 HN ALA 25 -11.928 19.519 -3.469 179 HA ALA 25 HA ALA 25 -12.162 17.526 -5.443 180 HB1 ALA 25 1HB ALA 25 -10.078 18.357 -6.312 181 HB2 ALA 25 2HB ALA 25 -9.720 19.168 -4.788 182 HB3 ALA 25 3HB ALA 25 -11.069 19.718 -5.783 183 H GLU 26 HN GLU 26 -10.574 17.540 -2.362 184 HA GLU 26 HA GLU 26 -8.677 15.525 -2.801 185 HB2 GLU 26 2HB GLU 26 -10.193 16.178 -0.271 186 HB3 GLU 26 1HB GLU 26 -8.736 15.196 -0.356 187 HG2 GLU 26 2HG GLU 26 -7.496 17.126 -1.216 188 HG3 GLU 26 1HG GLU 26 -8.955 18.109 -1.091 189 H LEU 27 HN LEU 27 -12.075 15.375 -1.895 190 HA LEU 27 HA LEU 27 -12.223 12.572 -1.586 191 HB2 LEU 27 2HB LEU 27 -13.811 14.544 -0.897 192 HB3 LEU 27 1HB LEU 27 -14.514 14.272 -2.475 193 HG LEU 27 HG LEU 27 -15.644 13.181 -0.521 194 HD11 LEU 27 1HD1 LEU 27 -14.729 11.391 -2.764 195 HD12 LEU 27 2HD1 LEU 27 -16.103 12.496 -2.811 196 HD13 LEU 27 3HD1 LEU 27 -16.126 11.107 -1.725 197 HD21 LEU 27 3HD2 LEU 27 -13.244 11.369 -0.653 198 HD22 LEU 27 1HD2 LEU 27 -14.708 11.064 0.282 199 HD23 LEU 27 2HD2 LEU 27 -13.679 12.437 0.682 200 H VAL 28 HN VAL 28 -12.607 14.764 -4.304 201 HA VAL 28 HA VAL 28 -13.627 12.908 -6.170 202 HB VAL 28 HB VAL 28 -11.953 15.361 -6.740 203 HG11 VAL 28 1HG1 VAL 28 -13.898 13.844 -8.472 204 HG12 VAL 28 2HG1 VAL 28 -12.146 13.896 -8.668 205 HG13 VAL 28 3HG1 VAL 28 -13.103 15.358 -8.906 206 HG21 VAL 28 3HG2 VAL 28 -14.082 16.541 -6.985 207 HG22 VAL 28 1HG2 VAL 28 -13.883 15.910 -5.350 208 HG23 VAL 28 2HG2 VAL 28 -14.947 15.086 -6.490 209 H TYR 29 HN TYR 29 -10.369 13.783 -5.190 210 HA TYR 29 HA TYR 29 -8.946 12.355 -7.158 211 HB2 TYR 29 2HB TYR 29 -7.970 14.070 -5.637 212 HB3 TYR 29 1HB TYR 29 -8.131 12.939 -4.301 213 HD1 TYR 29 1HD TYR 29 -6.503 13.337 -7.623 214 HD2 TYR 29 2HD TYR 29 -6.386 11.470 -3.803 215 HE1 TYR 29 1HE TYR 29 -4.266 12.450 -8.132 216 HE2 TYR 29 2HE TYR 29 -4.152 10.574 -4.301 217 HH TYR 29 HH TYR 29 -2.289 11.667 -6.938 218 H VAL 30 HN VAL 30 -10.516 11.408 -4.216 219 HA VAL 30 HA VAL 30 -9.356 8.856 -3.880 220 HB VAL 30 HB VAL 30 -12.032 9.936 -2.978 221 HG11 VAL 30 1HG1 VAL 30 -12.092 7.497 -3.050 222 HG12 VAL 30 2HG1 VAL 30 -12.083 8.083 -1.386 223 HG13 VAL 30 3HG1 VAL 30 -10.609 7.427 -2.099 224 HG21 VAL 30 3HG2 VAL 30 -9.427 9.580 -1.499 225 HG22 VAL 30 1HG2 VAL 30 -10.934 10.192 -0.817 226 HG23 VAL 30 2HG2 VAL 30 -10.093 11.114 -2.064 227 H LEU 31 HN LEU 31 -12.009 10.049 -5.811 228 HA LEU 31 HA LEU 31 -13.282 7.612 -6.381 229 HB2 LEU 31 2HB LEU 31 -13.130 10.110 -8.068 230 HB3 LEU 31 1HB LEU 31 -14.273 8.799 -8.297 231 HG LEU 31 HG LEU 31 -14.122 10.597 -5.872 232 HD11 LEU 31 1HD1 LEU 31 -16.226 11.506 -6.668 233 HD12 LEU 31 2HD1 LEU 31 -16.168 10.454 -8.082 234 HD13 LEU 31 3HD1 LEU 31 -14.963 11.727 -7.879 235 HD21 LEU 31 3HD2 LEU 31 -16.081 8.413 -6.583 236 HD22 LEU 31 1HD2 LEU 31 -16.212 9.505 -5.206 237 HD23 LEU 31 2HD2 LEU 31 -14.881 8.353 -5.292 238 H ARG 32 HN ARG 32 -13.468 6.887 -8.787 239 HA ARG 32 HA ARG 32 -12.566 5.716 -10.495 240 HB2 ARG 32 2HB ARG 32 -10.099 7.397 -9.995 241 HB3 ARG 32 1HB ARG 32 -10.280 6.270 -11.334 242 HG2 ARG 32 2HG ARG 32 -12.130 7.560 -12.211 243 HG3 ARG 32 1HG ARG 32 -12.048 8.654 -10.828 244 HD2 ARG 32 2HD ARG 32 -9.810 9.354 -11.506 245 HD3 ARG 32 1HD ARG 32 -9.864 8.237 -12.870 246 HE ARG 32 HE ARG 32 -12.054 9.753 -13.273 247 HH11 ARG 32 1HH1 ARG 32 -8.708 10.591 -12.633 248 HH12 ARG 32 2HH1 ARG 32 -8.767 12.057 -13.570 249 HH21 ARG 32 1HH2 ARG 32 -12.156 11.709 -14.428 250 HH22 ARG 32 2HH2 ARG 32 -10.743 12.711 -14.560 251 H HIS 33 HN HIS 33 -12.829 3.908 -9.266 252 HA HIS 33 HA HIS 33 -11.186 2.916 -7.277 253 HB2 HIS 33 2HB HIS 33 -12.205 0.730 -7.727 254 HB3 HIS 33 1HB HIS 33 -13.407 2.013 -7.752 255 HD1 HIS 33 1HD HIS 33 -12.485 -0.908 -9.536 256 HD2 HIS 33 2HD HIS 33 -13.866 2.858 -10.644 257 HE1 HIS 33 1HE HIS 33 -13.406 -1.174 -11.860 258 HE2 HIS 33 2HE HIS 33 -14.055 1.153 -12.578 259 H LYS 34 HN LYS 34 -9.363 1.761 -7.159 260 HA LYS 34 HA LYS 34 -7.854 1.332 -9.622 261 HB2 LYS 34 2HB LYS 34 -6.994 1.193 -6.723 262 HB3 LYS 34 1HB LYS 34 -5.932 0.899 -8.092 263 HG2 LYS 34 2HG LYS 34 -5.457 3.094 -7.517 264 HG3 LYS 34 1HG LYS 34 -6.600 3.272 -8.847 265 HD2 LYS 34 2HD LYS 34 -8.415 3.623 -7.237 266 HD3 LYS 34 1HD LYS 34 -7.272 3.441 -5.906 267 HE2 LYS 34 2HE LYS 34 -7.612 5.774 -6.216 268 HE3 LYS 34 1HE LYS 34 -6.011 5.401 -6.850 269 HZ1 LYS 34 3HZ LYS 34 -8.457 5.672 -8.513 270 HZ2 LYS 34 1HZ LYS 34 -6.873 5.465 -9.081 271 HZ3 LYS 34 2HZ LYS 34 -7.312 6.902 -8.288 272 H HIS 35 HN HIS 35 -6.337 -0.800 -9.310 273 HA HIS 35 HA HIS 35 -8.346 -2.947 -9.042 274 HB2 HIS 35 2HB HIS 35 -5.895 -2.933 -10.813 275 HB3 HIS 35 1HB HIS 35 -7.140 -4.171 -10.761 276 HD1 HIS 35 1HD HIS 35 -6.216 -2.344 -13.243 277 HD2 HIS 35 2HD HIS 35 -9.691 -1.981 -10.983 278 HE1 HIS 35 1HE HIS 35 -7.866 -1.140 -14.716 279 HE2 HIS 35 2HE HIS 35 -9.873 -0.736 -13.249 280 H GLY 36 HN GLY 36 -7.445 -5.131 -8.598 281 HA2 GLY 36 2HA GLY 36 -5.528 -6.463 -7.959 282 HA3 GLY 36 1HA GLY 36 -4.889 -5.054 -7.132 283 H GLN 37 HN GLN 37 -5.217 -7.678 -6.056 284 HA GLN 37 HA GLN 37 -7.079 -7.058 -3.853 285 HB2 GLN 37 2HB GLN 37 -7.608 -9.181 -5.011 286 HB3 GLN 37 1HB GLN 37 -5.975 -9.753 -4.693 287 HG2 GLN 37 2HG GLN 37 -6.463 -9.497 -2.251 288 HG3 GLN 37 1HG GLN 37 -8.140 -9.182 -2.689 289 HE21 GLN 37 1HE2 GLN 37 -7.043 -11.294 -1.083 290 HE22 GLN 37 2HE2 GLN 37 -7.497 -12.783 -1.841 291 H PHE 38 HN PHE 38 -4.071 -8.823 -4.506 292 HA PHE 38 HA PHE 38 -2.903 -7.670 -2.061 293 HB2 PHE 38 2HB PHE 38 -2.421 -10.223 -3.553 294 HB3 PHE 38 1HB PHE 38 -1.077 -9.495 -2.685 295 HD1 PHE 38 2HD PHE 38 -4.480 -10.885 -2.293 296 HD2 PHE 38 1HD PHE 38 -0.885 -9.686 -0.367 297 HE1 PHE 38 2HE PHE 38 -5.243 -11.953 -0.213 298 HE2 PHE 38 1HE PHE 38 -1.635 -10.756 1.716 299 HZ PHE 38 HZ PHE 38 -3.818 -11.887 1.797 300 H ILE 39 HN ILE 39 -2.107 -5.734 -2.742 301 HA ILE 39 HA ILE 39 -0.300 -5.798 -5.070 302 HB ILE 39 HB ILE 39 -2.325 -3.640 -4.438 303 HG12 ILE 39 2HG1 ILE 39 -3.270 -5.619 -5.552 304 HG13 ILE 39 1HG1 ILE 39 -3.293 -4.213 -6.611 305 HG21 ILE 39 1HG2 ILE 39 -0.247 -3.713 -6.623 306 HG22 ILE 39 2HG2 ILE 39 -0.229 -2.659 -5.210 307 HG23 ILE 39 3HG2 ILE 39 -1.496 -2.483 -6.423 308 HD11 ILE 39 3HD1 ILE 39 -1.295 -6.464 -6.711 309 HD12 ILE 39 1HD1 ILE 39 -1.328 -5.061 -7.777 310 HD13 ILE 39 2HD1 ILE 39 -2.652 -6.223 -7.811 311 H TYR 40 HN TYR 40 1.617 -4.957 -4.738 312 HA TYR 40 HA TYR 40 2.029 -3.126 -2.473 313 HB2 TYR 40 2HB TYR 40 3.360 -5.221 -2.391 314 HB3 TYR 40 1HB TYR 40 4.063 -4.822 -3.954 315 HD1 TYR 40 1HD TYR 40 5.679 -2.950 -4.145 316 HD2 TYR 40 2HD TYR 40 4.102 -4.145 -0.381 317 HE1 TYR 40 1HE TYR 40 7.474 -1.716 -3.004 318 HE2 TYR 40 2HE TYR 40 5.890 -2.913 0.766 319 HH TYR 40 HH TYR 40 8.022 -0.765 -0.916 320 H VAL 41 HN VAL 41 2.532 -1.076 -2.943 321 HA VAL 41 HA VAL 41 3.498 -0.488 -5.662 322 HB VAL 41 HB VAL 41 2.358 1.706 -5.532 323 HG11 VAL 41 1HG1 VAL 41 0.563 -0.692 -5.225 324 HG12 VAL 41 2HG1 VAL 41 1.278 -0.097 -6.723 325 HG13 VAL 41 3HG1 VAL 41 0.065 0.867 -5.879 326 HG21 VAL 41 3HG2 VAL 41 0.651 2.113 -3.857 327 HG22 VAL 41 1HG2 VAL 41 2.225 1.891 -3.094 328 HG23 VAL 41 2HG2 VAL 41 1.038 0.584 -3.068 329 H TRP 42 HN TRP 42 5.069 1.129 -5.843 330 HA TRP 42 HA TRP 42 6.123 2.167 -3.333 331 HB2 TRP 42 2HB TRP 42 8.463 1.623 -4.092 332 HB3 TRP 42 1HB TRP 42 7.485 0.241 -3.620 333 HD1 TRP 42 1HD TRP 42 6.297 -1.061 -5.899 334 HE1 TRP 42 1HE TRP 42 7.475 -1.658 -8.109 335 HE3 TRP 42 3HE TRP 42 10.251 2.179 -5.632 336 HZ2 TRP 42 2HZ TRP 42 9.773 -0.874 -9.541 337 HZ3 TRP 42 3HZ TRP 42 11.894 2.186 -7.463 338 HH2 TRP 42 2HH TRP 42 11.657 0.691 -9.375 339 H GLY 43 HN GLY 43 7.583 2.275 -6.564 340 HA2 GLY 43 2HA GLY 43 8.127 4.078 -7.878 341 HA3 GLY 43 1HA GLY 43 6.779 4.932 -7.138 342 H GLU 44 HN GLU 44 7.590 6.829 -6.543 343 HA GLU 44 HA GLU 44 9.091 7.108 -4.231 344 HB2 GLU 44 2HB GLU 44 10.968 6.366 -5.748 345 HB3 GLU 44 1HB GLU 44 10.711 7.833 -6.681 346 HG2 GLU 44 2HG GLU 44 11.159 9.148 -4.618 347 HG3 GLU 44 1HG GLU 44 11.573 7.636 -3.809 348 H GLU 45 HN GLU 45 9.624 9.069 -7.106 349 HA GLU 45 HA GLU 45 8.920 11.124 -7.760 350 HB2 GLU 45 2HB GLU 45 6.750 9.817 -7.761 351 HB3 GLU 45 1HB GLU 45 6.408 10.520 -6.190 352 HG2 GLU 45 2HG GLU 45 6.403 12.740 -7.153 353 HG3 GLU 45 1HG GLU 45 6.838 12.075 -8.726 354 H GLY 46 HN GLY 46 10.249 10.706 -5.101 355 HA2 GLY 46 2HA GLY 46 11.106 12.254 -3.584 356 HA3 GLY 46 1HA GLY 46 9.885 13.405 -4.109 357 H ALA 47 HN ALA 47 7.548 12.388 -3.627 358 HA ALA 47 HA ALA 47 7.268 10.823 -1.275 359 HB1 ALA 47 1HB ALA 47 8.057 12.899 -0.209 360 HB2 ALA 47 2HB ALA 47 6.396 12.518 0.243 361 HB3 ALA 47 3HB ALA 47 6.721 13.775 -0.953 362 H GLY 48 HN GLY 48 5.821 9.750 -2.669 363 HA2 GLY 48 2HA GLY 48 3.193 11.070 -2.851 364 HA3 GLY 48 1HA GLY 48 3.877 10.332 -4.294 365 H LYS 49 HN LYS 49 4.104 9.191 -1.004 366 HA LYS 49 HA LYS 49 3.726 6.500 -1.683 367 HB2 LYS 49 2HB LYS 49 3.633 6.138 0.768 368 HB3 LYS 49 1HB LYS 49 4.978 7.165 0.287 369 HG2 LYS 49 2HG LYS 49 3.879 9.118 1.051 370 HG3 LYS 49 1HG LYS 49 2.352 8.260 1.248 371 HD2 LYS 49 2HD LYS 49 3.819 6.793 2.888 372 HD3 LYS 49 1HD LYS 49 4.762 8.285 2.976 373 HE2 LYS 49 2HE LYS 49 2.799 9.528 3.645 374 HE3 LYS 49 1HE LYS 49 1.785 8.101 3.434 375 HZ1 LYS 49 3HZ LYS 49 3.853 8.579 5.498 376 HZ2 LYS 49 1HZ LYS 49 3.229 7.028 5.180 377 HZ3 LYS 49 2HZ LYS 49 2.201 8.263 5.712 378 H SER 50 HN SER 50 1.446 8.871 -0.306 379 HA SER 50 HA SER 50 -0.473 6.721 0.155 380 HB2 SER 50 2HB SER 50 -1.699 8.616 1.397 381 HB3 SER 50 1HB SER 50 -0.182 8.033 2.084 382 HG SER 50 HG SER 50 0.015 10.210 2.079 383 H HIS 51 HN HIS 51 0.140 8.219 -2.515 384 HA HIS 51 HA HIS 51 -2.212 9.624 -3.204 385 HB2 HIS 51 2HB HIS 51 -0.104 8.236 -4.847 386 HB3 HIS 51 1HB HIS 51 -1.506 8.988 -5.603 387 HD1 HIS 51 1HD HIS 51 1.592 9.902 -5.821 388 HD2 HIS 51 2HD HIS 51 -1.447 11.703 -3.621 389 HE1 HIS 51 1HE HIS 51 2.297 12.293 -5.515 390 HE2 HIS 51 2HE HIS 51 0.312 13.410 -4.440 391 H LEU 52 HN LEU 52 -1.241 6.317 -4.123 392 HA LEU 52 HA LEU 52 -3.918 5.621 -4.887 393 HB2 LEU 52 2HB LEU 52 -1.493 3.875 -4.444 394 HB3 LEU 52 1HB LEU 52 -3.002 3.345 -5.163 395 HG LEU 52 HG LEU 52 -1.132 5.414 -6.329 396 HD11 LEU 52 1HD1 LEU 52 -1.710 2.570 -7.149 397 HD12 LEU 52 2HD1 LEU 52 -0.212 3.170 -6.436 398 HD13 LEU 52 3HD1 LEU 52 -0.706 3.716 -8.038 399 HD21 LEU 52 3HD2 LEU 52 -3.660 4.204 -7.452 400 HD22 LEU 52 1HD2 LEU 52 -2.575 5.308 -8.296 401 HD23 LEU 52 2HD2 LEU 52 -3.472 5.863 -6.884 402 H LEU 53 HN LEU 53 -1.916 5.271 -2.070 403 HA LEU 53 HA LEU 53 -3.163 3.152 -0.762 404 HB2 LEU 53 2HB LEU 53 -0.962 4.342 -0.237 405 HB3 LEU 53 1HB LEU 53 -1.928 5.524 0.623 406 HG LEU 53 HG LEU 53 -2.823 3.546 1.986 407 HD11 LEU 53 1HD1 LEU 53 -0.385 2.268 0.758 408 HD12 LEU 53 2HD1 LEU 53 -2.060 1.763 0.533 409 HD13 LEU 53 3HD1 LEU 53 -1.301 1.623 2.119 410 HD21 LEU 53 3HD2 LEU 53 0.075 4.345 2.207 411 HD22 LEU 53 1HD2 LEU 53 -0.896 3.623 3.489 412 HD23 LEU 53 2HD2 LEU 53 -1.299 5.226 2.874 413 H GLN 54 HN GLN 54 -3.731 6.642 -0.394 414 HA GLN 54 HA GLN 54 -5.686 6.315 1.656 415 HB2 GLN 54 2HB GLN 54 -4.254 8.317 1.411 416 HB3 GLN 54 1HB GLN 54 -5.086 8.713 -0.082 417 HG2 GLN 54 2HG GLN 54 -7.160 9.031 1.128 418 HG3 GLN 54 1HG GLN 54 -6.371 8.566 2.635 419 HE21 GLN 54 1HE2 GLN 54 -3.898 9.948 1.942 420 HE22 GLN 54 2HE2 GLN 54 -4.209 11.633 2.143 421 H ALA 55 HN ALA 55 -5.838 7.038 -1.800 422 HA ALA 55 HA ALA 55 -8.599 7.535 -1.952 423 HB1 ALA 55 1HB ALA 55 -6.996 8.206 -3.684 424 HB2 ALA 55 2HB ALA 55 -8.341 7.282 -4.353 425 HB3 ALA 55 3HB ALA 55 -6.770 6.513 -4.121 426 H TRP 56 HN TRP 56 -6.728 4.566 -2.313 427 HA TRP 56 HA TRP 56 -8.740 2.919 -3.353 428 HB2 TRP 56 2HB TRP 56 -6.350 2.343 -3.326 429 HB3 TRP 56 1HB TRP 56 -6.403 2.188 -1.576 430 HD1 TRP 56 1HD TRP 56 -8.021 0.508 -4.679 431 HE1 TRP 56 1HE TRP 56 -8.323 -1.993 -4.143 432 HE3 TRP 56 3HE TRP 56 -6.431 0.518 0.181 433 HZ2 TRP 56 2HZ TRP 56 -7.942 -3.726 -1.953 434 HZ3 TRP 56 3HZ TRP 56 -6.433 -1.604 1.427 435 HH2 TRP 56 2HH TRP 56 -7.174 -3.681 0.381 436 H VAL 57 HN VAL 57 -7.836 3.624 -0.012 437 HA VAL 57 HA VAL 57 -9.593 1.734 1.166 438 HB VAL 57 HB VAL 57 -8.217 4.159 2.311 439 HG11 VAL 57 1HG1 VAL 57 -10.218 3.706 3.630 440 HG12 VAL 57 2HG1 VAL 57 -8.766 3.265 4.528 441 HG13 VAL 57 3HG1 VAL 57 -9.751 2.011 3.777 442 HG21 VAL 57 3HG2 VAL 57 -6.783 2.455 3.374 443 HG22 VAL 57 1HG2 VAL 57 -6.706 2.408 1.612 444 HG23 VAL 57 2HG2 VAL 57 -7.651 1.204 2.489 445 H ALA 58 HN ALA 58 -9.822 5.291 0.893 446 HA ALA 58 HA ALA 58 -12.320 5.484 2.186 447 HB1 ALA 58 1HB ALA 58 -11.162 7.403 0.164 448 HB2 ALA 58 2HB ALA 58 -10.767 7.379 1.882 449 HB3 ALA 58 3HB ALA 58 -12.410 7.753 1.362 450 H GLN 59 HN GLN 59 -11.449 4.947 -1.170 451 HA GLN 59 HA GLN 59 -14.011 5.290 -2.302 452 HB2 GLN 59 2HB GLN 59 -11.908 5.191 -3.607 453 HB3 GLN 59 1HB GLN 59 -11.748 3.490 -3.209 454 HG2 GLN 59 2HG GLN 59 -14.193 4.467 -4.612 455 HG3 GLN 59 1HG GLN 59 -12.702 4.211 -5.511 456 HE21 GLN 59 1HE2 GLN 59 -11.905 1.968 -3.777 457 HE22 GLN 59 2HE2 GLN 59 -12.894 0.636 -4.259 458 H ALA 60 HN ALA 60 -12.362 2.483 -0.919 459 HA ALA 60 HA ALA 60 -14.422 0.623 -1.554 460 HB1 ALA 60 1HB ALA 60 -12.119 -0.092 -1.169 461 HB2 ALA 60 2HB ALA 60 -13.221 -0.893 -0.049 462 HB3 ALA 60 3HB ALA 60 -12.223 0.449 0.508 463 H LEU 61 HN LEU 61 -13.702 2.662 1.209 464 HA LEU 61 HA LEU 61 -15.482 1.549 3.052 465 HB2 LEU 61 2HB LEU 61 -14.403 4.333 2.695 466 HB3 LEU 61 1HB LEU 61 -15.488 3.932 4.008 467 HG LEU 61 HG LEU 61 -12.805 2.641 3.530 468 HD11 LEU 61 1HD1 LEU 61 -12.565 4.970 4.195 469 HD12 LEU 61 2HD1 LEU 61 -12.089 3.895 5.511 470 HD13 LEU 61 3HD1 LEU 61 -13.653 4.707 5.558 471 HD21 LEU 61 3HD2 LEU 61 -14.410 1.164 4.630 472 HD22 LEU 61 1HD2 LEU 61 -14.739 2.409 5.834 473 HD23 LEU 61 2HD2 LEU 61 -13.140 1.668 5.744 474 H GLU 62 HN GLU 62 -16.000 4.235 0.761 475 HA GLU 62 HA GLU 62 -18.771 4.429 1.505 476 HB2 GLU 62 2HB GLU 62 -17.244 5.723 -0.748 477 HB3 GLU 62 1HB GLU 62 -18.912 6.091 -0.323 478 HG2 GLU 62 2HG GLU 62 -18.096 6.677 1.966 479 HG3 GLU 62 1HG GLU 62 -16.459 6.525 1.335 480 H ALA 63 HN ALA 63 -17.057 2.355 -0.431 481 HA ALA 63 HA ALA 63 -19.169 1.843 -2.340 482 HB1 ALA 63 1HB ALA 63 -17.754 0.026 -3.138 483 HB2 ALA 63 2HB ALA 63 -16.664 0.266 -1.773 484 HB3 ALA 63 3HB ALA 63 -16.835 1.526 -2.995 485 H GLY 64 HN GLY 64 -18.654 1.093 0.879 486 HA2 GLY 64 2HA GLY 64 -20.326 -0.039 2.141 487 HA3 GLY 64 1HA GLY 64 -20.741 -0.966 0.704 488 H LYS 65 HN LYS 65 -17.408 -0.623 1.381 489 HA LYS 65 HA LYS 65 -17.301 -3.394 2.376 490 HB2 LYS 65 2HB LYS 65 -14.950 -1.952 1.176 491 HB3 LYS 65 1HB LYS 65 -15.259 -3.679 1.263 492 HG2 LYS 65 2HG LYS 65 -16.713 -1.735 -0.520 493 HG3 LYS 65 1HG LYS 65 -15.407 -2.806 -1.023 494 HD2 LYS 65 2HD LYS 65 -16.768 -4.748 -0.477 495 HD3 LYS 65 1HD LYS 65 -18.064 -3.696 0.099 496 HE2 LYS 65 2HE LYS 65 -18.284 -2.742 -2.142 497 HE3 LYS 65 1HE LYS 65 -16.986 -3.787 -2.719 498 HZ1 LYS 65 3HZ LYS 65 -19.128 -4.714 -3.277 499 HZ2 LYS 65 1HZ LYS 65 -19.606 -4.684 -1.646 500 HZ3 LYS 65 2HZ LYS 65 -18.349 -5.709 -2.144 501 H ASN 66 HN ASN 66 -15.248 -3.716 3.776 502 HA ASN 66 HA ASN 66 -14.911 -1.352 5.492 503 HB2 ASN 66 2HB ASN 66 -15.601 -3.654 6.482 504 HB3 ASN 66 1HB ASN 66 -13.921 -4.093 6.229 505 HD21 ASN 66 1HD2 ASN 66 -13.730 -4.319 8.531 506 HD22 ASN 66 2HD2 ASN 66 -13.533 -2.913 9.526 507 H ALA 67 HN ALA 67 -12.979 -0.407 5.721 508 HA ALA 67 HA ALA 67 -10.591 -1.606 4.617 509 HB1 ALA 67 1HB ALA 67 -11.702 -0.725 2.618 510 HB2 ALA 67 2HB ALA 67 -10.205 0.142 2.964 511 HB3 ALA 67 3HB ALA 67 -11.760 0.874 3.357 512 H ALA 68 HN ALA 68 -8.701 -0.534 5.187 513 HA ALA 68 HA ALA 68 -8.805 2.003 6.561 514 HB1 ALA 68 1HB ALA 68 -7.971 -0.445 8.121 515 HB2 ALA 68 2HB ALA 68 -9.463 0.463 8.363 516 HB3 ALA 68 3HB ALA 68 -7.907 1.227 8.682 517 H TYR 69 HN TYR 69 -6.743 2.961 6.786 518 HA TYR 69 HA TYR 69 -4.516 1.408 5.689 519 HB2 TYR 69 2HB TYR 69 -3.642 3.492 4.677 520 HB3 TYR 69 1HB TYR 69 -5.165 2.978 3.973 521 HD1 TYR 69 2HD TYR 69 -7.208 4.290 4.353 522 HD2 TYR 69 1HD TYR 69 -3.465 5.544 5.934 523 HE1 TYR 69 2HE TYR 69 -8.129 6.536 4.739 524 HE2 TYR 69 1HE TYR 69 -4.378 7.793 6.330 525 HH TYR 69 HH TYR 69 -6.173 9.221 5.529 526 H ILE 70 HN ILE 70 -2.562 1.660 6.649 527 HA ILE 70 HA ILE 70 -2.461 3.407 9.022 528 HB ILE 70 HB ILE 70 -1.254 0.658 8.698 529 HG12 ILE 70 2HG1 ILE 70 -3.657 0.697 9.264 530 HG13 ILE 70 1HG1 ILE 70 -2.675 0.039 10.561 531 HG21 ILE 70 1HG2 ILE 70 -0.365 0.937 10.963 532 HG22 ILE 70 2HG2 ILE 70 -0.948 2.601 10.985 533 HG23 ILE 70 3HG2 ILE 70 0.314 2.123 9.848 534 HD11 ILE 70 3HD1 ILE 70 -3.802 2.823 10.457 535 HD12 ILE 70 1HD1 ILE 70 -2.821 2.150 11.760 536 HD13 ILE 70 2HD1 ILE 70 -4.418 1.482 11.425 537 H ASP 71 HN ASP 71 -1.114 4.998 8.637 538 HA ASP 71 HA ASP 71 1.112 4.697 6.779 539 HB2 ASP 71 2HB ASP 71 0.039 7.084 8.302 540 HB3 ASP 71 1HB ASP 71 1.491 7.146 7.313 541 H ALA 72 HN ALA 72 2.677 3.452 7.836 542 HA ALA 72 HA ALA 72 3.130 3.657 10.624 543 HB1 ALA 72 1HB ALA 72 3.625 1.630 9.365 544 HB2 ALA 72 2HB ALA 72 5.028 2.191 10.274 545 HB3 ALA 72 3HB ALA 72 4.935 2.465 8.533 546 H ALA 73 HN ALA 73 4.200 5.605 8.035 547 HA ALA 73 HA ALA 73 6.567 6.539 9.386 548 HB1 ALA 73 1HB ALA 73 5.137 7.707 7.008 549 HB2 ALA 73 2HB ALA 73 6.458 6.540 6.945 550 HB3 ALA 73 3HB ALA 73 6.742 8.161 7.579 551 H SER 74 HN SER 74 3.303 7.115 9.827 552 HA SER 74 HA SER 74 3.921 9.560 11.318 553 HB2 SER 74 2HB SER 74 1.484 9.106 9.589 554 HB3 SER 74 1HB SER 74 1.806 10.525 10.572 555 HG SER 74 HG SER 74 3.936 10.268 9.140 556 H MET 75 HN MET 75 2.233 6.563 11.099 557 HA MET 75 HA MET 75 0.975 7.006 13.721 558 HB2 MET 75 2HB MET 75 -0.345 5.903 11.233 559 HB3 MET 75 1HB MET 75 -1.029 5.745 12.841 560 HG2 MET 75 2HG MET 75 -1.024 8.236 12.999 561 HG3 MET 75 1HG MET 75 -0.531 8.281 11.310 562 HE1 MET 75 3HE MET 75 -3.611 6.696 9.501 563 HE2 MET 75 1HE MET 75 -2.121 5.902 10.012 564 HE3 MET 75 2HE MET 75 -2.063 7.509 9.284 565 HA PRO 76 HA PRO 76 2.452 2.862 14.423 566 HB2 PRO 76 2HB PRO 76 1.071 2.234 16.637 567 HB3 PRO 76 1HB PRO 76 2.343 3.461 16.659 568 HG2 PRO 76 2HG PRO 76 -0.620 3.803 16.593 569 HG3 PRO 76 1HG PRO 76 0.598 4.740 17.476 570 HD2 PRO 76 2HD PRO 76 -0.569 5.509 15.083 571 HD3 PRO 76 1HD PRO 76 0.977 6.117 15.699 572 H LEU 77 HN LEU 77 1.748 0.639 14.450 573 HA LEU 77 HA LEU 77 -0.730 0.251 12.967 574 HB2 LEU 77 2HB LEU 77 1.387 -0.811 12.205 575 HB3 LEU 77 1HB LEU 77 1.418 -1.747 13.686 576 HG LEU 77 HG LEU 77 -0.780 -2.756 12.996 577 HD11 LEU 77 1HD1 LEU 77 -1.463 -1.001 11.434 578 HD12 LEU 77 2HD1 LEU 77 -1.446 -2.592 10.672 579 HD13 LEU 77 3HD1 LEU 77 -0.138 -1.451 10.360 580 HD21 LEU 77 3HD2 LEU 77 1.338 -3.929 12.709 581 HD22 LEU 77 1HD2 LEU 77 1.557 -3.156 11.140 582 HD23 LEU 77 2HD2 LEU 77 0.228 -4.288 11.386 583 H THR 78 HN THR 78 -2.415 -1.066 13.687 584 HA THR 78 HA THR 78 -2.284 -1.951 16.469 585 HB THR 78 HB THR 78 -4.730 -1.085 16.617 586 HG1 THR 78 1HG THR 78 -3.777 0.869 14.805 587 HG21 THR 78 3HG2 THR 78 -2.404 0.847 16.660 588 HG22 THR 78 1HG2 THR 78 -2.889 -0.219 17.979 589 HG23 THR 78 2HG2 THR 78 -3.958 1.084 17.461 590 H ASP 79 HN ASP 79 -4.486 -3.135 16.975 591 HA ASP 79 HA ASP 79 -4.432 -5.406 15.216 592 HB2 ASP 79 2HB ASP 79 -5.783 -6.503 16.913 593 HB3 ASP 79 1HB ASP 79 -4.433 -5.672 17.671 594 H ALA 80 HN ALA 80 -6.343 -2.628 15.480 595 HA ALA 80 HA ALA 80 -8.875 -3.479 14.696 596 HB1 ALA 80 1HB ALA 80 -7.474 -0.930 13.898 597 HB2 ALA 80 2HB ALA 80 -8.374 -1.183 15.393 598 HB3 ALA 80 3HB ALA 80 -9.213 -1.224 13.842 599 H ALA 81 HN ALA 81 -5.939 -3.346 12.899 600 HA ALA 81 HA ALA 81 -6.847 -3.032 10.288 601 HB1 ALA 81 1HB ALA 81 -4.486 -4.655 11.229 602 HB2 ALA 81 2HB ALA 81 -4.489 -2.912 10.954 603 HB3 ALA 81 3HB ALA 81 -4.733 -4.019 9.602 604 H PHE 82 HN PHE 82 -6.999 -5.842 12.356 605 HA PHE 82 HA PHE 82 -7.295 -7.750 10.246 606 HB2 PHE 82 2HB PHE 82 -7.738 -7.838 13.214 607 HB3 PHE 82 1HB PHE 82 -8.235 -9.178 12.191 608 HD1 PHE 82 2HD PHE 82 -6.595 -10.549 11.050 609 HD2 PHE 82 1HD PHE 82 -5.413 -7.374 13.624 610 HE1 PHE 82 2HE PHE 82 -4.319 -11.475 11.135 611 HE2 PHE 82 1HE PHE 82 -3.131 -8.294 13.710 612 HZ PHE 82 HZ PHE 82 -2.583 -10.348 12.468 613 H GLU 83 HN GLU 83 -9.390 -5.435 11.551 614 HA GLU 83 HA GLU 83 -11.817 -6.954 11.202 615 HB2 GLU 83 2HB GLU 83 -11.402 -4.013 11.716 616 HB3 GLU 83 1HB GLU 83 -12.935 -4.864 11.806 617 HG2 GLU 83 2HG GLU 83 -12.050 -6.231 13.628 618 HG3 GLU 83 1HG GLU 83 -10.540 -5.329 13.555 619 H ALA 84 HN ALA 84 -9.870 -4.770 9.372 620 HA ALA 84 HA ALA 84 -11.989 -4.163 7.484 621 HB1 ALA 84 1HB ALA 84 -10.348 -2.689 6.433 622 HB2 ALA 84 2HB ALA 84 -9.101 -3.290 7.524 623 HB3 ALA 84 3HB ALA 84 -10.466 -2.374 8.164 624 H GLU 85 HN GLU 85 -12.298 -5.214 5.641 625 HA GLU 85 HA GLU 85 -10.685 -7.476 4.959 626 HB2 GLU 85 2HB GLU 85 -13.160 -7.228 4.506 627 HB3 GLU 85 1HB GLU 85 -12.738 -6.131 3.205 628 HG2 GLU 85 2HG GLU 85 -11.490 -7.892 2.091 629 HG3 GLU 85 1HG GLU 85 -11.862 -9.002 3.408 630 H TYR 86 HN TYR 86 -10.926 -4.176 3.903 631 HA TYR 86 HA TYR 86 -8.803 -4.630 1.923 632 HB2 TYR 86 2HB TYR 86 -10.714 -2.297 2.230 633 HB3 TYR 86 1HB TYR 86 -9.459 -2.417 1.006 634 HD1 TYR 86 1HD TYR 86 -12.423 -4.328 2.257 635 HD2 TYR 86 2HD TYR 86 -10.050 -3.209 -1.092 636 HE1 TYR 86 1HE TYR 86 -14.003 -5.471 0.765 637 HE2 TYR 86 2HE TYR 86 -11.627 -4.354 -2.593 638 HH TYR 86 HH TYR 86 -14.693 -5.474 -1.534 639 H LEU 87 HN LEU 87 -6.985 -4.572 3.192 640 HA LEU 87 HA LEU 87 -6.706 -2.286 5.028 641 HB2 LEU 87 2HB LEU 87 -6.592 -4.817 5.749 642 HB3 LEU 87 1HB LEU 87 -4.954 -4.713 5.142 643 HG LEU 87 HG LEU 87 -5.203 -4.391 7.620 644 HD11 LEU 87 1HD1 LEU 87 -4.035 -2.045 6.134 645 HD12 LEU 87 2HD1 LEU 87 -3.226 -3.587 6.411 646 HD13 LEU 87 3HD1 LEU 87 -3.640 -2.549 7.775 647 HD21 LEU 87 3HD2 LEU 87 -7.284 -3.127 7.576 648 HD22 LEU 87 1HD2 LEU 87 -6.461 -1.788 6.774 649 HD23 LEU 87 2HD2 LEU 87 -6.013 -2.239 8.419 650 H ALA 88 HN ALA 88 -5.197 -0.813 4.675 651 HA ALA 88 HA ALA 88 -3.162 -1.359 2.615 652 HB1 ALA 88 1HB ALA 88 -3.198 1.021 2.104 653 HB2 ALA 88 2HB ALA 88 -4.437 1.276 3.333 654 HB3 ALA 88 3HB ALA 88 -4.797 0.306 1.902 655 H VAL 89 HN VAL 89 -1.068 -1.066 3.147 656 HA VAL 89 HA VAL 89 -0.498 0.013 5.839 657 HB VAL 89 HB VAL 89 0.985 -2.234 4.465 658 HG11 VAL 89 1HG1 VAL 89 1.263 -1.094 7.243 659 HG12 VAL 89 2HG1 VAL 89 2.409 -0.893 5.919 660 HG13 VAL 89 3HG1 VAL 89 2.134 -2.492 6.612 661 HG21 VAL 89 3HG2 VAL 89 -0.932 -2.327 6.790 662 HG22 VAL 89 1HG2 VAL 89 0.024 -3.683 6.194 663 HG23 VAL 89 2HG2 VAL 89 -1.223 -2.967 5.172 664 H ASP 90 HN ASP 90 0.906 1.631 5.927 665 HA ASP 90 HA ASP 90 2.551 2.233 3.562 666 HB2 ASP 90 2HB ASP 90 1.133 4.070 4.101 667 HB3 ASP 90 1HB ASP 90 1.505 3.943 5.815 668 H GLN 91 HN GLN 91 4.708 2.244 3.682 669 HA GLN 91 HA GLN 91 6.810 1.825 4.445 670 HB2 GLN 91 2HB GLN 91 5.649 3.859 6.204 671 HB3 GLN 91 1HB GLN 91 7.044 3.034 6.880 672 HG2 GLN 91 2HG GLN 91 7.722 5.048 5.747 673 HG3 GLN 91 1HG GLN 91 8.355 3.636 4.904 674 HE21 GLN 91 1HE2 GLN 91 6.066 6.223 4.837 675 HE22 GLN 91 2HE2 GLN 91 5.650 6.104 3.172 676 H VAL 92 HN VAL 92 6.217 -0.493 4.751 677 HA VAL 92 HA VAL 92 5.725 -1.548 7.328 678 HB VAL 92 HB VAL 92 7.256 -2.937 5.121 679 HG11 VAL 92 1HG1 VAL 92 5.525 -4.012 7.344 680 HG12 VAL 92 2HG1 VAL 92 7.283 -4.108 7.244 681 HG13 VAL 92 3HG1 VAL 92 6.287 -4.975 6.075 682 HG21 VAL 92 3HG2 VAL 92 4.265 -2.763 5.478 683 HG22 VAL 92 1HG2 VAL 92 5.112 -3.763 4.294 684 HG23 VAL 92 2HG2 VAL 92 5.207 -2.005 4.193 685 H GLU 93 HN GLU 93 8.468 -0.143 5.907 686 HA GLU 93 HA GLU 93 10.510 -1.472 7.393 687 HB2 GLU 93 2HB GLU 93 10.835 -0.376 5.182 688 HB3 GLU 93 1HB GLU 93 10.577 1.183 5.942 689 HG2 GLU 93 2HG GLU 93 12.726 -0.557 7.021 690 HG3 GLU 93 1HG GLU 93 12.986 0.222 5.463 691 H LYS 94 HN LYS 94 8.353 1.167 8.052 692 HA LYS 94 HA LYS 94 10.096 2.388 10.008 693 HB2 LYS 94 2HB LYS 94 7.242 2.989 9.271 694 HB3 LYS 94 1HB LYS 94 8.214 3.934 10.383 695 HG2 LYS 94 2HG LYS 94 8.722 3.531 7.448 696 HG3 LYS 94 1HG LYS 94 8.151 5.004 8.231 697 HD2 LYS 94 2HD LYS 94 10.804 3.696 8.809 698 HD3 LYS 94 1HD LYS 94 10.581 5.005 7.652 699 HE2 LYS 94 2HE LYS 94 9.708 6.423 9.468 700 HE3 LYS 94 1HE LYS 94 10.014 5.115 10.611 701 HZ1 LYS 94 3HZ LYS 94 12.020 6.633 9.035 702 HZ2 LYS 94 1HZ LYS 94 12.389 5.230 9.913 703 HZ3 LYS 94 2HZ LYS 94 11.834 6.614 10.721 704 H LEU 95 HN LEU 95 8.328 -0.330 10.097 705 HA LEU 95 HA LEU 95 7.107 0.011 12.693 706 HB2 LEU 95 2HB LEU 95 7.454 -2.465 10.999 707 HB3 LEU 95 1HB LEU 95 6.447 -2.332 12.425 708 HG LEU 95 HG LEU 95 6.015 -0.855 9.828 709 HD11 LEU 95 1HD1 LEU 95 4.038 -2.275 9.612 710 HD12 LEU 95 2HD1 LEU 95 4.500 -3.141 11.078 711 HD13 LEU 95 3HD1 LEU 95 5.520 -3.230 9.643 712 HD21 LEU 95 3HD2 LEU 95 5.286 0.451 11.755 713 HD22 LEU 95 1HD2 LEU 95 4.349 -0.921 12.341 714 HD23 LEU 95 2HD2 LEU 95 3.906 -0.133 10.826 715 H GLY 96 HN GLY 96 7.751 -1.118 14.589 716 HA2 GLY 96 2HA GLY 96 10.641 -1.443 14.735 717 HA3 GLY 96 1HA GLY 96 9.524 -1.378 16.088 718 H ASN 97 HN ASN 97 8.524 -3.257 16.806 719 HA ASN 97 HA ASN 97 9.731 -5.728 15.741 720 HB2 ASN 97 2HB ASN 97 10.658 -5.177 17.932 721 HB3 ASN 97 1HB ASN 97 9.038 -5.044 18.608 722 HD21 ASN 97 1HD2 ASN 97 9.262 -6.633 20.119 723 HD22 ASN 97 2HD2 ASN 97 9.429 -8.309 19.719 724 H GLU 98 HN GLU 98 7.104 -4.872 17.974 725 HA GLU 98 HA GLU 98 5.652 -7.231 17.429 726 HB2 GLU 98 2HB GLU 98 5.548 -5.902 19.533 727 HB3 GLU 98 1HB GLU 98 4.649 -4.668 18.667 728 HG2 GLU 98 2HG GLU 98 2.763 -5.981 18.479 729 HG3 GLU 98 1HG GLU 98 3.661 -7.484 18.702 730 H GLU 99 HN GLU 99 5.452 -3.957 16.197 731 HA GLU 99 HA GLU 99 3.057 -4.129 14.790 732 HB2 GLU 99 2HB GLU 99 5.531 -2.652 13.879 733 HB3 GLU 99 1HB GLU 99 3.879 -2.341 13.369 734 HG2 GLU 99 2HG GLU 99 4.248 -0.669 14.903 735 HG3 GLU 99 1HG GLU 99 3.441 -1.894 15.878 736 H GLN 100 HN GLN 100 6.315 -5.143 13.804 737 HA GLN 100 HA GLN 100 5.506 -5.905 11.178 738 HB2 GLN 100 2HB GLN 100 7.973 -6.600 12.778 739 HB3 GLN 100 1HB GLN 100 7.726 -7.071 11.103 740 HG2 GLN 100 2HG GLN 100 7.510 -4.660 10.525 741 HG3 GLN 100 1HG GLN 100 7.959 -4.273 12.183 742 HE21 GLN 100 1HE2 GLN 100 9.295 -3.614 9.680 743 HE22 GLN 100 2HE2 GLN 100 10.893 -4.267 9.795 744 H ALA 101 HN ALA 101 5.695 -7.507 14.278 745 HA ALA 101 HA ALA 101 5.231 -10.145 13.331 746 HB1 ALA 101 1HB ALA 101 6.105 -9.718 15.572 747 HB2 ALA 101 2HB ALA 101 4.611 -10.650 15.645 748 HB3 ALA 101 3HB ALA 101 4.593 -8.927 16.018 749 H LEU 102 HN LEU 102 3.146 -7.516 14.410 750 HA LEU 102 HA LEU 102 0.663 -8.821 14.134 751 HB2 LEU 102 2HB LEU 102 1.246 -6.563 15.232 752 HB3 LEU 102 1HB LEU 102 1.165 -5.888 13.621 753 HG LEU 102 HG LEU 102 -0.876 -5.533 14.995 754 HD11 LEU 102 1HD1 LEU 102 -2.488 -6.135 13.266 755 HD12 LEU 102 2HD1 LEU 102 -1.277 -7.166 12.501 756 HD13 LEU 102 3HD1 LEU 102 -1.025 -5.423 12.583 757 HD21 LEU 102 3HD2 LEU 102 -1.226 -8.508 14.688 758 HD22 LEU 102 1HD2 LEU 102 -2.397 -7.384 15.376 759 HD23 LEU 102 2HD2 LEU 102 -0.859 -7.659 16.191 760 H LEU 103 HN LEU 103 2.510 -6.753 11.929 761 HA LEU 103 HA LEU 103 0.879 -6.839 9.685 762 HB2 LEU 103 2HB LEU 103 3.166 -5.633 10.240 763 HB3 LEU 103 1HB LEU 103 3.850 -7.003 9.395 764 HG LEU 103 HG LEU 103 3.584 -5.018 7.963 765 HD11 LEU 103 1HD1 LEU 103 2.472 -6.112 6.078 766 HD12 LEU 103 2HD1 LEU 103 1.857 -7.351 7.173 767 HD13 LEU 103 3HD1 LEU 103 3.593 -7.191 6.908 768 HD21 LEU 103 3HD2 LEU 103 1.586 -4.099 9.016 769 HD22 LEU 103 1HD2 LEU 103 0.634 -5.443 8.386 770 HD23 LEU 103 2HD2 LEU 103 1.369 -4.288 7.275 771 H PHE 104 HN PHE 104 3.507 -9.038 10.609 772 HA PHE 104 HA PHE 104 3.318 -10.844 8.499 773 HB2 PHE 104 2HB PHE 104 5.161 -10.939 10.064 774 HB3 PHE 104 1HB PHE 104 4.071 -11.317 11.390 775 HD1 PHE 104 1HD PHE 104 5.073 -12.633 8.052 776 HD2 PHE 104 2HD PHE 104 3.816 -13.513 12.022 777 HE1 PHE 104 1HE PHE 104 5.333 -15.035 7.600 778 HE2 PHE 104 2HE PHE 104 4.073 -15.918 11.576 779 HZ PHE 104 HZ PHE 104 4.832 -16.682 9.362 780 H SER 105 HN SER 105 1.632 -10.808 11.602 781 HA SER 105 HA SER 105 0.217 -13.194 11.340 782 HB2 SER 105 2HB SER 105 0.415 -11.753 13.405 783 HB3 SER 105 1HB SER 105 -0.815 -10.706 12.709 784 HG SER 105 HG SER 105 -1.754 -12.231 14.104 785 H ILE 106 HN ILE 106 -0.521 -9.954 10.180 786 HA ILE 106 HA ILE 106 -3.091 -10.411 9.179 787 HB ILE 106 HB ILE 106 -0.948 -8.601 8.048 788 HG12 ILE 106 2HG1 ILE 106 -3.211 -8.002 9.970 789 HG13 ILE 106 1HG1 ILE 106 -1.519 -8.171 10.425 790 HG21 ILE 106 1HG2 ILE 106 -2.820 -7.354 7.051 791 HG22 ILE 106 2HG2 ILE 106 -3.933 -8.600 7.618 792 HG23 ILE 106 3HG2 ILE 106 -2.702 -8.997 6.420 793 HD11 ILE 106 3HD1 ILE 106 -2.671 -6.060 8.610 794 HD12 ILE 106 1HD1 ILE 106 -0.969 -6.230 9.039 795 HD13 ILE 106 2HD1 ILE 106 -2.155 -5.839 10.283 796 H PHE 107 HN PHE 107 0.059 -10.718 7.538 797 HA PHE 107 HA PHE 107 -0.945 -11.728 5.115 798 HB2 PHE 107 2HB PHE 107 1.718 -11.711 6.446 799 HB3 PHE 107 1HB PHE 107 1.476 -12.841 5.120 800 HD1 PHE 107 2HD PHE 107 0.876 -11.991 2.874 801 HD2 PHE 107 1HD PHE 107 1.984 -9.391 6.056 802 HE1 PHE 107 2HE PHE 107 1.311 -10.195 1.248 803 HE2 PHE 107 1HE PHE 107 2.417 -7.591 4.436 804 HZ PHE 107 HZ PHE 107 2.083 -7.992 2.029 805 H ASN 108 HN ASN 108 0.143 -13.341 8.061 806 HA ASN 108 HA ASN 108 -0.043 -15.994 7.197 807 HB2 ASN 108 2HB ASN 108 0.987 -15.283 9.337 808 HB3 ASN 108 1HB ASN 108 -0.613 -14.895 9.961 809 HD21 ASN 108 1HD2 ASN 108 -0.725 -16.331 11.583 810 HD22 ASN 108 2HD2 ASN 108 -0.668 -18.050 11.375 811 H ARG 109 HN ARG 109 -2.474 -13.854 8.614 812 HA ARG 109 HA ARG 109 -4.528 -15.800 8.825 813 HB2 ARG 109 2HB ARG 109 -4.150 -13.150 9.601 814 HB3 ARG 109 1HB ARG 109 -5.480 -13.075 8.455 815 HG2 ARG 109 2HG ARG 109 -6.333 -13.307 10.694 816 HG3 ARG 109 1HG ARG 109 -6.683 -14.771 9.771 817 HD2 ARG 109 2HD ARG 109 -4.816 -15.908 10.813 818 HD3 ARG 109 1HD ARG 109 -4.363 -14.435 11.669 819 HE ARG 109 HE ARG 109 -6.787 -14.722 12.613 820 HH11 ARG 109 1HH1 ARG 109 -4.361 -17.191 12.070 821 HH12 ARG 109 2HH1 ARG 109 -4.971 -18.246 13.310 822 HH21 ARG 109 1HH2 ARG 109 -7.595 -16.116 14.250 823 HH22 ARG 109 2HH2 ARG 109 -6.797 -17.636 14.539 824 H PHE 110 HN PHE 110 -3.870 -13.268 6.407 825 HA PHE 110 HA PHE 110 -6.131 -13.855 4.809 826 HB2 PHE 110 2HB PHE 110 -3.567 -12.367 4.256 827 HB3 PHE 110 1HB PHE 110 -4.815 -12.567 3.030 828 HD1 PHE 110 2HD PHE 110 -5.391 -11.982 6.653 829 HD2 PHE 110 1HD PHE 110 -5.467 -10.334 2.729 830 HE1 PHE 110 2HE PHE 110 -6.579 -10.007 7.509 831 HE2 PHE 110 1HE PHE 110 -6.650 -8.356 3.587 832 HZ PHE 110 HZ PHE 110 -7.210 -8.190 5.977 833 H ARG 111 HN ARG 111 -2.815 -15.021 4.804 834 HA ARG 111 HA ARG 111 -3.018 -16.502 2.380 835 HB2 ARG 111 2HB ARG 111 -0.864 -15.831 3.355 836 HB3 ARG 111 1HB ARG 111 -1.158 -16.865 4.739 837 HG2 ARG 111 2HG ARG 111 0.412 -17.875 3.197 838 HG3 ARG 111 1HG ARG 111 -1.066 -18.831 3.313 839 HD2 ARG 111 2HD ARG 111 -0.846 -16.775 1.170 840 HD3 ARG 111 1HD ARG 111 0.037 -18.285 0.990 841 HE ARG 111 HE ARG 111 -2.655 -18.802 1.697 842 HH11 ARG 111 1HH1 ARG 111 -0.698 -17.747 -1.015 843 HH12 ARG 111 2HH1 ARG 111 -1.779 -18.398 -2.209 844 HH21 ARG 111 1HH2 ARG 111 -4.081 -19.656 0.123 845 HH22 ARG 111 2HH2 ARG 111 -3.688 -19.478 -1.565 846 H ASN 112 HN ASN 112 -3.957 -17.074 5.662 847 HA ASN 112 HA ASN 112 -4.279 -19.919 5.323 848 HB2 ASN 112 2HB ASN 112 -4.495 -18.000 7.529 849 HB3 ASN 112 1HB ASN 112 -5.683 -19.299 7.593 850 HD21 ASN 112 1HD2 ASN 112 -2.337 -18.459 7.819 851 HD22 ASN 112 2HD2 ASN 112 -1.772 -20.006 8.355 852 H SER 113 HN SER 113 -6.425 -17.101 5.509 853 HA SER 113 HA SER 113 -8.779 -18.725 5.218 854 HB2 SER 113 2HB SER 113 -8.744 -16.550 6.473 855 HB3 SER 113 1HB SER 113 -8.553 -15.719 4.931 856 HG SER 113 HG SER 113 -10.667 -17.548 5.313 857 H GLY 114 HN GLY 114 -6.903 -16.559 3.107 858 HA2 GLY 114 2HA GLY 114 -6.607 -17.190 0.791 859 HA3 GLY 114 1HA GLY 114 -8.237 -17.847 0.813 860 H LYS 115 HN LYS 115 -9.312 -15.534 2.258 861 HA LYS 115 HA LYS 115 -9.556 -13.752 -0.041 862 HB2 LYS 115 2HB LYS 115 -11.547 -14.816 1.163 863 HB3 LYS 115 1HB LYS 115 -11.198 -13.739 2.498 864 HG2 LYS 115 2HG LYS 115 -11.517 -11.826 0.919 865 HG3 LYS 115 1HG LYS 115 -12.055 -12.994 -0.289 866 HD2 LYS 115 2HD LYS 115 -13.837 -13.712 1.258 867 HD3 LYS 115 1HD LYS 115 -13.305 -12.488 2.411 868 HE2 LYS 115 2HE LYS 115 -13.663 -10.818 0.498 869 HE3 LYS 115 1HE LYS 115 -14.576 -12.111 -0.279 870 HZ1 LYS 115 3HZ LYS 115 -15.146 -10.796 2.316 871 HZ2 LYS 115 1HZ LYS 115 -15.926 -12.219 1.809 872 HZ3 LYS 115 2HZ LYS 115 -16.106 -10.785 0.922 873 H GLY 116 HN GLY 116 -9.875 -11.404 0.629 874 HA2 GLY 116 2HA GLY 116 -9.447 -9.752 2.415 875 HA3 GLY 116 1HA GLY 116 -7.999 -10.679 2.781 876 H PHE 117 HN PHE 117 -8.600 -7.836 1.834 877 HA PHE 117 HA PHE 117 -6.868 -7.832 -0.548 878 HB2 PHE 117 2HB PHE 117 -8.936 -5.856 0.423 879 HB3 PHE 117 1HB PHE 117 -7.773 -5.470 -0.839 880 HD1 PHE 117 2HD PHE 117 -10.294 -8.095 0.008 881 HD2 PHE 117 1HD PHE 117 -8.396 -5.784 -3.020 882 HE1 PHE 117 2HE PHE 117 -11.791 -9.076 -1.679 883 HE2 PHE 117 1HE PHE 117 -9.892 -6.761 -4.709 884 HZ PHE 117 HZ PHE 117 -11.592 -8.411 -4.039 885 H LEU 118 HN LEU 118 -4.940 -6.862 -0.454 886 HA LEU 118 HA LEU 118 -4.328 -5.197 1.882 887 HB2 LEU 118 2HB LEU 118 -3.407 -7.817 1.550 888 HB3 LEU 118 1HB LEU 118 -2.064 -6.801 1.062 889 HG LEU 118 HG LEU 118 -1.880 -7.410 3.411 890 HD11 LEU 118 1HD1 LEU 118 -0.991 -5.253 2.742 891 HD12 LEU 118 2HD1 LEU 118 -1.644 -5.177 4.379 892 HD13 LEU 118 3HD1 LEU 118 -2.560 -4.501 3.032 893 HD21 LEU 118 3HD2 LEU 118 -4.210 -7.750 3.941 894 HD22 LEU 118 1HD2 LEU 118 -4.542 -6.033 3.708 895 HD23 LEU 118 2HD2 LEU 118 -3.517 -6.559 5.043 896 H LEU 119 HN LEU 119 -3.587 -3.338 1.231 897 HA LEU 119 HA LEU 119 -2.046 -3.197 -1.275 898 HB2 LEU 119 2HB LEU 119 -4.155 -1.946 -1.400 899 HB3 LEU 119 1HB LEU 119 -3.719 -1.053 0.044 900 HG LEU 119 HG LEU 119 -1.758 -0.121 -1.197 901 HD11 LEU 119 1HD1 LEU 119 -1.720 -0.289 -3.622 902 HD12 LEU 119 2HD1 LEU 119 -3.106 -1.379 -3.582 903 HD13 LEU 119 3HD1 LEU 119 -1.567 -1.883 -2.883 904 HD21 LEU 119 3HD2 LEU 119 -3.805 1.166 -0.941 905 HD22 LEU 119 1HD2 LEU 119 -4.476 0.411 -2.386 906 HD23 LEU 119 2HD2 LEU 119 -3.071 1.469 -2.515 907 H LEU 120 HN LEU 120 0.039 -3.204 -0.706 908 HA LEU 120 HA LEU 120 0.817 -1.724 1.704 909 HB2 LEU 120 2HB LEU 120 2.422 -3.707 0.096 910 HB3 LEU 120 1HB LEU 120 2.919 -2.957 1.601 911 HG LEU 120 HG LEU 120 0.685 -4.097 2.482 912 HD11 LEU 120 1HD1 LEU 120 0.358 -6.289 1.456 913 HD12 LEU 120 2HD1 LEU 120 1.533 -5.879 0.207 914 HD13 LEU 120 3HD1 LEU 120 0.016 -4.985 0.317 915 HD21 LEU 120 3HD2 LEU 120 3.289 -5.548 2.055 916 HD22 LEU 120 1HD2 LEU 120 2.046 -5.987 3.229 917 HD23 LEU 120 2HD2 LEU 120 2.910 -4.457 3.387 918 H GLY 121 HN GLY 121 1.593 0.223 1.468 919 HA2 GLY 121 2HA GLY 121 2.912 0.899 -1.087 920 HA3 GLY 121 1HA GLY 121 1.933 2.035 -0.165 921 H SER 122 HN SER 122 4.914 1.685 -1.011 922 HA SER 122 HA SER 122 5.876 2.974 1.392 923 HB2 SER 122 2HB SER 122 6.284 0.498 1.728 924 HB3 SER 122 1HB SER 122 7.362 0.557 0.335 925 HG SER 122 HG SER 122 7.750 2.415 2.393 926 H GLU 123 HN GLU 123 7.803 4.164 1.037 927 HA GLU 123 HA GLU 123 8.040 5.107 -1.667 928 HB2 GLU 123 2HB GLU 123 9.694 5.856 0.753 929 HB3 GLU 123 1HB GLU 123 9.524 6.779 -0.736 930 HG2 GLU 123 2HG GLU 123 7.159 7.133 -0.253 931 HG3 GLU 123 1HG GLU 123 7.316 6.193 1.229 932 H TYR 124 HN TYR 124 9.140 2.389 -0.450 933 HA TYR 124 HA TYR 124 11.566 2.380 -2.092 934 HB2 TYR 124 2HB TYR 124 11.476 1.162 0.683 935 HB3 TYR 124 1HB TYR 124 12.858 1.223 -0.403 936 HD1 TYR 124 2HD TYR 124 13.779 3.550 -1.005 937 HD2 TYR 124 1HD TYR 124 11.134 2.857 2.255 938 HE1 TYR 124 2HE TYR 124 14.475 5.683 0.006 939 HE2 TYR 124 1HE TYR 124 11.822 4.985 3.272 940 HH TYR 124 HH TYR 124 13.929 6.488 3.160 941 H THR 125 HN THR 125 12.344 -0.038 -2.237 942 HA THR 125 HA THR 125 10.010 -1.607 -2.981 943 HB THR 125 HB THR 125 11.618 -3.176 -3.985 944 HG1 THR 125 1HG THR 125 13.695 -1.365 -3.278 945 HG21 THR 125 3HG2 THR 125 12.501 -1.703 -5.731 946 HG22 THR 125 1HG2 THR 125 12.186 -0.300 -4.711 947 HG23 THR 125 2HG2 THR 125 10.842 -1.271 -5.313 948 HA PRO 126 HA PRO 126 9.926 -4.179 0.570 949 HB2 PRO 126 2HB PRO 126 9.309 -6.619 -0.447 950 HB3 PRO 126 1HB PRO 126 8.158 -5.285 -0.376 951 HG2 PRO 126 2HG PRO 126 9.802 -6.235 -2.686 952 HG3 PRO 126 1HG PRO 126 8.093 -5.758 -2.651 953 HD2 PRO 126 2HD PRO 126 10.038 -4.103 -3.531 954 HD3 PRO 126 1HD PRO 126 8.590 -3.507 -2.699 955 H GLN 127 HN GLN 127 12.132 -4.847 -1.926 956 HA GLN 127 HA GLN 127 13.488 -6.984 -0.507 957 HB2 GLN 127 2HB GLN 127 14.045 -5.662 -3.167 958 HB3 GLN 127 1HB GLN 127 14.997 -6.983 -2.501 959 HG2 GLN 127 2HG GLN 127 13.082 -8.448 -2.556 960 HG3 GLN 127 1HG GLN 127 12.052 -7.127 -3.108 961 HE21 GLN 127 1HE2 GLN 127 12.192 -6.437 -5.233 962 HE22 GLN 127 2HE2 GLN 127 13.021 -7.338 -6.453 963 H GLN 128 HN GLN 128 13.527 -3.654 -0.383 964 HA GLN 128 HA GLN 128 16.315 -3.683 0.581 965 HB2 GLN 128 2HB GLN 128 16.602 -1.424 -0.111 966 HB3 GLN 128 1HB GLN 128 15.900 -2.283 -1.474 967 HG2 GLN 128 2HG GLN 128 13.682 -1.395 -0.830 968 HG3 GLN 128 1HG GLN 128 14.468 -0.452 0.435 969 HE21 GLN 128 1HE2 GLN 128 15.842 1.257 -0.159 970 HE22 GLN 128 2HE2 GLN 128 15.762 1.972 -1.732 971 H LEU 129 HN LEU 129 13.268 -3.747 1.640 972 HA LEU 129 HA LEU 129 13.387 -1.668 3.638 973 HB2 LEU 129 2HB LEU 129 11.431 -3.930 3.223 974 HB3 LEU 129 1HB LEU 129 11.257 -2.670 4.422 975 HG LEU 129 HG LEU 129 11.202 -2.309 1.430 976 HD11 LEU 129 1HD1 LEU 129 8.878 -1.660 1.801 977 HD12 LEU 129 2HD1 LEU 129 9.053 -2.010 3.522 978 HD13 LEU 129 3HD1 LEU 129 9.180 -3.312 2.338 979 HD21 LEU 129 3HD2 LEU 129 10.922 -0.257 3.623 980 HD22 LEU 129 1HD2 LEU 129 10.679 0.033 1.900 981 HD23 LEU 129 2HD2 LEU 129 12.277 -0.404 2.505 982 H VAL 130 HN VAL 130 13.733 -1.947 5.816 983 HA VAL 130 HA VAL 130 15.119 -4.362 6.603 984 HB VAL 130 HB VAL 130 14.430 -1.970 8.322 985 HG11 VAL 130 1HG1 VAL 130 16.278 -2.770 9.735 986 HG12 VAL 130 2HG1 VAL 130 16.466 -4.171 8.682 987 HG13 VAL 130 3HG1 VAL 130 14.980 -3.959 9.609 988 HG21 VAL 130 3HG2 VAL 130 15.761 -1.266 6.405 989 HG22 VAL 130 1HG2 VAL 130 16.948 -2.521 6.751 990 HG23 VAL 130 2HG2 VAL 130 16.715 -1.193 7.886 991 H ILE 131 HN ILE 131 13.488 -5.886 6.493 992 HA ILE 131 HA ILE 131 11.559 -5.785 8.699 993 HB ILE 131 HB ILE 131 9.896 -6.953 7.237 994 HG12 ILE 131 2HG1 ILE 131 11.793 -6.095 5.037 995 HG13 ILE 131 1HG1 ILE 131 11.415 -7.752 5.499 996 HG21 ILE 131 1HG2 ILE 131 9.663 -4.599 7.751 997 HG22 ILE 131 2HG2 ILE 131 9.139 -4.916 6.097 998 HG23 ILE 131 3HG2 ILE 131 10.712 -4.175 6.397 999 HD11 ILE 131 3HD1 ILE 131 9.102 -7.420 4.796 1000 HD12 ILE 131 1HD1 ILE 131 10.234 -7.109 3.480 1001 HD13 ILE 131 2HD1 ILE 131 9.482 -5.761 4.333 1002 H ARG 132 HN ARG 132 10.587 -8.024 9.041 1003 HA ARG 132 HA ARG 132 12.702 -9.770 9.701 1004 HB2 ARG 132 2HB ARG 132 9.759 -10.449 9.574 1005 HB3 ARG 132 1HB ARG 132 10.990 -11.247 10.546 1006 HG2 ARG 132 2HG ARG 132 10.028 -8.411 10.874 1007 HG3 ARG 132 1HG ARG 132 9.619 -9.780 11.910 1008 HD2 ARG 132 2HD ARG 132 11.814 -9.943 12.738 1009 HD3 ARG 132 1HD ARG 132 12.462 -8.932 11.446 1010 HE ARG 132 HE ARG 132 11.069 -7.102 12.546 1011 HH11 ARG 132 1HH1 ARG 132 12.471 -9.776 14.315 1012 HH12 ARG 132 2HH1 ARG 132 12.693 -8.860 15.781 1013 HH21 ARG 132 1HH2 ARG 132 11.372 -5.883 14.460 1014 HH22 ARG 132 2HH2 ARG 132 12.069 -6.646 15.855 1015 H GLU 133 HN GLU 133 13.157 -11.884 8.914 1016 HA GLU 133 HA GLU 133 13.439 -11.946 6.130 1017 HB2 GLU 133 2HB GLU 133 13.708 -14.157 8.167 1018 HB3 GLU 133 1HB GLU 133 14.162 -14.324 6.475 1019 HG2 GLU 133 2HG GLU 133 15.772 -12.514 6.726 1020 HG3 GLU 133 1HG GLU 133 15.324 -12.351 8.424 1021 H ASP 134 HN ASP 134 11.306 -13.969 8.168 1022 HA ASP 134 HA ASP 134 10.145 -15.298 5.946 1023 HB2 ASP 134 2HB ASP 134 10.175 -16.054 8.391 1024 HB3 ASP 134 1HB ASP 134 8.822 -14.954 8.633 1025 H LEU 135 HN LEU 135 9.181 -12.496 7.864 1026 HA LEU 135 HA LEU 135 6.744 -11.880 6.667 1027 HB2 LEU 135 2HB LEU 135 7.585 -10.697 8.615 1028 HB3 LEU 135 1HB LEU 135 8.926 -10.057 7.687 1029 HG LEU 135 HG LEU 135 7.222 -8.829 6.275 1030 HD11 LEU 135 1HD1 LEU 135 5.278 -10.185 6.884 1031 HD12 LEU 135 2HD1 LEU 135 5.020 -8.474 7.224 1032 HD13 LEU 135 3HD1 LEU 135 5.389 -9.589 8.541 1033 HD21 LEU 135 3HD2 LEU 135 8.564 -7.728 7.997 1034 HD22 LEU 135 1HD2 LEU 135 7.361 -8.154 9.213 1035 HD23 LEU 135 2HD2 LEU 135 6.942 -7.040 7.911 1036 H ARG 136 HN ARG 136 10.013 -10.865 5.754 1037 HA ARG 136 HA ARG 136 9.394 -9.415 3.443 1038 HB2 ARG 136 2HB ARG 136 11.562 -9.327 4.560 1039 HB3 ARG 136 1HB ARG 136 11.864 -11.009 4.155 1040 HG2 ARG 136 2HG ARG 136 11.968 -10.445 1.798 1041 HG3 ARG 136 1HG ARG 136 11.599 -8.757 2.173 1042 HD2 ARG 136 2HD ARG 136 13.637 -8.565 3.463 1043 HD3 ARG 136 1HD ARG 136 13.987 -10.274 3.217 1044 HE ARG 136 HE ARG 136 13.744 -8.825 0.761 1045 HH11 ARG 136 1HH1 ARG 136 15.899 -9.602 3.400 1046 HH12 ARG 136 2HH1 ARG 136 17.348 -9.419 2.450 1047 HH21 ARG 136 1HH2 ARG 136 15.659 -8.569 -0.500 1048 HH22 ARG 136 2HH2 ARG 136 17.203 -8.824 0.240 1049 H THR 137 HN THR 137 9.630 -12.821 4.017 1050 HA THR 137 HA THR 137 9.774 -13.605 1.272 1051 HB THR 137 HB THR 137 8.900 -15.278 3.612 1052 HG1 THR 137 1HG THR 137 11.038 -14.146 3.787 1053 HG21 THR 137 3HG2 THR 137 8.502 -16.287 1.429 1054 HG22 THR 137 1HG2 THR 137 9.795 -17.131 2.282 1055 HG23 THR 137 2HG2 THR 137 10.186 -16.004 0.984 1056 H ARG 138 HN ARG 138 7.208 -13.175 3.668 1057 HA ARG 138 HA ARG 138 5.115 -14.254 2.066 1058 HB2 ARG 138 2HB ARG 138 4.845 -12.231 4.294 1059 HB3 ARG 138 1HB ARG 138 3.621 -13.357 3.723 1060 HG2 ARG 138 2HG ARG 138 6.203 -14.132 5.053 1061 HG3 ARG 138 1HG ARG 138 4.636 -14.044 5.847 1062 HD2 ARG 138 2HD ARG 138 3.779 -15.840 4.565 1063 HD3 ARG 138 1HD ARG 138 5.140 -15.776 3.446 1064 HE ARG 138 HE ARG 138 6.104 -16.290 6.045 1065 HH11 ARG 138 1HH1 ARG 138 4.255 -17.878 3.519 1066 HH12 ARG 138 2HH1 ARG 138 4.801 -19.463 3.952 1067 HH21 ARG 138 1HH2 ARG 138 6.839 -18.357 6.585 1068 HH22 ARG 138 2HH2 ARG 138 6.293 -19.737 5.673 1069 H MET 139 HN MET 139 6.786 -11.282 2.075 1070 HA MET 139 HA MET 139 4.840 -9.567 0.983 1071 HB2 MET 139 2HB MET 139 7.848 -9.545 0.689 1072 HB3 MET 139 1HB MET 139 6.792 -8.227 0.208 1073 HG2 MET 139 2HG MET 139 7.011 -9.284 3.014 1074 HG3 MET 139 1HG MET 139 7.907 -7.901 2.394 1075 HE1 MET 139 3HE MET 139 5.767 -6.490 0.510 1076 HE2 MET 139 1HE MET 139 6.824 -5.650 1.645 1077 HE3 MET 139 2HE MET 139 5.090 -5.327 1.650 1078 H ALA 140 HN ALA 140 6.551 -12.200 -0.365 1079 HA ALA 140 HA ALA 140 6.344 -11.321 -3.106 1080 HB1 ALA 140 1HB ALA 140 7.243 -13.530 -3.661 1081 HB2 ALA 140 2HB ALA 140 7.084 -14.016 -1.972 1082 HB3 ALA 140 3HB ALA 140 8.207 -12.732 -2.420 1083 H TYR 141 HN TYR 141 4.051 -12.220 -0.999 1084 HA TYR 141 HA TYR 141 2.514 -13.851 -2.868 1085 HB2 TYR 141 2HB TYR 141 2.067 -13.019 -0.011 1086 HB3 TYR 141 1HB TYR 141 0.790 -13.752 -0.970 1087 HD1 TYR 141 2HD TYR 141 1.428 -16.023 -2.129 1088 HD2 TYR 141 1HD TYR 141 3.460 -14.386 1.231 1089 HE1 TYR 141 2HE TYR 141 2.282 -18.258 -1.563 1090 HE2 TYR 141 1HE TYR 141 4.315 -16.616 1.808 1091 HH TYR 141 HH TYR 141 4.238 -19.213 -0.317 1092 H CYS 142 HN CYS 142 3.160 -10.710 -2.695 1093 HA CYS 142 HA CYS 142 0.489 -9.998 -3.663 1094 HB2 CYS 142 2HB CYS 142 0.815 -7.715 -2.817 1095 HB3 CYS 142 1HB CYS 142 0.856 -8.893 -1.512 1096 HG CYS 142 HG CYS 142 3.898 -8.769 -2.032 1097 H LEU 143 HN LEU 143 0.399 -8.663 -5.428 1098 HA LEU 143 HA LEU 143 2.658 -8.866 -7.207 1099 HB2 LEU 143 2HB LEU 143 -0.079 -7.660 -7.571 1100 HB3 LEU 143 1HB LEU 143 1.129 -7.734 -8.836 1101 HG LEU 143 HG LEU 143 1.070 -10.269 -8.418 1102 HD11 LEU 143 1HD1 LEU 143 -1.075 -11.138 -7.631 1103 HD12 LEU 143 2HD1 LEU 143 -1.566 -9.502 -7.196 1104 HD13 LEU 143 3HD1 LEU 143 -0.213 -10.266 -6.364 1105 HD21 LEU 143 3HD2 LEU 143 -0.755 -10.544 -9.996 1106 HD22 LEU 143 1HD2 LEU 143 0.260 -9.172 -10.446 1107 HD23 LEU 143 2HD2 LEU 143 -1.299 -8.900 -9.665 1108 H VAL 144 HN VAL 144 3.561 -7.022 -8.341 1109 HA VAL 144 HA VAL 144 3.615 -4.668 -6.586 1110 HB VAL 144 HB VAL 144 5.834 -5.752 -8.329 1111 HG11 VAL 144 1HG1 VAL 144 5.804 -3.363 -6.488 1112 HG12 VAL 144 2HG1 VAL 144 5.917 -3.327 -8.249 1113 HG13 VAL 144 3HG1 VAL 144 7.230 -4.018 -7.294 1114 HG21 VAL 144 3HG2 VAL 144 5.490 -7.101 -6.337 1115 HG22 VAL 144 1HG2 VAL 144 5.551 -5.657 -5.327 1116 HG23 VAL 144 2HG2 VAL 144 6.988 -6.179 -6.205 1117 H TYR 145 HN TYR 145 2.716 -2.955 -7.425 1118 HA TYR 145 HA TYR 145 2.647 -2.638 -10.336 1119 HB2 TYR 145 2HB TYR 145 1.076 -1.410 -8.099 1120 HB3 TYR 145 1HB TYR 145 1.189 -0.576 -9.642 1121 HD1 TYR 145 2HD TYR 145 1.360 -3.563 -10.964 1122 HD2 TYR 145 1HD TYR 145 -1.410 -1.417 -8.553 1123 HE1 TYR 145 2HE TYR 145 -0.471 -4.939 -11.859 1124 HE2 TYR 145 1HE TYR 145 -3.250 -2.791 -9.435 1125 HH TYR 145 HH TYR 145 -2.755 -5.650 -11.175 1126 H GLU 146 HN GLU 146 4.100 -1.457 -11.292 1127 HA GLU 146 HA GLU 146 5.842 0.252 -9.697 1128 HB2 GLU 146 2HB GLU 146 6.855 -1.445 -11.148 1129 HB3 GLU 146 1HB GLU 146 6.061 -0.742 -12.547 1130 HG2 GLU 146 2HG GLU 146 7.347 1.363 -12.091 1131 HG3 GLU 146 1HG GLU 146 8.253 0.449 -10.882 1132 H VAL 147 HN VAL 147 5.263 2.318 -9.537 1133 HA VAL 147 HA VAL 147 3.741 3.605 -11.640 1134 HB VAL 147 HB VAL 147 4.793 4.805 -9.071 1135 HG11 VAL 147 1HG1 VAL 147 2.660 5.756 -10.980 1136 HG12 VAL 147 2HG1 VAL 147 4.258 6.469 -10.764 1137 HG13 VAL 147 3HG1 VAL 147 3.085 6.521 -9.448 1138 HG21 VAL 147 3HG2 VAL 147 3.298 2.949 -8.586 1139 HG22 VAL 147 1HG2 VAL 147 2.082 3.625 -9.669 1140 HG23 VAL 147 2HG2 VAL 147 2.526 4.485 -8.195 1141 H LYS 148 HN LYS 148 6.652 4.569 -9.831 1142 HA LYS 148 HA LYS 148 7.948 5.323 -12.345 1143 HB2 LYS 148 2HB LYS 148 7.661 7.100 -9.914 1144 HB3 LYS 148 1HB LYS 148 8.773 7.418 -11.237 1145 HG2 LYS 148 2HG LYS 148 6.919 7.652 -12.777 1146 HG3 LYS 148 1HG LYS 148 5.778 7.243 -11.492 1147 HD2 LYS 148 2HD LYS 148 6.392 9.224 -10.260 1148 HD3 LYS 148 1HD LYS 148 7.657 9.601 -11.433 1149 HE2 LYS 148 2HE LYS 148 5.974 9.910 -13.164 1150 HE3 LYS 148 1HE LYS 148 4.700 9.495 -12.017 1151 HZ1 LYS 148 3HZ LYS 148 5.242 11.427 -10.717 1152 HZ2 LYS 148 1HZ LYS 148 4.962 11.901 -12.323 1153 HZ3 LYS 148 2HZ LYS 148 6.549 11.803 -11.733 1154 HA PRO 149 HA PRO 149 11.182 3.343 -9.933 1155 HB2 PRO 149 2HB PRO 149 12.618 2.623 -12.193 1156 HB3 PRO 149 1HB PRO 149 11.361 1.647 -11.433 1157 HG2 PRO 149 2HG PRO 149 11.293 2.927 -13.990 1158 HG3 PRO 149 1HG PRO 149 10.026 1.961 -13.220 1159 HD2 PRO 149 2HD PRO 149 10.296 4.890 -13.417 1160 HD3 PRO 149 1HD PRO 149 8.848 3.905 -13.127 Start of MODEL 5 1 H1 MET 1 H1 MET 1 -28.980 4.768 -47.796 2 H2 MET 1 H2 MET 1 -29.372 4.046 -46.312 3 H3 MET 1 H3 MET 1 -29.681 3.222 -47.759 4 HA MET 1 HA MET 1 -27.763 2.287 -46.733 5 HB2 MET 1 2HB MET 1 -26.994 4.038 -49.082 6 HB3 MET 1 1HB MET 1 -26.086 2.648 -48.512 7 HG2 MET 1 2HG MET 1 -27.274 1.891 -50.375 8 HG3 MET 1 1HG MET 1 -28.156 1.271 -48.981 9 HE1 MET 1 2HE MET 1 -30.280 0.764 -50.524 10 HE2 MET 1 3HE MET 1 -29.368 1.356 -51.912 11 HE3 MET 1 1HE MET 1 -30.997 1.959 -51.605 12 H GLY 2 HN GLY 2 -26.868 2.835 -44.854 13 HA2 GLY 2 2HA GLY 2 -25.354 3.802 -43.421 14 HA3 GLY 2 1HA GLY 2 -24.640 4.591 -44.819 15 H HIS 3 HN HIS 3 -27.993 4.957 -43.806 16 HA HIS 3 HA HIS 3 -27.896 7.769 -43.828 17 HB2 HIS 3 2HB HIS 3 -30.000 6.463 -44.046 18 HB3 HIS 3 1HB HIS 3 -29.862 5.993 -42.357 19 HD1 HIS 3 1HD HIS 3 -31.037 7.450 -40.737 20 HD2 HIS 3 2HD HIS 3 -30.272 9.412 -44.328 21 HE1 HIS 3 1HE HIS 3 -32.154 9.693 -40.540 22 HE2 HIS 3 2HE HIS 3 -31.534 10.927 -42.646 23 H HIS 4 HN HIS 4 -27.069 9.140 -42.418 24 HA HIS 4 HA HIS 4 -26.640 8.217 -39.658 25 HB2 HIS 4 2HB HIS 4 -24.438 9.405 -39.691 26 HB3 HIS 4 1HB HIS 4 -24.510 7.991 -40.730 27 HD1 HIS 4 1HD HIS 4 -24.277 8.365 -43.266 28 HD2 HIS 4 2HD HIS 4 -24.156 11.873 -41.030 29 HE1 HIS 4 1HE HIS 4 -23.475 10.150 -44.845 30 HE2 HIS 4 2HE HIS 4 -23.541 12.283 -43.512 31 H HIS 5 HN HIS 5 -26.768 9.716 -38.062 32 HA HIS 5 HA HIS 5 -26.972 12.528 -38.623 33 HB2 HIS 5 2HB HIS 5 -29.185 12.864 -37.664 34 HB3 HIS 5 1HB HIS 5 -29.308 11.767 -39.032 35 HD1 HIS 5 1HD HIS 5 -30.834 12.191 -35.977 36 HD2 HIS 5 2HD HIS 5 -29.012 8.900 -37.755 37 HE1 HIS 5 1HE HIS 5 -31.784 10.172 -34.809 38 HE2 HIS 5 2HE HIS 5 -30.634 8.189 -35.870 39 H HIS 6 HN HIS 6 -26.539 13.755 -36.756 40 HA HIS 6 HA HIS 6 -26.157 12.336 -34.252 41 HB2 HIS 6 2HB HIS 6 -23.787 12.854 -34.049 42 HB3 HIS 6 1HB HIS 6 -24.060 11.885 -35.490 43 HD1 HIS 6 1HD HIS 6 -22.050 14.532 -34.470 44 HD2 HIS 6 2HD HIS 6 -24.439 13.922 -37.819 45 HE1 HIS 6 1HE HIS 6 -21.175 16.104 -36.229 46 HE2 HIS 6 2HE HIS 6 -22.769 15.866 -38.167 47 H HIS 7 HN HIS 7 -26.372 13.633 -32.518 48 HA HIS 7 HA HIS 7 -26.298 16.537 -32.990 49 HB2 HIS 7 2HB HIS 7 -28.616 15.675 -32.626 50 HB3 HIS 7 1HB HIS 7 -28.117 15.102 -31.038 51 HD1 HIS 7 1HD HIS 7 -29.366 18.057 -32.803 52 HD2 HIS 7 2HD HIS 7 -27.427 17.256 -29.209 53 HE1 HIS 7 1HE HIS 7 -29.632 20.132 -31.407 54 HE2 HIS 7 2HE HIS 7 -28.607 19.560 -29.176 55 H HIS 8 HN HIS 8 -24.177 16.729 -32.316 56 HA HIS 8 HA HIS 8 -23.974 16.859 -29.408 57 HB2 HIS 8 2HB HIS 8 -22.815 14.754 -30.133 58 HB3 HIS 8 1HB HIS 8 -21.730 15.743 -31.107 59 HD1 HIS 8 1HD HIS 8 -19.547 15.863 -29.947 60 HD2 HIS 8 2HD HIS 8 -22.735 16.060 -27.274 61 HE1 HIS 8 1HE HIS 8 -18.517 16.196 -27.672 62 HE2 HIS 8 2HE HIS 8 -20.466 16.420 -26.086 63 H SER 9 HN SER 9 -24.185 19.047 -29.501 64 HA SER 9 HA SER 9 -22.285 20.489 -31.219 65 HB2 SER 9 2HB SER 9 -24.648 20.882 -31.791 66 HB3 SER 9 1HB SER 9 -24.961 21.428 -30.144 67 HG SER 9 HG SER 9 -24.627 23.219 -31.445 68 H HIS 10 HN HIS 10 -24.161 21.618 -28.406 69 HA HIS 10 HA HIS 10 -21.679 22.093 -26.952 70 HB2 HIS 10 2HB HIS 10 -23.546 24.350 -27.717 71 HB3 HIS 10 1HB HIS 10 -22.183 24.488 -26.614 72 HD1 HIS 10 1HD HIS 10 -23.091 24.634 -30.157 73 HD2 HIS 10 2HD HIS 10 -19.616 24.187 -27.925 74 HE1 HIS 10 1HE HIS 10 -21.206 25.093 -31.750 75 HE2 HIS 10 2HE HIS 10 -19.105 24.710 -30.410 76 H MET 11 HN MET 11 -21.949 21.712 -24.887 77 HA MET 11 HA MET 11 -24.650 21.898 -23.721 78 HB2 MET 11 2HB MET 11 -22.208 20.364 -22.785 79 HB3 MET 11 1HB MET 11 -23.716 20.478 -21.885 80 HG2 MET 11 2HG MET 11 -24.895 19.352 -23.679 81 HG3 MET 11 1HG MET 11 -23.413 19.281 -24.628 82 HE1 MET 11 3HE MET 11 -24.025 15.542 -23.610 83 HE2 MET 11 1HE MET 11 -23.804 16.673 -24.945 84 HE3 MET 11 2HE MET 11 -25.264 16.747 -23.958 85 H ASP 12 HN ASP 12 -24.891 23.872 -22.887 86 HA ASP 12 HA ASP 12 -22.539 25.283 -21.906 87 HB2 ASP 12 2HB ASP 12 -23.843 27.298 -22.029 88 HB3 ASP 12 1HB ASP 12 -24.089 26.399 -23.521 89 H TYR 13 HN TYR 13 -22.260 25.979 -19.881 90 HA TYR 13 HA TYR 13 -24.421 25.713 -17.956 91 HB2 TYR 13 2HB TYR 13 -22.764 24.763 -16.272 92 HB3 TYR 13 1HB TYR 13 -23.323 23.660 -17.519 93 HD1 TYR 13 2HD TYR 13 -21.784 23.173 -19.473 94 HD2 TYR 13 1HD TYR 13 -20.466 25.199 -15.976 95 HE1 TYR 13 2HE TYR 13 -19.454 22.635 -20.047 96 HE2 TYR 13 1HE TYR 13 -18.135 24.668 -16.539 97 HH TYR 13 HH TYR 13 -16.898 22.969 -17.871 98 HA PRO 14 HA PRO 14 -22.633 29.841 -17.703 99 HB2 PRO 14 2HB PRO 14 -24.737 30.862 -16.281 100 HB3 PRO 14 1HB PRO 14 -24.715 30.725 -18.041 101 HG2 PRO 14 2HG PRO 14 -25.978 28.923 -16.015 102 HG3 PRO 14 1HG PRO 14 -26.617 29.479 -17.573 103 HD2 PRO 14 2HD PRO 14 -25.561 27.022 -17.262 104 HD3 PRO 14 1HD PRO 14 -25.379 27.936 -18.773 105 H SER 15 HN SER 15 -21.588 30.935 -16.077 106 HA SER 15 HA SER 15 -20.994 29.486 -13.705 107 HB2 SER 15 2HB SER 15 -20.403 32.380 -14.380 108 HB3 SER 15 1HB SER 15 -19.635 31.439 -13.101 109 HG SER 15 HG SER 15 -19.564 30.410 -15.697 110 H PHE 16 HN PHE 16 -22.546 29.199 -12.244 111 HA PHE 16 HA PHE 16 -24.533 31.186 -11.688 112 HB2 PHE 16 2HB PHE 16 -23.855 28.620 -10.228 113 HB3 PHE 16 1HB PHE 16 -25.273 29.617 -9.921 114 HD1 PHE 16 2HD PHE 16 -26.919 29.952 -11.836 115 HD2 PHE 16 1HD PHE 16 -23.902 26.955 -11.855 116 HE1 PHE 16 2HE PHE 16 -28.163 28.715 -13.560 117 HE2 PHE 16 1HE PHE 16 -25.139 25.714 -13.581 118 HZ PHE 16 HZ PHE 16 -27.273 26.592 -14.436 119 H ASP 17 HN ASP 17 -24.902 31.769 -9.302 120 HA ASP 17 HA ASP 17 -22.766 33.406 -8.503 121 HB2 ASP 17 2HB ASP 17 -25.096 33.945 -7.998 122 HB3 ASP 17 1HB ASP 17 -25.206 32.542 -6.939 123 H LYS 18 HN LYS 18 -21.036 33.031 -7.326 124 HA LYS 18 HA LYS 18 -20.553 30.336 -6.395 125 HB2 LYS 18 2HB LYS 18 -18.246 31.236 -5.956 126 HB3 LYS 18 1HB LYS 18 -18.782 31.366 -7.626 127 HG2 LYS 18 2HG LYS 18 -19.311 33.718 -7.292 128 HG3 LYS 18 1HG LYS 18 -18.830 33.597 -5.600 129 HD2 LYS 18 2HD LYS 18 -16.970 32.990 -7.889 130 HD3 LYS 18 1HD LYS 18 -17.115 34.591 -7.163 131 HE2 LYS 18 2HE LYS 18 -16.365 32.072 -5.682 132 HE3 LYS 18 1HE LYS 18 -15.226 33.287 -6.257 133 HZ1 LYS 18 3HZ LYS 18 -15.734 33.598 -3.923 134 HZ2 LYS 18 1HZ LYS 18 -17.389 33.743 -4.268 135 HZ3 LYS 18 2HZ LYS 18 -16.303 34.916 -4.826 136 H PHE 19 HN PHE 19 -19.701 29.850 -4.266 137 HA PHE 19 HA PHE 19 -20.342 31.835 -2.238 138 HB2 PHE 19 2HB PHE 19 -20.899 28.860 -2.123 139 HB3 PHE 19 1HB PHE 19 -20.933 29.913 -0.722 140 HD1 PHE 19 2HD PHE 19 -22.721 31.511 -0.406 141 HD2 PHE 19 1HD PHE 19 -22.647 28.932 -3.788 142 HE1 PHE 19 2HE PHE 19 -25.083 32.037 -0.853 143 HE2 PHE 19 1HE PHE 19 -25.008 29.452 -4.243 144 HZ PHE 19 HZ PHE 19 -26.228 31.008 -2.773 145 H LEU 20 HN LEU 20 -17.133 29.294 -2.182 146 HA LEU 20 HA LEU 20 -19.890 28.364 -2.496 147 HB2 LEU 20 2HB LEU 20 -17.259 27.391 -3.566 148 HB3 LEU 20 1HB LEU 20 -18.609 26.286 -3.415 149 HG LEU 20 HG LEU 20 -18.628 28.821 -5.059 150 HD11 LEU 20 1HD1 LEU 20 -18.368 25.930 -5.870 151 HD12 LEU 20 2HD1 LEU 20 -17.134 27.182 -6.020 152 HD13 LEU 20 3HD1 LEU 20 -18.611 27.280 -6.978 153 HD21 LEU 20 3HD2 LEU 20 -20.725 27.932 -5.960 154 HD22 LEU 20 1HD2 LEU 20 -20.840 28.226 -4.226 155 HD23 LEU 20 2HD2 LEU 20 -20.638 26.580 -4.829 156 H GLY 21 HN GLY 21 -20.101 25.966 -1.744 157 HA2 GLY 21 2HA GLY 21 -19.756 26.023 1.058 158 HA3 GLY 21 1HA GLY 21 -20.309 24.646 0.121 159 H THR 22 HN THR 22 -18.237 23.914 -1.375 160 HA THR 22 HA THR 22 -15.811 23.804 0.171 161 HB THR 22 HB THR 22 -17.252 22.129 1.326 162 HG1 THR 22 1HG THR 22 -15.686 20.458 1.261 163 HG21 THR 22 3HG2 THR 22 -18.615 21.409 -0.556 164 HG22 THR 22 1HG2 THR 22 -17.800 20.025 0.175 165 HG23 THR 22 2HG2 THR 22 -17.198 20.708 -1.336 166 H GLU 23 HN GLU 23 -14.483 21.776 -0.953 167 HA GLU 23 HA GLU 23 -14.926 21.924 -3.852 168 HB2 GLU 23 2HB GLU 23 -12.247 22.258 -2.479 169 HB3 GLU 23 1HB GLU 23 -12.486 22.109 -4.215 170 HG2 GLU 23 2HG GLU 23 -13.905 24.172 -4.095 171 HG3 GLU 23 1HG GLU 23 -13.372 24.352 -2.427 172 H ASN 24 HN ASN 24 -14.946 20.006 -4.769 173 HA ASN 24 HA ASN 24 -14.313 17.661 -3.190 174 HB2 ASN 24 2HB ASN 24 -15.321 16.400 -5.038 175 HB3 ASN 24 1HB ASN 24 -16.383 17.705 -4.526 176 HD21 ASN 24 1HD2 ASN 24 -16.790 19.403 -5.899 177 HD22 ASN 24 2HD2 ASN 24 -16.312 19.398 -7.570 178 H ALA 25 HN ALA 25 -12.574 19.692 -5.068 179 HA ALA 25 HA ALA 25 -11.104 18.195 -6.849 180 HB1 ALA 25 1HB ALA 25 -10.977 20.641 -6.624 181 HB2 ALA 25 2HB ALA 25 -9.385 19.883 -6.672 182 HB3 ALA 25 3HB ALA 25 -10.052 20.439 -5.137 183 H GLU 26 HN GLU 26 -10.621 18.492 -3.354 184 HA GLU 26 HA GLU 26 -8.155 17.172 -3.179 185 HB2 GLU 26 2HB GLU 26 -10.426 17.306 -1.190 186 HB3 GLU 26 1HB GLU 26 -8.845 16.634 -0.822 187 HG2 GLU 26 2HG GLU 26 -7.842 18.837 -1.373 188 HG3 GLU 26 1HG GLU 26 -9.473 19.484 -1.559 189 H LEU 27 HN LEU 27 -11.443 15.945 -3.218 190 HA LEU 27 HA LEU 27 -10.754 13.258 -2.634 191 HB2 LEU 27 2HB LEU 27 -12.958 14.150 -2.138 192 HB3 LEU 27 1HB LEU 27 -13.230 14.495 -3.834 193 HG LEU 27 HG LEU 27 -13.124 12.072 -4.298 194 HD11 LEU 27 1HD1 LEU 27 -11.802 11.374 -2.380 195 HD12 LEU 27 2HD1 LEU 27 -13.330 10.495 -2.439 196 HD13 LEU 27 3HD1 LEU 27 -13.119 11.822 -1.295 197 HD21 LEU 27 3HD2 LEU 27 -15.349 11.571 -3.415 198 HD22 LEU 27 1HD2 LEU 27 -15.260 13.220 -4.029 199 HD23 LEU 27 2HD2 LEU 27 -15.207 12.924 -2.292 200 H VAL 28 HN VAL 28 -11.084 15.172 -5.543 201 HA VAL 28 HA VAL 28 -11.043 13.059 -7.423 202 HB VAL 28 HB VAL 28 -9.999 15.875 -7.745 203 HG11 VAL 28 1HG1 VAL 28 -10.814 13.853 -9.828 204 HG12 VAL 28 2HG1 VAL 28 -9.172 14.405 -9.495 205 HG13 VAL 28 3HG1 VAL 28 -10.367 15.530 -10.142 206 HG21 VAL 28 3HG2 VAL 28 -12.185 16.366 -8.735 207 HG22 VAL 28 1HG2 VAL 28 -12.321 15.873 -7.047 208 HG23 VAL 28 2HG2 VAL 28 -12.726 14.736 -8.335 209 H TYR 29 HN TYR 29 -8.505 14.868 -5.772 210 HA TYR 29 HA TYR 29 -6.314 13.693 -7.129 211 HB2 TYR 29 2HB TYR 29 -5.892 15.707 -5.923 212 HB3 TYR 29 1HB TYR 29 -6.586 15.052 -4.446 213 HD1 TYR 29 1HD TYR 29 -3.741 14.472 -6.807 214 HD2 TYR 29 2HD TYR 29 -5.178 14.224 -2.810 215 HE1 TYR 29 1HE TYR 29 -1.504 13.777 -6.050 216 HE2 TYR 29 2HE TYR 29 -2.950 13.531 -2.044 217 HH TYR 29 HH TYR 29 -0.169 13.774 -3.987 218 H VAL 30 HN VAL 30 -8.178 12.809 -4.294 219 HA VAL 30 HA VAL 30 -6.541 10.648 -3.470 220 HB VAL 30 HB VAL 30 -9.470 11.179 -2.927 221 HG11 VAL 30 1HG1 VAL 30 -7.548 9.314 -1.553 222 HG12 VAL 30 2HG1 VAL 30 -8.958 8.858 -2.507 223 HG13 VAL 30 3HG1 VAL 30 -9.167 9.712 -0.979 224 HG21 VAL 30 3HG2 VAL 30 -7.022 11.811 -1.295 225 HG22 VAL 30 1HG2 VAL 30 -8.695 12.082 -0.803 226 HG23 VAL 30 2HG2 VAL 30 -8.020 12.973 -2.169 227 H LEU 31 HN LEU 31 -9.562 10.799 -5.355 228 HA LEU 31 HA LEU 31 -9.700 7.964 -5.697 229 HB2 LEU 31 2HB LEU 31 -11.171 10.206 -7.070 230 HB3 LEU 31 1HB LEU 31 -11.545 8.507 -7.274 231 HG LEU 31 HG LEU 31 -11.763 10.045 -4.682 232 HD11 LEU 31 1HD1 LEU 31 -14.171 9.800 -4.996 233 HD12 LEU 31 2HD1 LEU 31 -13.895 9.022 -6.554 234 HD13 LEU 31 3HD1 LEU 31 -13.448 10.711 -6.321 235 HD21 LEU 31 3HD2 LEU 31 -11.208 7.688 -4.349 236 HD22 LEU 31 1HD2 LEU 31 -12.565 7.224 -5.375 237 HD23 LEU 31 2HD2 LEU 31 -12.860 8.037 -3.838 238 H ARG 32 HN ARG 32 -8.140 7.006 -6.857 239 HA ARG 32 HA ARG 32 -7.557 8.064 -9.534 240 HB2 ARG 32 2HB ARG 32 -5.645 7.519 -7.974 241 HB3 ARG 32 1HB ARG 32 -6.117 5.830 -8.083 242 HG2 ARG 32 2HG ARG 32 -4.331 6.130 -9.593 243 HG3 ARG 32 1HG ARG 32 -5.790 6.021 -10.576 244 HD2 ARG 32 2HD ARG 32 -5.846 8.437 -10.815 245 HD3 ARG 32 1HD ARG 32 -4.442 8.596 -9.758 246 HE ARG 32 HE ARG 32 -4.083 6.969 -12.149 247 HH11 ARG 32 1HH1 ARG 32 -3.705 10.141 -10.688 248 HH12 ARG 32 2HH1 ARG 32 -2.445 10.628 -11.784 249 HH21 ARG 32 1HH2 ARG 32 -2.443 7.620 -13.601 250 HH22 ARG 32 2HH2 ARG 32 -1.752 9.209 -13.455 251 H HIS 33 HN HIS 33 -7.345 4.696 -8.499 252 HA HIS 33 HA HIS 33 -9.869 3.874 -9.513 253 HB2 HIS 33 2HB HIS 33 -7.479 3.570 -11.287 254 HB3 HIS 33 1HB HIS 33 -8.642 2.251 -11.222 255 HD1 HIS 33 1HD HIS 33 -7.914 4.648 -13.470 256 HD2 HIS 33 2HD HIS 33 -11.425 3.896 -11.373 257 HE1 HIS 33 1HE HIS 33 -9.753 5.715 -14.820 258 HE2 HIS 33 2HE HIS 33 -11.824 5.450 -13.407 259 H LYS 34 HN LYS 34 -10.217 1.589 -9.227 260 HA LYS 34 HA LYS 34 -8.737 0.531 -6.993 261 HB2 LYS 34 2HB LYS 34 -10.334 -1.361 -7.138 262 HB3 LYS 34 1HB LYS 34 -11.127 0.205 -7.051 263 HG2 LYS 34 2HG LYS 34 -11.541 0.153 -9.444 264 HG3 LYS 34 1HG LYS 34 -10.701 -1.394 -9.567 265 HD2 LYS 34 2HD LYS 34 -12.358 -2.480 -8.243 266 HD3 LYS 34 1HD LYS 34 -13.116 -0.940 -7.833 267 HE2 LYS 34 2HE LYS 34 -13.742 -0.608 -10.160 268 HE3 LYS 34 1HE LYS 34 -12.940 -2.114 -10.604 269 HZ1 LYS 34 3HZ LYS 34 -15.156 -2.015 -8.643 270 HZ2 LYS 34 1HZ LYS 34 -14.528 -3.371 -9.448 271 HZ3 LYS 34 2HZ LYS 34 -15.423 -2.207 -10.304 272 H HIS 35 HN HIS 35 -8.266 -1.944 -7.094 273 HA HIS 35 HA HIS 35 -7.058 -2.799 -9.592 274 HB2 HIS 35 2HB HIS 35 -5.443 -2.242 -7.096 275 HB3 HIS 35 1HB HIS 35 -4.861 -3.266 -8.403 276 HD1 HIS 35 1HD HIS 35 -5.167 0.251 -7.369 277 HD2 HIS 35 2HD HIS 35 -4.420 -1.839 -10.882 278 HE1 HIS 35 1HE HIS 35 -4.213 1.939 -8.967 279 HE2 HIS 35 2HE HIS 35 -3.897 0.686 -11.134 280 H GLY 36 HN GLY 36 -5.525 -4.906 -8.528 281 HA2 GLY 36 2HA GLY 36 -7.534 -6.834 -7.968 282 HA3 GLY 36 1HA GLY 36 -5.802 -7.111 -7.961 283 H GLN 37 HN GLN 37 -6.281 -8.533 -6.146 284 HA GLN 37 HA GLN 37 -7.345 -7.335 -3.738 285 HB2 GLN 37 2HB GLN 37 -8.024 -9.607 -4.318 286 HB3 GLN 37 1HB GLN 37 -6.347 -10.140 -4.254 287 HG2 GLN 37 2HG GLN 37 -6.259 -9.641 -1.879 288 HG3 GLN 37 1HG GLN 37 -7.917 -9.044 -1.930 289 HE21 GLN 37 1HE2 GLN 37 -6.761 -11.200 -0.361 290 HE22 GLN 37 2HE2 GLN 37 -7.668 -12.620 -0.752 291 H PHE 38 HN PHE 38 -4.341 -9.125 -4.505 292 HA PHE 38 HA PHE 38 -3.076 -7.782 -2.219 293 HB2 PHE 38 2HB PHE 38 -2.224 -10.194 -3.831 294 HB3 PHE 38 1HB PHE 38 -1.235 -9.453 -2.579 295 HD1 PHE 38 1HD PHE 38 -2.467 -9.170 -0.253 296 HD2 PHE 38 2HD PHE 38 -3.545 -11.985 -3.257 297 HE1 PHE 38 1HE PHE 38 -3.566 -10.569 1.452 298 HE2 PHE 38 2HE PHE 38 -4.645 -13.381 -1.559 299 HZ PHE 38 HZ PHE 38 -4.658 -12.678 0.798 300 H ILE 39 HN ILE 39 -2.600 -5.796 -3.030 301 HA ILE 39 HA ILE 39 -0.835 -5.742 -5.389 302 HB ILE 39 HB ILE 39 -2.894 -3.668 -4.604 303 HG12 ILE 39 2HG1 ILE 39 -3.878 -5.682 -5.615 304 HG13 ILE 39 1HG1 ILE 39 -4.025 -4.288 -6.683 305 HG21 ILE 39 1HG2 ILE 39 -0.910 -2.633 -5.559 306 HG22 ILE 39 2HG2 ILE 39 -2.267 -2.534 -6.683 307 HG23 ILE 39 3HG2 ILE 39 -0.991 -3.725 -6.941 308 HD11 ILE 39 3HD1 ILE 39 -2.131 -5.107 -7.996 309 HD12 ILE 39 1HD1 ILE 39 -3.434 -6.293 -7.921 310 HD13 ILE 39 2HD1 ILE 39 -1.993 -6.502 -6.926 311 H TYR 40 HN TYR 40 1.115 -5.011 -4.965 312 HA TYR 40 HA TYR 40 1.491 -3.121 -2.754 313 HB2 TYR 40 2HB TYR 40 2.991 -4.914 -2.437 314 HB3 TYR 40 1HB TYR 40 3.351 -5.028 -4.157 315 HD1 TYR 40 1HD TYR 40 3.739 -2.715 -1.256 316 HD2 TYR 40 2HD TYR 40 5.270 -4.048 -4.993 317 HE1 TYR 40 1HE TYR 40 5.712 -1.277 -0.956 318 HE2 TYR 40 2HE TYR 40 7.242 -2.616 -4.704 319 HH TYR 40 HH TYR 40 7.758 -0.771 -1.737 320 H VAL 41 HN VAL 41 1.865 -1.070 -3.223 321 HA VAL 41 HA VAL 41 2.749 -0.411 -5.953 322 HB VAL 41 HB VAL 41 1.513 1.736 -5.723 323 HG11 VAL 41 1HG1 VAL 41 0.531 -0.119 -6.954 324 HG12 VAL 41 2HG1 VAL 41 -0.715 0.806 -6.113 325 HG13 VAL 41 3HG1 VAL 41 -0.181 -0.745 -5.466 326 HG21 VAL 41 3HG2 VAL 41 1.402 1.800 -3.261 327 HG22 VAL 41 1HG2 VAL 41 0.267 0.451 -3.291 328 HG23 VAL 41 2HG2 VAL 41 -0.183 2.000 -4.009 329 H TRP 42 HN TRP 42 4.447 0.953 -6.150 330 HA TRP 42 HA TRP 42 5.344 2.326 -3.711 331 HB2 TRP 42 2HB TRP 42 7.672 2.038 -4.398 332 HB3 TRP 42 1HB TRP 42 6.887 0.478 -4.215 333 HD1 TRP 42 1HD TRP 42 6.476 -0.959 -6.452 334 HE1 TRP 42 1HE TRP 42 7.622 -0.876 -8.760 335 HE3 TRP 42 3HE TRP 42 8.700 3.636 -6.095 336 HZ2 TRP 42 2HZ TRP 42 9.247 0.906 -10.228 337 HZ3 TRP 42 3HZ TRP 42 10.031 4.454 -7.995 338 HH2 TRP 42 2HH TRP 42 10.297 3.115 -10.016 339 H GLY 43 HN GLY 43 6.052 4.406 -3.934 340 HA2 GLY 43 2HA GLY 43 5.632 5.582 -6.611 341 HA3 GLY 43 1HA GLY 43 5.267 6.419 -5.106 342 H GLU 44 HN GLU 44 7.077 7.114 -7.354 343 HA GLU 44 HA GLU 44 9.759 6.807 -6.791 344 HB2 GLU 44 2HB GLU 44 8.308 9.172 -7.983 345 HB3 GLU 44 1HB GLU 44 10.059 9.020 -7.954 346 HG2 GLU 44 2HG GLU 44 9.922 6.993 -9.292 347 HG3 GLU 44 1HG GLU 44 8.163 7.103 -9.295 348 H GLU 45 HN GLU 45 10.624 7.019 -4.873 349 HA GLU 45 HA GLU 45 10.935 7.598 -2.712 350 HB2 GLU 45 2HB GLU 45 11.756 9.941 -2.368 351 HB3 GLU 45 1HB GLU 45 12.587 9.021 -3.604 352 HG2 GLU 45 2HG GLU 45 10.382 10.855 -4.399 353 HG3 GLU 45 1HG GLU 45 11.956 11.522 -3.968 354 H GLY 46 HN GLY 46 8.187 7.526 -3.413 355 HA2 GLY 46 2HA GLY 46 6.416 7.807 -1.815 356 HA3 GLY 46 1HA GLY 46 7.152 9.325 -1.324 357 H ALA 47 HN ALA 47 4.786 7.880 -3.239 358 HA ALA 47 HA ALA 47 4.614 9.968 -5.221 359 HB1 ALA 47 1HB ALA 47 2.630 7.785 -4.607 360 HB2 ALA 47 2HB ALA 47 3.981 7.638 -5.731 361 HB3 ALA 47 3HB ALA 47 2.685 8.789 -6.056 362 H GLY 48 HN GLY 48 4.546 11.624 -3.442 363 HA2 GLY 48 2HA GLY 48 3.327 13.313 -2.449 364 HA3 GLY 48 1HA GLY 48 1.869 12.577 -3.103 365 H LYS 49 HN LYS 49 0.940 10.788 -1.974 366 HA LYS 49 HA LYS 49 1.852 9.981 0.591 367 HB2 LYS 49 2HB LYS 49 -0.175 10.800 1.842 368 HB3 LYS 49 1HB LYS 49 0.994 12.039 1.418 369 HG2 LYS 49 2HG LYS 49 -0.393 12.921 -0.261 370 HG3 LYS 49 1HG LYS 49 -1.440 11.500 -0.252 371 HD2 LYS 49 2HD LYS 49 -2.379 13.531 0.904 372 HD3 LYS 49 1HD LYS 49 -2.331 12.061 1.878 373 HE2 LYS 49 2HE LYS 49 -0.149 12.887 2.824 374 HE3 LYS 49 1HE LYS 49 -0.457 14.420 2.009 375 HZ1 LYS 49 3HZ LYS 49 -2.309 13.185 3.969 376 HZ2 LYS 49 1HZ LYS 49 -2.418 14.740 3.304 377 HZ3 LYS 49 2HZ LYS 49 -1.160 14.356 4.374 378 H SER 50 HN SER 50 -0.369 8.959 1.713 379 HA SER 50 HA SER 50 -0.840 6.688 0.067 380 HB2 SER 50 2HB SER 50 -2.452 6.278 2.157 381 HB3 SER 50 1HB SER 50 -0.701 6.108 2.277 382 HG SER 50 HG SER 50 -1.222 7.436 3.934 383 H HIS 51 HN HIS 51 -1.912 9.032 -1.147 384 HA HIS 51 HA HIS 51 -4.660 9.396 -0.692 385 HB2 HIS 51 2HB HIS 51 -4.693 10.675 -2.742 386 HB3 HIS 51 1HB HIS 51 -3.222 11.041 -1.856 387 HD1 HIS 51 1HD HIS 51 -1.027 9.585 -2.825 388 HD2 HIS 51 2HD HIS 51 -4.272 10.189 -5.358 389 HE1 HIS 51 1HE HIS 51 -0.142 9.255 -5.149 390 HE2 HIS 51 2HE HIS 51 -2.048 9.903 -6.659 391 H LEU 52 HN LEU 52 -2.935 7.106 -2.709 392 HA LEU 52 HA LEU 52 -5.180 6.355 -4.280 393 HB2 LEU 52 2HB LEU 52 -3.032 5.998 -5.204 394 HB3 LEU 52 1HB LEU 52 -2.472 5.154 -3.771 395 HG LEU 52 HG LEU 52 -4.073 3.336 -4.289 396 HD11 LEU 52 1HD1 LEU 52 -5.632 4.609 -5.669 397 HD12 LEU 52 2HD1 LEU 52 -5.028 3.195 -6.531 398 HD13 LEU 52 3HD1 LEU 52 -4.389 4.796 -6.907 399 HD21 LEU 52 3HD2 LEU 52 -1.725 3.142 -4.876 400 HD22 LEU 52 1HD2 LEU 52 -2.029 3.951 -6.414 401 HD23 LEU 52 2HD2 LEU 52 -2.736 2.367 -6.096 402 H LEU 53 HN LEU 53 -3.600 5.063 -1.388 403 HA LEU 53 HA LEU 53 -5.236 2.749 -1.214 404 HB2 LEU 53 2HB LEU 53 -3.443 4.140 0.763 405 HB3 LEU 53 1HB LEU 53 -4.378 2.723 1.197 406 HG LEU 53 HG LEU 53 -3.207 1.488 -0.661 407 HD11 LEU 53 1HD1 LEU 53 -1.432 3.920 -0.645 408 HD12 LEU 53 2HD1 LEU 53 -2.460 3.388 -1.976 409 HD13 LEU 53 3HD1 LEU 53 -1.091 2.398 -1.468 410 HD21 LEU 53 3HD2 LEU 53 -1.512 2.604 1.558 411 HD22 LEU 53 1HD2 LEU 53 -1.162 1.149 0.625 412 HD23 LEU 53 2HD2 LEU 53 -2.586 1.210 1.665 413 H GLN 54 HN GLN 54 -5.423 5.990 0.139 414 HA GLN 54 HA GLN 54 -7.506 5.524 1.973 415 HB2 GLN 54 2HB GLN 54 -6.063 7.569 1.889 416 HB3 GLN 54 1HB GLN 54 -6.958 8.086 0.469 417 HG2 GLN 54 2HG GLN 54 -9.000 8.217 1.755 418 HG3 GLN 54 1HG GLN 54 -8.171 7.592 3.180 419 HE21 GLN 54 1HE2 GLN 54 -9.602 10.093 2.832 420 HE22 GLN 54 2HE2 GLN 54 -8.462 11.354 3.178 421 H ALA 55 HN ALA 55 -7.529 6.438 -1.437 422 HA ALA 55 HA ALA 55 -10.311 6.781 -1.726 423 HB1 ALA 55 1HB ALA 55 -8.691 7.517 -3.413 424 HB2 ALA 55 2HB ALA 55 -9.928 6.470 -4.109 425 HB3 ALA 55 3HB ALA 55 -8.318 5.831 -3.783 426 H TRP 56 HN TRP 56 -8.226 3.968 -2.085 427 HA TRP 56 HA TRP 56 -10.200 2.178 -2.995 428 HB2 TRP 56 2HB TRP 56 -7.804 1.758 -3.247 429 HB3 TRP 56 1HB TRP 56 -7.623 1.643 -1.501 430 HD1 TRP 56 1HD TRP 56 -9.292 -0.261 -4.427 431 HE1 TRP 56 1HE TRP 56 -9.445 -2.744 -3.757 432 HE3 TRP 56 3HE TRP 56 -7.579 0.092 0.368 433 HZ2 TRP 56 2HZ TRP 56 -8.893 -4.338 -1.498 434 HZ3 TRP 56 3HZ TRP 56 -7.412 -1.958 1.718 435 HH2 TRP 56 2HH TRP 56 -8.058 -4.127 0.800 436 H VAL 57 HN VAL 57 -9.006 2.956 0.245 437 HA VAL 57 HA VAL 57 -10.585 1.102 1.665 438 HB VAL 57 HB VAL 57 -9.450 3.766 2.538 439 HG11 VAL 57 1HG1 VAL 57 -10.634 1.583 4.251 440 HG12 VAL 57 2HG1 VAL 57 -11.353 3.165 3.952 441 HG13 VAL 57 3HG1 VAL 57 -9.831 3.040 4.836 442 HG21 VAL 57 3HG2 VAL 57 -7.755 2.143 1.933 443 HG22 VAL 57 1HG2 VAL 57 -8.507 0.936 2.977 444 HG23 VAL 57 2HG2 VAL 57 -7.773 2.375 3.681 445 H ALA 58 HN ALA 58 -11.148 4.526 0.848 446 HA ALA 58 HA ALA 58 -13.642 4.782 2.098 447 HB1 ALA 58 1HB ALA 58 -13.982 6.725 0.644 448 HB2 ALA 58 2HB ALA 58 -12.620 6.217 -0.355 449 HB3 ALA 58 3HB ALA 58 -12.353 6.699 1.320 450 H GLN 59 HN GLN 59 -12.795 3.792 -1.191 451 HA GLN 59 HA GLN 59 -15.357 3.526 -2.240 452 HB2 GLN 59 2HB GLN 59 -13.314 3.453 -3.586 453 HB3 GLN 59 1HB GLN 59 -12.860 1.930 -2.841 454 HG2 GLN 59 2HG GLN 59 -15.453 2.116 -4.297 455 HG3 GLN 59 1HG GLN 59 -13.951 2.008 -5.211 456 HE21 GLN 59 1HE2 GLN 59 -12.668 0.369 -3.134 457 HE22 GLN 59 2HE2 GLN 59 -13.344 -1.211 -3.307 458 H ALA 60 HN ALA 60 -13.456 1.301 -0.289 459 HA ALA 60 HA ALA 60 -15.331 -0.856 -0.462 460 HB1 ALA 60 1HB ALA 60 -12.942 -1.217 -0.019 461 HB2 ALA 60 2HB ALA 60 -13.963 -1.916 1.236 462 HB3 ALA 60 3HB ALA 60 -13.115 -0.398 1.534 463 H LEU 61 HN LEU 61 -14.663 1.712 1.861 464 HA LEU 61 HA LEU 61 -16.428 0.878 3.886 465 HB2 LEU 61 2HB LEU 61 -15.374 3.598 3.138 466 HB3 LEU 61 1HB LEU 61 -16.386 3.330 4.542 467 HG LEU 61 HG LEU 61 -13.678 2.074 4.075 468 HD11 LEU 61 1HD1 LEU 61 -12.915 3.545 5.857 469 HD12 LEU 61 2HD1 LEU 61 -14.524 4.257 5.980 470 HD13 LEU 61 3HD1 LEU 61 -13.567 4.487 4.517 471 HD21 LEU 61 3HD2 LEU 61 -13.888 1.314 6.391 472 HD22 LEU 61 1HD2 LEU 61 -15.158 0.638 5.372 473 HD23 LEU 61 2HD2 LEU 61 -15.521 1.978 6.461 474 H GLU 62 HN GLU 62 -16.901 3.139 1.179 475 HA GLU 62 HA GLU 62 -19.587 3.752 1.892 476 HB2 GLU 62 2HB GLU 62 -18.162 4.085 -0.748 477 HB3 GLU 62 1HB GLU 62 -19.716 4.800 -0.334 478 HG2 GLU 62 2HG GLU 62 -18.617 6.025 1.505 479 HG3 GLU 62 1HG GLU 62 -17.071 5.364 0.977 480 H ALA 63 HN ALA 63 -18.167 1.063 0.402 481 HA ALA 63 HA ALA 63 -20.475 0.258 -1.124 482 HB1 ALA 63 1HB ALA 63 -18.041 -1.325 -0.292 483 HB2 ALA 63 2HB ALA 63 -18.245 -0.451 -1.810 484 HB3 ALA 63 3HB ALA 63 -19.262 -1.847 -1.452 485 H GLY 64 HN GLY 64 -19.710 0.311 2.134 486 HA2 GLY 64 2HA GLY 64 -21.255 -0.301 3.813 487 HA3 GLY 64 1HA GLY 64 -21.956 -1.477 2.708 488 H LYS 65 HN LYS 65 -18.547 -1.461 2.845 489 HA LYS 65 HA LYS 65 -18.598 -3.806 4.616 490 HB2 LYS 65 2HB LYS 65 -16.740 -3.263 2.289 491 HB3 LYS 65 1HB LYS 65 -16.686 -4.673 3.335 492 HG2 LYS 65 2HG LYS 65 -18.930 -3.927 1.468 493 HG3 LYS 65 1HG LYS 65 -17.749 -5.217 1.231 494 HD2 LYS 65 2HD LYS 65 -18.594 -6.411 3.147 495 HD3 LYS 65 1HD LYS 65 -19.684 -5.077 3.542 496 HE2 LYS 65 2HE LYS 65 -20.851 -5.432 1.405 497 HE3 LYS 65 1HE LYS 65 -19.782 -6.792 1.063 498 HZ1 LYS 65 3HZ LYS 65 -21.728 -6.585 3.301 499 HZ2 LYS 65 1HZ LYS 65 -20.630 -7.866 3.094 500 HZ3 LYS 65 2HZ LYS 65 -21.842 -7.597 1.941 501 H ASN 66 HN ASN 66 -16.185 -4.191 5.411 502 HA ASN 66 HA ASN 66 -15.474 -1.632 6.660 503 HB2 ASN 66 2HB ASN 66 -16.128 -3.743 8.031 504 HB3 ASN 66 1HB ASN 66 -14.499 -4.284 7.662 505 HD21 ASN 66 1HD2 ASN 66 -14.015 -4.202 9.898 506 HD22 ASN 66 2HD2 ASN 66 -13.676 -2.690 10.669 507 H ALA 67 HN ALA 67 -13.553 -0.764 6.463 508 HA ALA 67 HA ALA 67 -11.294 -2.310 5.485 509 HB1 ALA 67 1HB ALA 67 -12.228 0.196 4.079 510 HB2 ALA 67 2HB ALA 67 -12.361 -1.443 3.441 511 HB3 ALA 67 3HB ALA 67 -10.771 -0.726 3.706 512 H ALA 68 HN ALA 68 -9.271 -1.244 5.909 513 HA ALA 68 HA ALA 68 -9.539 0.953 7.849 514 HB1 ALA 68 1HB ALA 68 -7.698 -1.423 8.103 515 HB2 ALA 68 2HB ALA 68 -9.166 -1.146 9.041 516 HB3 ALA 68 3HB ALA 68 -7.791 -0.056 9.214 517 H TYR 69 HN TYR 69 -8.381 2.648 7.436 518 HA TYR 69 HA TYR 69 -6.181 2.490 5.508 519 HB2 TYR 69 2HB TYR 69 -7.715 4.155 4.841 520 HB3 TYR 69 1HB TYR 69 -7.961 4.715 6.489 521 HD1 TYR 69 2HD TYR 69 -5.542 4.699 3.675 522 HD2 TYR 69 1HD TYR 69 -6.663 6.447 7.387 523 HE1 TYR 69 2HE TYR 69 -3.885 6.487 3.333 524 HE2 TYR 69 1HE TYR 69 -5.014 8.229 7.057 525 HH TYR 69 HH TYR 69 -2.725 8.361 5.664 526 H ILE 70 HN ILE 70 -4.211 2.251 6.375 527 HA ILE 70 HA ILE 70 -3.624 3.662 8.895 528 HB ILE 70 HB ILE 70 -2.730 0.855 8.212 529 HG12 ILE 70 2HG1 ILE 70 -4.653 1.811 10.346 530 HG13 ILE 70 1HG1 ILE 70 -5.121 1.018 8.848 531 HG21 ILE 70 1HG2 ILE 70 -1.797 0.821 10.485 532 HG22 ILE 70 2HG2 ILE 70 -2.231 2.519 10.680 533 HG23 ILE 70 3HG2 ILE 70 -1.034 2.047 9.473 534 HD11 ILE 70 3HD1 ILE 70 -5.157 -0.530 10.712 535 HD12 ILE 70 1HD1 ILE 70 -3.455 -0.202 11.032 536 HD13 ILE 70 2HD1 ILE 70 -3.932 -0.993 9.530 537 H ASP 71 HN ASP 71 -1.674 4.644 9.024 538 HA ASP 71 HA ASP 71 0.114 4.438 6.685 539 HB2 ASP 71 2HB ASP 71 -0.153 6.661 8.731 540 HB3 ASP 71 1HB ASP 71 1.035 6.633 7.436 541 H ALA 72 HN ALA 72 1.758 3.072 7.117 542 HA ALA 72 HA ALA 72 2.355 2.133 9.697 543 HB1 ALA 72 1HB ALA 72 2.801 0.893 7.614 544 HB2 ALA 72 2HB ALA 72 4.192 0.953 8.695 545 HB3 ALA 72 3HB ALA 72 4.137 1.995 7.273 546 H ALA 73 HN ALA 73 3.498 4.935 8.043 547 HA ALA 73 HA ALA 73 5.729 5.231 9.931 548 HB1 ALA 73 1HB ALA 73 6.321 5.420 7.580 549 HB2 ALA 73 2HB ALA 73 6.559 6.961 8.402 550 HB3 ALA 73 3HB ALA 73 5.142 6.719 7.374 551 H SER 74 HN SER 74 2.739 5.799 10.265 552 HA SER 74 HA SER 74 3.148 8.365 11.612 553 HB2 SER 74 2HB SER 74 2.037 8.933 9.515 554 HB3 SER 74 1HB SER 74 0.803 7.716 9.810 555 HG SER 74 HG SER 74 1.116 9.591 11.824 556 H MET 75 HN MET 75 1.285 5.440 11.185 557 HA MET 75 HA MET 75 0.504 5.549 14.020 558 HB2 MET 75 2HB MET 75 -1.190 4.704 11.651 559 HB3 MET 75 1HB MET 75 -1.639 4.420 13.323 560 HG2 MET 75 2HG MET 75 -1.606 6.869 13.698 561 HG3 MET 75 1HG MET 75 -1.280 7.086 11.980 562 HE1 MET 75 3HE MET 75 -2.987 6.267 10.060 563 HE2 MET 75 1HE MET 75 -4.569 5.566 10.404 564 HE3 MET 75 2HE MET 75 -3.104 4.667 10.795 565 HA PRO 76 HA PRO 76 2.250 1.437 13.909 566 HB2 PRO 76 2HB PRO 76 1.369 0.531 16.293 567 HB3 PRO 76 1HB PRO 76 2.660 1.727 16.156 568 HG2 PRO 76 2HG PRO 76 -0.229 2.124 16.807 569 HG3 PRO 76 1HG PRO 76 1.196 2.915 17.502 570 HD2 PRO 76 2HD PRO 76 -0.410 4.048 15.584 571 HD3 PRO 76 1HD PRO 76 1.294 4.470 15.826 572 H LEU 77 HN LEU 77 1.589 -0.721 13.632 573 HA LEU 77 HA LEU 77 -1.097 -1.014 12.654 574 HB2 LEU 77 2HB LEU 77 0.907 -2.118 11.620 575 HB3 LEU 77 1HB LEU 77 1.007 -3.149 13.033 576 HG LEU 77 HG LEU 77 -1.153 -4.146 12.508 577 HD11 LEU 77 1HD1 LEU 77 -2.206 -2.175 11.498 578 HD12 LEU 77 2HD1 LEU 77 -2.334 -3.591 10.454 579 HD13 LEU 77 3HD1 LEU 77 -1.149 -2.335 10.096 580 HD21 LEU 77 3HD2 LEU 77 -0.543 -5.289 10.434 581 HD22 LEU 77 1HD2 LEU 77 0.847 -5.132 11.509 582 HD23 LEU 77 2HD2 LEU 77 0.684 -4.064 10.117 583 H THR 78 HN THR 78 -2.725 -2.323 13.551 584 HA THR 78 HA THR 78 -2.325 -3.017 16.366 585 HB THR 78 HB THR 78 -4.515 -1.931 16.885 586 HG1 THR 78 1HG THR 78 -4.778 -0.145 15.037 587 HG21 THR 78 3HG2 THR 78 -2.397 -0.792 17.392 588 HG22 THR 78 1HG2 THR 78 -3.658 0.358 16.952 589 HG23 THR 78 2HG2 THR 78 -2.405 -0.066 15.785 590 H ASP 79 HN ASP 79 -4.365 -4.083 17.241 591 HA ASP 79 HA ASP 79 -4.936 -6.400 15.728 592 HB2 ASP 79 2HB ASP 79 -6.472 -6.962 17.560 593 HB3 ASP 79 1HB ASP 79 -4.923 -6.402 18.180 594 H ALA 80 HN ALA 80 -6.286 -3.294 15.714 595 HA ALA 80 HA ALA 80 -8.971 -3.760 15.095 596 HB1 ALA 80 1HB ALA 80 -8.085 -1.557 15.678 597 HB2 ALA 80 2HB ALA 80 -8.959 -1.512 14.147 598 HB3 ALA 80 3HB ALA 80 -7.195 -1.508 14.154 599 H ALA 81 HN ALA 81 -6.107 -4.168 13.213 600 HA ALA 81 HA ALA 81 -7.163 -3.955 10.624 601 HB1 ALA 81 1HB ALA 81 -4.764 -3.955 11.086 602 HB2 ALA 81 2HB ALA 81 -5.190 -5.196 9.908 603 HB3 ALA 81 3HB ALA 81 -4.858 -5.646 11.580 604 H PHE 82 HN PHE 82 -7.480 -6.461 12.994 605 HA PHE 82 HA PHE 82 -8.179 -8.528 11.117 606 HB2 PHE 82 2HB PHE 82 -8.420 -8.323 14.118 607 HB3 PHE 82 1HB PHE 82 -8.925 -9.736 13.203 608 HD1 PHE 82 1HD PHE 82 -7.219 -11.052 11.940 609 HD2 PHE 82 2HD PHE 82 -6.152 -7.943 14.647 610 HE1 PHE 82 1HE PHE 82 -4.929 -11.942 12.058 611 HE2 PHE 82 2HE PHE 82 -3.860 -8.831 14.766 612 HZ PHE 82 HZ PHE 82 -3.248 -10.833 13.473 613 H GLU 83 HN GLU 83 -9.770 -5.869 12.436 614 HA GLU 83 HA GLU 83 -12.423 -7.004 12.458 615 HB2 GLU 83 2HB GLU 83 -11.514 -4.136 12.695 616 HB3 GLU 83 1HB GLU 83 -13.132 -4.732 13.021 617 HG2 GLU 83 2HG GLU 83 -12.254 -6.108 14.831 618 HG3 GLU 83 1HG GLU 83 -10.638 -5.491 14.513 619 H ALA 84 HN ALA 84 -10.380 -5.356 10.242 620 HA ALA 84 HA ALA 84 -12.537 -4.467 8.533 621 HB1 ALA 84 1HB ALA 84 -9.551 -4.317 8.135 622 HB2 ALA 84 2HB ALA 84 -10.568 -3.048 8.817 623 HB3 ALA 84 3HB ALA 84 -10.772 -3.530 7.133 624 H GLU 85 HN GLU 85 -13.018 -5.267 6.536 625 HA GLU 85 HA GLU 85 -12.194 -7.993 5.988 626 HB2 GLU 85 2HB GLU 85 -14.551 -7.077 5.679 627 HB3 GLU 85 1HB GLU 85 -13.944 -6.261 4.251 628 HG2 GLU 85 2HG GLU 85 -13.357 -8.350 3.228 629 HG3 GLU 85 1HG GLU 85 -13.793 -9.234 4.687 630 H TYR 86 HN TYR 86 -11.490 -4.808 4.913 631 HA TYR 86 HA TYR 86 -9.514 -5.909 3.004 632 HB2 TYR 86 2HB TYR 86 -10.897 -3.246 2.595 633 HB3 TYR 86 1HB TYR 86 -9.978 -4.193 1.429 634 HD1 TYR 86 1HD TYR 86 -11.008 -6.607 0.964 635 HD2 TYR 86 2HD TYR 86 -13.195 -3.269 2.419 636 HE1 TYR 86 1HE TYR 86 -13.093 -7.637 0.169 637 HE2 TYR 86 2HE TYR 86 -15.289 -4.288 1.631 638 HH TYR 86 HH TYR 86 -15.668 -7.394 0.970 639 H LEU 87 HN LEU 87 -7.450 -5.151 3.352 640 HA LEU 87 HA LEU 87 -7.173 -3.031 5.398 641 HB2 LEU 87 2HB LEU 87 -6.601 -5.650 5.747 642 HB3 LEU 87 1HB LEU 87 -5.055 -5.077 5.157 643 HG LEU 87 HG LEU 87 -5.182 -5.126 7.615 644 HD11 LEU 87 1HD1 LEU 87 -4.967 -2.349 6.470 645 HD12 LEU 87 2HD1 LEU 87 -3.674 -3.546 6.538 646 HD13 LEU 87 3HD1 LEU 87 -4.335 -2.878 8.030 647 HD21 LEU 87 3HD2 LEU 87 -6.582 -3.489 8.784 648 HD22 LEU 87 1HD2 LEU 87 -7.545 -4.664 7.887 649 HD23 LEU 87 2HD2 LEU 87 -7.318 -3.037 7.247 650 H ALA 88 HN ALA 88 -6.012 -1.298 4.806 651 HA ALA 88 HA ALA 88 -3.986 -1.626 2.692 652 HB1 ALA 88 1HB ALA 88 -4.539 0.610 1.869 653 HB2 ALA 88 2HB ALA 88 -5.822 0.736 3.074 654 HB3 ALA 88 3HB ALA 88 -5.931 -0.469 1.791 655 H VAL 89 HN VAL 89 -1.998 -1.054 3.282 656 HA VAL 89 HA VAL 89 -1.668 0.928 5.440 657 HB VAL 89 HB VAL 89 -0.068 -1.631 5.148 658 HG11 VAL 89 1HG1 VAL 89 1.330 0.228 5.881 659 HG12 VAL 89 2HG1 VAL 89 1.080 -0.929 7.189 660 HG13 VAL 89 3HG1 VAL 89 0.185 0.590 7.174 661 HG21 VAL 89 3HG2 VAL 89 -2.257 -2.040 6.122 662 HG22 VAL 89 1HG2 VAL 89 -1.988 -0.760 7.304 663 HG23 VAL 89 2HG2 VAL 89 -0.996 -2.217 7.341 664 H ASP 90 HN ASP 90 -0.540 2.605 4.701 665 HA ASP 90 HA ASP 90 1.328 2.174 2.468 666 HB2 ASP 90 2HB ASP 90 -0.626 3.957 2.495 667 HB3 ASP 90 1HB ASP 90 0.536 4.901 3.414 668 H GLN 91 HN GLN 91 3.161 3.911 2.560 669 HA GLN 91 HA GLN 91 5.174 4.441 3.455 670 HB2 GLN 91 2HB GLN 91 3.716 4.832 6.063 671 HB3 GLN 91 1HB GLN 91 5.177 5.640 5.513 672 HG2 GLN 91 2HG GLN 91 3.733 6.576 3.627 673 HG3 GLN 91 1HG GLN 91 2.358 6.036 4.584 674 HE21 GLN 91 1HE2 GLN 91 1.545 7.987 5.080 675 HE22 GLN 91 2HE2 GLN 91 2.356 9.187 6.024 676 H VAL 92 HN VAL 92 4.460 1.697 3.452 677 HA VAL 92 HA VAL 92 5.119 0.325 5.827 678 HB VAL 92 HB VAL 92 5.452 -0.594 2.959 679 HG11 VAL 92 1HG1 VAL 92 5.195 -2.207 5.492 680 HG12 VAL 92 2HG1 VAL 92 6.646 -2.045 4.503 681 HG13 VAL 92 3HG1 VAL 92 5.222 -2.862 3.856 682 HG21 VAL 92 3HG2 VAL 92 3.235 -1.608 3.234 683 HG22 VAL 92 1HG2 VAL 92 3.182 0.148 3.389 684 HG23 VAL 92 2HG2 VAL 92 3.106 -0.867 4.829 685 H GLU 93 HN GLU 93 7.002 2.157 3.765 686 HA GLU 93 HA GLU 93 9.473 0.848 3.725 687 HB2 GLU 93 2HB GLU 93 8.581 2.955 2.469 688 HB3 GLU 93 1HB GLU 93 9.210 3.834 3.853 689 HG2 GLU 93 2HG GLU 93 10.878 3.908 2.207 690 HG3 GLU 93 1HG GLU 93 11.423 2.735 3.403 691 H LYS 94 HN LYS 94 7.811 2.401 6.305 692 HA LYS 94 HA LYS 94 10.319 2.744 7.811 693 HB2 LYS 94 2HB LYS 94 7.914 4.383 7.570 694 HB3 LYS 94 1HB LYS 94 8.423 4.127 9.234 695 HG2 LYS 94 2HG LYS 94 9.529 6.062 8.625 696 HG3 LYS 94 1HG LYS 94 10.754 4.813 8.410 697 HD2 LYS 94 2HD LYS 94 10.951 6.100 6.493 698 HD3 LYS 94 1HD LYS 94 9.950 4.752 5.968 699 HE2 LYS 94 2HE LYS 94 8.008 6.031 5.946 700 HE3 LYS 94 1HE LYS 94 8.695 7.270 6.992 701 HZ1 LYS 94 3HZ LYS 94 8.487 8.019 4.694 702 HZ2 LYS 94 1HZ LYS 94 9.509 6.771 4.170 703 HZ3 LYS 94 2HZ LYS 94 10.104 7.993 5.187 704 H LEU 95 HN LEU 95 8.758 0.193 7.645 705 HA LEU 95 HA LEU 95 7.257 -0.220 9.984 706 HB2 LEU 95 2HB LEU 95 8.864 -2.120 8.296 707 HB3 LEU 95 1HB LEU 95 7.923 -2.649 9.673 708 HG LEU 95 HG LEU 95 6.863 -1.367 7.160 709 HD11 LEU 95 1HD1 LEU 95 5.742 -3.526 6.865 710 HD12 LEU 95 2HD1 LEU 95 6.546 -4.135 8.311 711 HD13 LEU 95 3HD1 LEU 95 7.498 -3.696 6.894 712 HD21 LEU 95 3HD2 LEU 95 5.406 -2.240 9.654 713 HD22 LEU 95 1HD2 LEU 95 4.637 -1.766 8.137 714 HD23 LEU 95 2HD2 LEU 95 5.574 -0.589 9.056 715 H GLY 96 HN GLY 96 7.750 -0.638 12.066 716 HA2 GLY 96 2HA GLY 96 10.589 -0.553 12.814 717 HA3 GLY 96 1HA GLY 96 9.228 -0.220 13.873 718 H ASN 97 HN ASN 97 8.338 -1.867 15.063 719 HA ASN 97 HA ASN 97 9.609 -4.514 14.745 720 HB2 ASN 97 2HB ASN 97 10.711 -3.390 16.588 721 HB3 ASN 97 1HB ASN 97 9.165 -2.996 17.325 722 HD21 ASN 97 1HD2 ASN 97 10.064 -6.089 15.868 723 HD22 ASN 97 2HD2 ASN 97 9.965 -6.995 17.336 724 H GLU 98 HN GLU 98 7.048 -2.963 16.694 725 HA GLU 98 HA GLU 98 5.579 -5.297 17.162 726 HB2 GLU 98 2HB GLU 98 4.534 -2.465 17.006 727 HB3 GLU 98 1HB GLU 98 3.761 -3.815 17.827 728 HG2 GLU 98 2HG GLU 98 5.531 -3.922 19.438 729 HG3 GLU 98 1HG GLU 98 6.461 -2.710 18.559 730 H GLU 99 HN GLU 99 5.425 -2.919 14.599 731 HA GLU 99 HA GLU 99 3.064 -3.753 13.359 732 HB2 GLU 99 2HB GLU 99 5.468 -2.652 11.902 733 HB3 GLU 99 1HB GLU 99 3.779 -2.529 11.433 734 HG2 GLU 99 2HG GLU 99 4.098 -0.447 12.278 735 HG3 GLU 99 1HG GLU 99 3.579 -1.284 13.741 736 H GLN 100 HN GLN 100 6.368 -4.942 13.059 737 HA GLN 100 HA GLN 100 5.938 -6.600 10.809 738 HB2 GLN 100 2HB GLN 100 8.003 -6.615 12.999 739 HB3 GLN 100 1HB GLN 100 7.977 -7.853 11.752 740 HG2 GLN 100 2HG GLN 100 8.118 -6.011 10.060 741 HG3 GLN 100 1HG GLN 100 8.396 -4.900 11.401 742 HE21 GLN 100 1HE2 GLN 100 10.374 -4.901 12.434 743 HE22 GLN 100 2HE2 GLN 100 11.734 -5.804 11.859 744 H ALA 101 HN ALA 101 5.739 -7.199 14.285 745 HA ALA 101 HA ALA 101 5.264 -9.978 14.099 746 HB1 ALA 101 1HB ALA 101 4.443 -8.079 16.291 747 HB2 ALA 101 2HB ALA 101 6.016 -8.867 16.156 748 HB3 ALA 101 3HB ALA 101 4.564 -9.834 16.419 749 H LEU 102 HN LEU 102 3.121 -7.182 14.213 750 HA LEU 102 HA LEU 102 0.700 -8.688 14.284 751 HB2 LEU 102 2HB LEU 102 1.284 -6.135 14.784 752 HB3 LEU 102 1HB LEU 102 0.796 -5.949 13.115 753 HG LEU 102 HG LEU 102 -1.037 -5.450 14.628 754 HD11 LEU 102 1HD1 LEU 102 -1.494 -8.009 13.116 755 HD12 LEU 102 2HD1 LEU 102 -1.600 -6.374 12.463 756 HD13 LEU 102 3HD1 LEU 102 -2.747 -6.909 13.691 757 HD21 LEU 102 3HD2 LEU 102 -2.035 -7.189 16.027 758 HD22 LEU 102 1HD2 LEU 102 -0.373 -6.846 16.503 759 HD23 LEU 102 2HD2 LEU 102 -0.741 -8.297 15.571 760 H LEU 103 HN LEU 103 2.445 -6.973 11.715 761 HA LEU 103 HA LEU 103 0.785 -7.513 9.559 762 HB2 LEU 103 2HB LEU 103 2.849 -6.013 9.701 763 HB3 LEU 103 1HB LEU 103 3.795 -7.453 9.401 764 HG LEU 103 HG LEU 103 3.380 -5.979 7.412 765 HD11 LEU 103 1HD1 LEU 103 2.390 -8.812 7.195 766 HD12 LEU 103 2HD1 LEU 103 4.074 -8.294 7.143 767 HD13 LEU 103 3HD1 LEU 103 2.961 -7.809 5.862 768 HD21 LEU 103 3HD2 LEU 103 1.080 -5.362 7.872 769 HD22 LEU 103 1HD2 LEU 103 0.575 -7.042 7.683 770 HD23 LEU 103 2HD2 LEU 103 1.202 -6.149 6.298 771 H PHE 104 HN PHE 104 3.492 -9.445 10.807 772 HA PHE 104 HA PHE 104 3.503 -11.510 8.970 773 HB2 PHE 104 2HB PHE 104 5.148 -11.240 10.798 774 HB3 PHE 104 1HB PHE 104 3.928 -11.749 11.957 775 HD1 PHE 104 1HD PHE 104 5.800 -12.881 8.963 776 HD2 PHE 104 2HD PHE 104 3.642 -14.005 12.455 777 HE1 PHE 104 1HE PHE 104 6.466 -15.223 8.616 778 HE2 PHE 104 2HE PHE 104 4.307 -16.350 12.120 779 HZ PHE 104 HZ PHE 104 5.723 -16.961 10.200 780 H SER 105 HN SER 105 1.500 -11.177 11.872 781 HA SER 105 HA SER 105 0.110 -13.623 11.522 782 HB2 SER 105 2HB SER 105 0.291 -12.291 13.670 783 HB3 SER 105 1HB SER 105 -0.893 -11.178 12.991 784 HG SER 105 HG SER 105 -1.656 -13.799 12.803 785 H ILE 106 HN ILE 106 -0.568 -10.265 10.609 786 HA ILE 106 HA ILE 106 -3.096 -10.580 9.495 787 HB ILE 106 HB ILE 106 -0.840 -8.759 8.658 788 HG12 ILE 106 2HG1 ILE 106 -1.662 -8.373 10.918 789 HG13 ILE 106 1HG1 ILE 106 -2.131 -7.045 9.857 790 HG21 ILE 106 1HG2 ILE 106 -2.495 -7.427 7.456 791 HG22 ILE 106 2HG2 ILE 106 -3.728 -8.640 7.803 792 HG23 ILE 106 3HG2 ILE 106 -2.353 -9.048 6.775 793 HD11 ILE 106 3HD1 ILE 106 -3.922 -9.315 10.712 794 HD12 ILE 106 1HD1 ILE 106 -4.382 -7.937 9.712 795 HD13 ILE 106 2HD1 ILE 106 -3.919 -7.688 11.396 796 H PHE 107 HN PHE 107 0.075 -10.878 7.912 797 HA PHE 107 HA PHE 107 -0.887 -11.539 5.361 798 HB2 PHE 107 2HB PHE 107 1.606 -11.159 6.548 799 HB3 PHE 107 1HB PHE 107 1.641 -12.828 5.992 800 HD1 PHE 107 1HD PHE 107 1.061 -13.279 3.552 801 HD2 PHE 107 2HD PHE 107 1.930 -9.398 5.071 802 HE1 PHE 107 1HE PHE 107 1.547 -12.499 1.270 803 HE2 PHE 107 2HE PHE 107 2.421 -8.612 2.792 804 HZ PHE 107 HZ PHE 107 2.227 -10.158 0.889 805 H ASN 108 HN ASN 108 0.041 -13.579 8.103 806 HA ASN 108 HA ASN 108 -0.266 -16.070 6.828 807 HB2 ASN 108 2HB ASN 108 0.886 -15.813 8.981 808 HB3 ASN 108 1HB ASN 108 -0.629 -15.347 9.748 809 HD21 ASN 108 1HD2 ASN 108 -0.686 -16.998 11.195 810 HD22 ASN 108 2HD2 ASN 108 -0.922 -18.653 10.744 811 H ARG 109 HN ARG 109 -2.531 -14.141 8.756 812 HA ARG 109 HA ARG 109 -4.663 -16.012 8.630 813 HB2 ARG 109 2HB ARG 109 -4.378 -14.164 10.326 814 HB3 ARG 109 1HB ARG 109 -4.845 -13.023 9.078 815 HG2 ARG 109 2HG ARG 109 -6.665 -15.289 9.760 816 HG3 ARG 109 1HG ARG 109 -6.592 -13.870 10.802 817 HD2 ARG 109 2HD ARG 109 -7.120 -12.445 8.869 818 HD3 ARG 109 1HD ARG 109 -7.238 -13.883 7.857 819 HE ARG 109 HE ARG 109 -9.025 -14.521 9.661 820 HH11 ARG 109 1HH1 ARG 109 -8.472 -11.391 8.189 821 HH12 ARG 109 2HH1 ARG 109 -10.115 -10.857 8.384 822 HH21 ARG 109 1HH2 ARG 109 -11.197 -13.824 9.920 823 HH22 ARG 109 2HH2 ARG 109 -11.656 -12.245 9.369 824 H PHE 110 HN PHE 110 -3.806 -13.175 6.670 825 HA PHE 110 HA PHE 110 -6.161 -13.201 5.098 826 HB2 PHE 110 2HB PHE 110 -3.437 -11.994 4.721 827 HB3 PHE 110 1HB PHE 110 -4.645 -11.910 3.445 828 HD1 PHE 110 1HD PHE 110 -6.030 -11.871 6.750 829 HD2 PHE 110 2HD PHE 110 -4.304 -9.422 3.729 830 HE1 PHE 110 1HE PHE 110 -7.006 -9.883 7.816 831 HE2 PHE 110 2HE PHE 110 -5.285 -7.426 4.787 832 HZ PHE 110 HZ PHE 110 -6.636 -7.658 6.834 833 H ARG 111 HN ARG 111 -3.060 -14.839 4.778 834 HA ARG 111 HA ARG 111 -3.572 -15.871 2.170 835 HB2 ARG 111 2HB ARG 111 -1.621 -16.631 4.307 836 HB3 ARG 111 1HB ARG 111 -1.728 -17.481 2.764 837 HG2 ARG 111 2HG ARG 111 -1.565 -15.108 1.743 838 HG3 ARG 111 1HG ARG 111 -0.906 -14.676 3.321 839 HD2 ARG 111 2HD ARG 111 0.127 -16.873 1.557 840 HD3 ARG 111 1HD ARG 111 0.793 -15.256 1.675 841 HE ARG 111 HE ARG 111 1.194 -15.800 4.089 842 HH11 ARG 111 1HH1 ARG 111 1.025 -18.278 1.633 843 HH12 ARG 111 2HH1 ARG 111 1.897 -19.464 2.567 844 HH21 ARG 111 1HH2 ARG 111 2.359 -17.359 5.339 845 HH22 ARG 111 2HH2 ARG 111 2.643 -18.943 4.683 846 H ASN 112 HN ASN 112 -4.278 -16.918 5.420 847 HA ASN 112 HA ASN 112 -5.077 -19.578 4.701 848 HB2 ASN 112 2HB ASN 112 -5.010 -17.939 7.164 849 HB3 ASN 112 1HB ASN 112 -6.222 -19.211 7.119 850 HD21 ASN 112 1HD2 ASN 112 -2.835 -18.467 7.163 851 HD22 ASN 112 2HD2 ASN 112 -2.282 -20.072 7.494 852 H SER 113 HN SER 113 -6.759 -16.574 5.521 853 HA SER 113 HA SER 113 -9.373 -17.631 5.144 854 HB2 SER 113 2HB SER 113 -8.980 -15.652 6.529 855 HB3 SER 113 1HB SER 113 -8.378 -14.767 5.129 856 HG SER 113 HG SER 113 -10.561 -14.261 5.571 857 H GLY 114 HN GLY 114 -7.041 -16.025 3.071 858 HA2 GLY 114 2HA GLY 114 -6.955 -16.187 0.734 859 HA3 GLY 114 1HA GLY 114 -8.609 -16.785 0.734 860 H LYS 115 HN LYS 115 -9.031 -14.413 2.709 861 HA LYS 115 HA LYS 115 -9.286 -12.325 0.674 862 HB2 LYS 115 2HB LYS 115 -11.421 -13.597 1.336 863 HB3 LYS 115 1HB LYS 115 -11.279 -12.790 2.888 864 HG2 LYS 115 2HG LYS 115 -11.535 -10.653 1.867 865 HG3 LYS 115 1HG LYS 115 -11.440 -11.359 0.255 866 HD2 LYS 115 2HD LYS 115 -13.513 -12.648 0.791 867 HD3 LYS 115 1HD LYS 115 -13.626 -11.732 2.295 868 HE2 LYS 115 2HE LYS 115 -13.747 -9.650 1.021 869 HE3 LYS 115 1HE LYS 115 -13.622 -10.558 -0.483 870 HZ1 LYS 115 3HZ LYS 115 -15.704 -11.720 0.193 871 HZ2 LYS 115 1HZ LYS 115 -15.895 -10.062 -0.120 872 HZ3 LYS 115 2HZ LYS 115 -15.846 -10.622 1.477 873 H GLY 116 HN GLY 116 -9.848 -10.186 1.919 874 HA2 GLY 116 2HA GLY 116 -9.424 -9.144 4.174 875 HA3 GLY 116 1HA GLY 116 -7.857 -9.933 4.079 876 H PHE 117 HN PHE 117 -8.101 -9.387 1.126 877 HA PHE 117 HA PHE 117 -7.076 -7.995 -0.354 878 HB2 PHE 117 2HB PHE 117 -9.273 -6.395 0.902 879 HB3 PHE 117 1HB PHE 117 -8.275 -5.702 -0.372 880 HD1 PHE 117 2HD PHE 117 -10.230 -8.805 0.341 881 HD2 PHE 117 1HD PHE 117 -8.981 -5.928 -2.539 882 HE1 PHE 117 2HE PHE 117 -11.634 -9.901 -1.355 883 HE2 PHE 117 1HE PHE 117 -10.385 -7.019 -4.239 884 HZ PHE 117 HZ PHE 117 -11.712 -9.008 -3.647 885 H LEU 118 HN LEU 118 -4.958 -7.861 0.414 886 HA LEU 118 HA LEU 118 -4.382 -5.680 2.263 887 HB2 LEU 118 2HB LEU 118 -3.397 -8.066 2.458 888 HB3 LEU 118 1HB LEU 118 -2.354 -7.552 1.146 889 HG LEU 118 HG LEU 118 -1.456 -5.747 2.501 890 HD11 LEU 118 1HD1 LEU 118 -3.437 -5.295 3.861 891 HD12 LEU 118 2HD1 LEU 118 -2.014 -5.562 4.868 892 HD13 LEU 118 3HD1 LEU 118 -3.220 -6.836 4.692 893 HD21 LEU 118 3HD2 LEU 118 -1.387 -8.397 3.938 894 HD22 LEU 118 1HD2 LEU 118 -0.211 -7.093 4.096 895 HD23 LEU 118 2HD2 LEU 118 -0.378 -7.949 2.562 896 H LEU 119 HN LEU 119 -3.714 -3.857 1.604 897 HA LEU 119 HA LEU 119 -2.492 -3.579 -1.058 898 HB2 LEU 119 2HB LEU 119 -4.778 -2.595 -0.867 899 HB3 LEU 119 1HB LEU 119 -4.188 -1.550 0.409 900 HG LEU 119 HG LEU 119 -2.652 -0.470 -1.184 901 HD11 LEU 119 1HD1 LEU 119 -4.011 -2.204 -3.244 902 HD12 LEU 119 2HD1 LEU 119 -2.337 -2.361 -2.709 903 HD13 LEU 119 3HD1 LEU 119 -2.855 -0.911 -3.569 904 HD21 LEU 119 3HD2 LEU 119 -4.870 0.468 -0.808 905 HD22 LEU 119 1HD2 LEU 119 -5.527 -0.549 -2.090 906 HD23 LEU 119 2HD2 LEU 119 -4.355 0.713 -2.477 907 H LEU 120 HN LEU 120 -0.428 -3.037 -0.921 908 HA LEU 120 HA LEU 120 0.503 -1.718 1.549 909 HB2 LEU 120 2HB LEU 120 2.011 -3.675 -0.192 910 HB3 LEU 120 1HB LEU 120 2.605 -2.936 1.283 911 HG LEU 120 HG LEU 120 0.227 -4.793 1.171 912 HD11 LEU 120 1HD1 LEU 120 2.239 -5.991 0.526 913 HD12 LEU 120 2HD1 LEU 120 1.728 -6.468 2.145 914 HD13 LEU 120 3HD1 LEU 120 3.087 -5.363 1.939 915 HD21 LEU 120 3HD2 LEU 120 0.227 -3.241 3.065 916 HD22 LEU 120 1HD2 LEU 120 1.856 -3.764 3.492 917 HD23 LEU 120 2HD2 LEU 120 0.511 -4.902 3.587 918 H GLY 121 HN GLY 121 1.903 -0.010 1.372 919 HA2 GLY 121 2HA GLY 121 2.921 0.657 -1.306 920 HA3 GLY 121 1HA GLY 121 1.992 1.856 -0.419 921 H SER 122 HN SER 122 4.871 1.676 -1.360 922 HA SER 122 HA SER 122 5.912 2.940 1.025 923 HB2 SER 122 2HB SER 122 7.974 1.657 1.109 924 HB3 SER 122 1HB SER 122 6.603 0.563 1.272 925 HG SER 122 HG SER 122 8.554 0.617 -0.587 926 H GLU 123 HN GLU 123 8.640 3.141 -0.009 927 HA GLU 123 HA GLU 123 7.973 4.986 -2.212 928 HB2 GLU 123 2HB GLU 123 9.549 6.596 -1.267 929 HB3 GLU 123 1HB GLU 123 8.262 6.205 -0.134 930 HG2 GLU 123 2HG GLU 123 9.874 4.543 0.891 931 HG3 GLU 123 1HG GLU 123 11.127 5.330 -0.070 932 H TYR 124 HN TYR 124 10.241 2.616 -1.023 933 HA TYR 124 HA TYR 124 11.956 3.195 -3.344 934 HB2 TYR 124 2HB TYR 124 12.535 1.492 -0.913 935 HB3 TYR 124 1HB TYR 124 13.642 1.747 -2.256 936 HD1 TYR 124 1HD TYR 124 13.515 4.574 -2.780 937 HD2 TYR 124 2HD TYR 124 13.386 2.537 0.953 938 HE1 TYR 124 1HE TYR 124 14.409 6.572 -1.665 939 HE2 TYR 124 2HE TYR 124 14.281 4.530 2.078 940 HH TYR 124 HH TYR 124 15.657 6.521 1.448 941 H THR 125 HN THR 125 11.590 0.116 -1.689 942 HA THR 125 HA THR 125 9.910 -1.153 -3.564 943 HB THR 125 HB THR 125 12.003 -2.766 -4.197 944 HG1 THR 125 1HG THR 125 13.011 -0.104 -4.275 945 HG21 THR 125 3HG2 THR 125 11.068 -0.383 -5.795 946 HG22 THR 125 1HG2 THR 125 10.317 -1.978 -5.766 947 HG23 THR 125 2HG2 THR 125 11.933 -1.777 -6.442 948 HA PRO 126 HA PRO 126 9.631 -4.024 -0.302 949 HB2 PRO 126 2HB PRO 126 9.414 -6.455 -1.529 950 HB3 PRO 126 1HB PRO 126 8.114 -5.261 -1.484 951 HG2 PRO 126 2HG PRO 126 10.070 -5.847 -3.669 952 HG3 PRO 126 1HG PRO 126 8.327 -5.537 -3.780 953 HD2 PRO 126 2HD PRO 126 10.150 -3.636 -4.344 954 HD3 PRO 126 1HD PRO 126 8.593 -3.248 -3.585 955 H GLN 127 HN GLN 127 12.108 -4.682 -2.657 956 HA GLN 127 HA GLN 127 13.453 -6.622 -0.983 957 HB2 GLN 127 2HB GLN 127 14.257 -5.395 -3.621 958 HB3 GLN 127 1HB GLN 127 15.112 -6.700 -2.810 959 HG2 GLN 127 2HG GLN 127 13.181 -8.143 -3.041 960 HG3 GLN 127 1HG GLN 127 12.268 -6.832 -3.789 961 HE21 GLN 127 1HE2 GLN 127 12.768 -6.195 -5.890 962 HE22 GLN 127 2HE2 GLN 127 13.720 -7.184 -6.948 963 H GLN 128 HN GLN 128 13.302 -3.312 -1.067 964 HA GLN 128 HA GLN 128 16.048 -3.012 -0.055 965 HB2 GLN 128 2HB GLN 128 14.066 -0.872 -0.876 966 HB3 GLN 128 1HB GLN 128 15.722 -0.594 -0.351 967 HG2 GLN 128 2HG GLN 128 14.857 -2.059 -2.833 968 HG3 GLN 128 1HG GLN 128 15.539 -0.436 -2.757 969 HE21 GLN 128 1HE2 GLN 128 16.452 -2.845 -4.145 970 HE22 GLN 128 2HE2 GLN 128 18.070 -3.128 -3.589 971 H LEU 129 HN LEU 129 13.012 -3.618 1.012 972 HA LEU 129 HA LEU 129 12.768 -1.882 3.243 973 HB2 LEU 129 2HB LEU 129 11.581 -4.598 2.666 974 HB3 LEU 129 1HB LEU 129 11.153 -3.631 4.058 975 HG LEU 129 HG LEU 129 10.739 -2.775 1.196 976 HD11 LEU 129 1HD1 LEU 129 8.376 -3.205 1.620 977 HD12 LEU 129 2HD1 LEU 129 8.772 -3.826 3.222 978 HD13 LEU 129 3HD1 LEU 129 9.330 -4.678 1.782 979 HD21 LEU 129 3HD2 LEU 129 11.022 -0.896 2.702 980 HD22 LEU 129 1HD2 LEU 129 9.834 -1.581 3.813 981 HD23 LEU 129 2HD2 LEU 129 9.333 -1.032 2.213 982 H VAL 130 HN VAL 130 13.641 -2.004 5.228 983 HA VAL 130 HA VAL 130 15.422 -4.250 5.795 984 HB VAL 130 HB VAL 130 15.133 -1.674 7.349 985 HG11 VAL 130 1HG1 VAL 130 17.281 -3.792 7.390 986 HG12 VAL 130 2HG1 VAL 130 16.078 -3.509 8.648 987 HG13 VAL 130 3HG1 VAL 130 17.303 -2.286 8.308 988 HG21 VAL 130 3HG2 VAL 130 17.149 -2.408 5.230 989 HG22 VAL 130 1HG2 VAL 130 17.202 -0.962 6.238 990 HG23 VAL 130 2HG2 VAL 130 15.883 -1.188 5.088 991 H ILE 131 HN ILE 131 13.838 -5.762 6.257 992 HA ILE 131 HA ILE 131 12.737 -5.576 8.957 993 HB ILE 131 HB ILE 131 10.600 -6.606 8.192 994 HG12 ILE 131 2HG1 ILE 131 11.550 -5.815 5.428 995 HG13 ILE 131 1HG1 ILE 131 11.427 -7.466 6.026 996 HG21 ILE 131 1HG2 ILE 131 11.224 -3.867 7.102 997 HG22 ILE 131 2HG2 ILE 131 10.637 -4.260 8.718 998 HG23 ILE 131 3HG2 ILE 131 9.599 -4.521 7.315 999 HD11 ILE 131 3HD1 ILE 131 9.548 -6.871 4.598 1000 HD12 ILE 131 1HD1 ILE 131 9.132 -5.552 5.691 1001 HD13 ILE 131 2HD1 ILE 131 9.022 -7.223 6.244 1002 H ARG 132 HN ARG 132 11.561 -7.938 9.253 1003 HA ARG 132 HA ARG 132 13.580 -9.855 9.253 1004 HB2 ARG 132 2HB ARG 132 10.648 -9.928 9.630 1005 HB3 ARG 132 1HB ARG 132 11.425 -11.455 9.262 1006 HG2 ARG 132 2HG ARG 132 12.203 -9.622 11.521 1007 HG3 ARG 132 1HG ARG 132 11.210 -11.076 11.675 1008 HD2 ARG 132 2HD ARG 132 13.009 -12.469 10.959 1009 HD3 ARG 132 1HD ARG 132 13.983 -11.075 10.506 1010 HE ARG 132 HE ARG 132 13.256 -11.251 13.312 1011 HH11 ARG 132 1HH1 ARG 132 15.602 -11.935 10.801 1012 HH12 ARG 132 2HH1 ARG 132 16.930 -12.091 11.912 1013 HH21 ARG 132 1HH2 ARG 132 15.014 -11.489 14.784 1014 HH22 ARG 132 2HH2 ARG 132 16.600 -11.846 14.159 1015 H GLU 133 HN GLU 133 14.312 -11.280 7.874 1016 HA GLU 133 HA GLU 133 13.780 -10.822 5.115 1017 HB2 GLU 133 2HB GLU 133 15.416 -12.729 4.774 1018 HB3 GLU 133 1HB GLU 133 16.024 -11.321 5.629 1019 HG2 GLU 133 2HG GLU 133 15.016 -13.757 7.066 1020 HG3 GLU 133 1HG GLU 133 16.681 -13.611 6.511 1021 H ASP 134 HN ASP 134 12.749 -13.201 7.440 1022 HA ASP 134 HA ASP 134 11.737 -15.047 5.501 1023 HB2 ASP 134 2HB ASP 134 10.671 -16.170 7.365 1024 HB3 ASP 134 1HB ASP 134 12.311 -15.722 7.820 1025 H LEU 135 HN LEU 135 10.522 -12.225 7.123 1026 HA LEU 135 HA LEU 135 7.796 -12.632 6.276 1027 HB2 LEU 135 2HB LEU 135 8.651 -11.339 8.344 1028 HB3 LEU 135 1HB LEU 135 9.005 -10.041 7.225 1029 HG LEU 135 HG LEU 135 6.233 -11.200 7.518 1030 HD11 LEU 135 1HD1 LEU 135 7.410 -8.816 8.942 1031 HD12 LEU 135 2HD1 LEU 135 6.987 -10.356 9.692 1032 HD13 LEU 135 3HD1 LEU 135 5.725 -9.337 8.998 1033 HD21 LEU 135 3HD2 LEU 135 6.646 -9.909 5.481 1034 HD22 LEU 135 1HD2 LEU 135 7.231 -8.560 6.452 1035 HD23 LEU 135 2HD2 LEU 135 5.544 -9.059 6.564 1036 H ARG 136 HN ARG 136 10.595 -10.740 5.303 1037 HA ARG 136 HA ARG 136 9.282 -9.163 3.358 1038 HB2 ARG 136 2HB ARG 136 11.542 -8.772 4.521 1039 HB3 ARG 136 1HB ARG 136 12.214 -9.864 3.321 1040 HG2 ARG 136 2HG ARG 136 10.579 -7.593 2.348 1041 HG3 ARG 136 1HG ARG 136 12.181 -7.239 2.991 1042 HD2 ARG 136 2HD ARG 136 11.717 -9.358 0.917 1043 HD3 ARG 136 1HD ARG 136 11.990 -7.671 0.487 1044 HE ARG 136 HE ARG 136 14.060 -8.335 2.168 1045 HH11 ARG 136 1HH1 ARG 136 12.808 -9.576 -0.847 1046 HH12 ARG 136 2HH1 ARG 136 14.360 -10.050 -1.461 1047 HH21 ARG 136 1HH2 ARG 136 16.115 -8.923 1.376 1048 HH22 ARG 136 2HH2 ARG 136 16.255 -9.655 -0.198 1049 H THR 137 HN THR 137 10.508 -12.414 3.277 1050 HA THR 137 HA THR 137 10.565 -12.564 0.408 1051 HB THR 137 HB THR 137 10.543 -15.125 0.986 1052 HG1 THR 137 1HG THR 137 11.681 -14.324 3.406 1053 HG21 THR 137 3HG2 THR 137 12.857 -13.345 1.757 1054 HG22 THR 137 1HG2 THR 137 12.469 -13.869 0.118 1055 HG23 THR 137 2HG2 THR 137 12.956 -15.053 1.330 1056 H ARG 138 HN ARG 138 8.191 -13.114 2.927 1057 HA ARG 138 HA ARG 138 6.283 -14.477 1.290 1058 HB2 ARG 138 2HB ARG 138 5.632 -12.791 3.702 1059 HB3 ARG 138 1HB ARG 138 4.749 -14.178 3.080 1060 HG2 ARG 138 2HG ARG 138 7.508 -14.317 4.264 1061 HG3 ARG 138 1HG ARG 138 6.024 -14.611 5.161 1062 HD2 ARG 138 2HD ARG 138 5.497 -16.442 3.550 1063 HD3 ARG 138 1HD ARG 138 7.085 -16.189 2.822 1064 HE ARG 138 HE ARG 138 7.267 -16.585 5.645 1065 HH11 ARG 138 1HH1 ARG 138 6.905 -18.306 2.600 1066 HH12 ARG 138 2HH1 ARG 138 7.562 -19.792 3.228 1067 HH21 ARG 138 1HH2 ARG 138 8.128 -18.507 6.453 1068 HH22 ARG 138 2HH2 ARG 138 8.282 -19.904 5.426 1069 H MET 139 HN MET 139 7.351 -11.286 1.502 1070 HA MET 139 HA MET 139 5.060 -9.812 0.825 1071 HB2 MET 139 2HB MET 139 7.983 -9.292 0.264 1072 HB3 MET 139 1HB MET 139 6.707 -8.119 -0.014 1073 HG2 MET 139 2HG MET 139 7.260 -9.345 2.670 1074 HG3 MET 139 1HG MET 139 7.993 -7.844 2.114 1075 HE1 MET 139 3HE MET 139 6.682 -5.606 1.706 1076 HE2 MET 139 1HE MET 139 4.923 -5.478 1.749 1077 HE3 MET 139 2HE MET 139 5.706 -6.440 0.497 1078 H ALA 140 HN ALA 140 6.915 -12.017 -0.985 1079 HA ALA 140 HA ALA 140 6.468 -10.891 -3.577 1080 HB1 ALA 140 1HB ALA 140 8.379 -12.345 -3.093 1081 HB2 ALA 140 2HB ALA 140 7.404 -12.959 -4.428 1082 HB3 ALA 140 3HB ALA 140 7.278 -13.696 -2.830 1083 H TYR 141 HN TYR 141 4.247 -12.078 -1.525 1084 HA TYR 141 HA TYR 141 2.771 -13.702 -3.425 1085 HB2 TYR 141 2HB TYR 141 2.290 -12.882 -0.574 1086 HB3 TYR 141 1HB TYR 141 1.009 -13.611 -1.532 1087 HD1 TYR 141 1HD TYR 141 1.948 -15.806 -2.885 1088 HD2 TYR 141 2HD TYR 141 3.382 -14.325 0.836 1089 HE1 TYR 141 1HE TYR 141 2.770 -18.052 -2.313 1090 HE2 TYR 141 2HE TYR 141 4.219 -16.561 1.412 1091 HH TYR 141 HH TYR 141 3.742 -18.903 0.814 1092 H CYS 142 HN CYS 142 3.279 -10.600 -3.566 1093 HA CYS 142 HA CYS 142 0.523 -10.010 -4.342 1094 HB2 CYS 142 2HB CYS 142 0.789 -7.689 -3.512 1095 HB3 CYS 142 1HB CYS 142 0.862 -8.879 -2.217 1096 HG CYS 142 HG CYS 142 3.697 -8.797 -2.087 1097 H LEU 143 HN LEU 143 0.366 -8.273 -5.921 1098 HA LEU 143 HA LEU 143 2.450 -8.500 -7.916 1099 HB2 LEU 143 2HB LEU 143 -0.177 -7.015 -7.923 1100 HB3 LEU 143 1HB LEU 143 0.924 -7.038 -9.279 1101 HG LEU 143 HG LEU 143 0.645 -9.566 -9.243 1102 HD11 LEU 143 1HD1 LEU 143 -0.347 -9.774 -7.032 1103 HD12 LEU 143 2HD1 LEU 143 -1.425 -10.412 -8.273 1104 HD13 LEU 143 3HD1 LEU 143 -1.738 -8.828 -7.561 1105 HD21 LEU 143 3HD2 LEU 143 -1.687 -7.792 -9.931 1106 HD22 LEU 143 1HD2 LEU 143 -1.458 -9.440 -10.515 1107 HD23 LEU 143 2HD2 LEU 143 -0.314 -8.178 -10.969 1108 H VAL 144 HN VAL 144 3.469 -6.630 -8.922 1109 HA VAL 144 HA VAL 144 3.860 -4.479 -6.951 1110 HB VAL 144 HB VAL 144 5.810 -5.437 -9.053 1111 HG11 VAL 144 1HG1 VAL 144 6.077 -3.075 -8.530 1112 HG12 VAL 144 2HG1 VAL 144 7.422 -4.011 -7.878 1113 HG13 VAL 144 3HG1 VAL 144 6.139 -3.451 -6.808 1114 HG21 VAL 144 3HG2 VAL 144 5.513 -7.102 -7.293 1115 HG22 VAL 144 1HG2 VAL 144 5.823 -5.872 -6.069 1116 HG23 VAL 144 2HG2 VAL 144 7.102 -6.346 -7.186 1117 H TYR 145 HN TYR 145 2.901 -2.692 -7.522 1118 HA TYR 145 HA TYR 145 2.915 -1.890 -10.359 1119 HB2 TYR 145 2HB TYR 145 0.850 -1.495 -8.211 1120 HB3 TYR 145 1HB TYR 145 0.939 -0.391 -9.577 1121 HD1 TYR 145 2HD TYR 145 0.508 -3.984 -8.707 1122 HD2 TYR 145 1HD TYR 145 -0.080 -0.928 -11.604 1123 HE1 TYR 145 2HE TYR 145 -0.874 -5.519 -10.040 1124 HE2 TYR 145 1HE TYR 145 -1.465 -2.455 -12.944 1125 HH TYR 145 HH TYR 145 -1.909 -4.746 -13.260 1126 H GLU 146 HN GLU 146 3.494 0.218 -10.845 1127 HA GLU 146 HA GLU 146 4.794 1.647 -8.641 1128 HB2 GLU 146 2HB GLU 146 6.139 2.763 -10.418 1129 HB3 GLU 146 1HB GLU 146 6.382 1.026 -10.328 1130 HG2 GLU 146 2HG GLU 146 4.853 0.747 -12.241 1131 HG3 GLU 146 1HG GLU 146 4.706 2.500 -12.348 1132 H VAL 147 HN VAL 147 3.752 3.334 -7.896 1133 HA VAL 147 HA VAL 147 1.897 4.786 -9.647 1134 HB VAL 147 HB VAL 147 2.256 5.042 -6.650 1135 HG11 VAL 147 1HG1 VAL 147 0.126 6.246 -6.731 1136 HG12 VAL 147 2HG1 VAL 147 0.105 6.093 -8.488 1137 HG13 VAL 147 3HG1 VAL 147 1.357 7.054 -7.702 1138 HG21 VAL 147 3HG2 VAL 147 0.150 3.797 -6.477 1139 HG22 VAL 147 1HG2 VAL 147 1.417 2.831 -7.233 1140 HG23 VAL 147 2HG2 VAL 147 0.152 3.556 -8.224 1141 H LYS 148 HN LYS 148 3.092 6.172 -10.807 1142 HA LYS 148 HA LYS 148 5.051 7.822 -9.359 1143 HB2 LYS 148 2HB LYS 148 6.252 8.031 -11.505 1144 HB3 LYS 148 1HB LYS 148 6.140 6.363 -10.961 1145 HG2 LYS 148 2HG LYS 148 4.452 5.867 -12.558 1146 HG3 LYS 148 1HG LYS 148 4.270 7.570 -12.980 1147 HD2 LYS 148 2HD LYS 148 6.938 6.283 -13.292 1148 HD3 LYS 148 1HD LYS 148 5.685 5.944 -14.484 1149 HE2 LYS 148 2HE LYS 148 7.073 7.792 -15.221 1150 HE3 LYS 148 1HE LYS 148 5.433 8.342 -14.898 1151 HZ1 LYS 148 3HZ LYS 148 7.462 9.699 -14.064 1152 HZ2 LYS 148 1HZ LYS 148 7.474 8.589 -12.783 1153 HZ3 LYS 148 2HZ LYS 148 6.098 9.544 -13.076 1154 HA PRO 149 HA PRO 149 2.923 11.489 -10.782 1155 HB2 PRO 149 2HB PRO 149 5.089 13.127 -11.138 1156 HB3 PRO 149 1HB PRO 149 4.368 12.789 -9.562 1157 HG2 PRO 149 2HG PRO 149 6.794 11.593 -10.833 1158 HG3 PRO 149 1HG PRO 149 6.533 12.080 -9.148 1159 HD2 PRO 149 2HD PRO 149 6.401 9.500 -9.943 1160 HD3 PRO 149 1HD PRO 149 5.394 10.144 -8.631 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -9.322 31.541 -19.391 2 H2 MET 1 H2 MET 1 -8.169 30.733 -18.451 3 H3 MET 1 H3 MET 1 -9.815 30.419 -18.219 4 HA MET 1 HA MET 1 -10.019 29.419 -20.355 5 HB2 MET 1 2HB MET 1 -7.107 30.184 -20.636 6 HB3 MET 1 1HB MET 1 -7.900 29.017 -21.678 7 HG2 MET 1 2HG MET 1 -7.821 31.117 -22.802 8 HG3 MET 1 1HG MET 1 -9.494 30.776 -22.370 9 HE1 MET 1 2HE MET 1 -8.380 33.644 -23.281 10 HE2 MET 1 3HE MET 1 -9.229 34.693 -22.146 11 HE3 MET 1 1HE MET 1 -10.072 33.335 -22.893 12 H GLY 2 HN GLY 2 -10.115 27.257 -20.150 13 HA2 GLY 2 2HA GLY 2 -7.943 25.669 -19.226 14 HA3 GLY 2 1HA GLY 2 -9.134 25.890 -17.950 15 H HIS 3 HN HIS 3 -8.203 23.638 -19.915 16 HA HIS 3 HA HIS 3 -10.703 22.285 -19.978 17 HB2 HIS 3 2HB HIS 3 -11.008 23.835 -21.921 18 HB3 HIS 3 1HB HIS 3 -9.602 23.099 -22.682 19 HD1 HIS 3 1HD HIS 3 -13.226 22.690 -22.215 20 HD2 HIS 3 2HD HIS 3 -10.021 20.347 -23.475 21 HE1 HIS 3 1HE HIS 3 -14.245 20.706 -23.380 22 HE2 HIS 3 2HE HIS 3 -12.297 19.273 -24.095 23 H HIS 4 HN HIS 4 -7.429 22.538 -21.277 24 HA HIS 4 HA HIS 4 -7.236 19.703 -21.790 25 HB2 HIS 4 2HB HIS 4 -6.066 21.576 -23.094 26 HB3 HIS 4 1HB HIS 4 -4.947 21.666 -21.739 27 HD1 HIS 4 1HD HIS 4 -2.915 20.260 -22.004 28 HD2 HIS 4 2HD HIS 4 -6.131 18.809 -24.210 29 HE1 HIS 4 1HE HIS 4 -2.019 18.306 -23.312 30 HE2 HIS 4 2HE HIS 4 -3.925 17.618 -24.818 31 H HIS 5 HN HIS 5 -7.832 19.183 -19.507 32 HA HIS 5 HA HIS 5 -5.843 19.700 -17.490 33 HB2 HIS 5 2HB HIS 5 -7.316 18.241 -16.038 34 HB3 HIS 5 1HB HIS 5 -8.066 19.694 -16.677 35 HD1 HIS 5 1HD HIS 5 -10.127 19.416 -18.110 36 HD2 HIS 5 2HD HIS 5 -8.281 15.800 -17.194 37 HE1 HIS 5 1HE HIS 5 -11.725 17.621 -18.862 38 HE2 HIS 5 2HE HIS 5 -10.682 15.458 -18.086 39 H HIS 6 HN HIS 6 -4.115 18.715 -18.745 40 HA HIS 6 HA HIS 6 -3.430 16.204 -17.599 41 HB2 HIS 6 2HB HIS 6 -4.761 15.258 -19.399 42 HB3 HIS 6 1HB HIS 6 -3.944 16.269 -20.584 43 HD1 HIS 6 1HD HIS 6 -3.129 13.413 -18.191 44 HD2 HIS 6 2HD HIS 6 -1.779 15.111 -21.745 45 HE1 HIS 6 1HE HIS 6 -1.299 11.896 -19.023 46 HE2 HIS 6 2HE HIS 6 -0.384 13.032 -21.081 47 H HIS 7 HN HIS 7 -1.540 17.021 -16.893 48 HA HIS 7 HA HIS 7 0.598 17.472 -18.709 49 HB2 HIS 7 2HB HIS 7 -0.555 19.620 -19.034 50 HB3 HIS 7 1HB HIS 7 -0.530 19.907 -17.299 51 HD1 HIS 7 1HD HIS 7 1.895 19.525 -20.198 52 HD2 HIS 7 2HD HIS 7 1.662 21.253 -16.420 53 HE1 HIS 7 1HE HIS 7 4.006 20.870 -19.932 54 HE2 HIS 7 2HE HIS 7 3.802 21.984 -17.677 55 H HIS 8 HN HIS 8 2.448 16.995 -17.692 56 HA HIS 8 HA HIS 8 2.554 16.454 -14.900 57 HB2 HIS 8 2HB HIS 8 4.703 16.763 -16.999 58 HB3 HIS 8 1HB HIS 8 5.085 16.441 -15.314 59 HD1 HIS 8 1HD HIS 8 5.320 14.632 -18.103 60 HD2 HIS 8 2HD HIS 8 2.965 14.040 -14.725 61 HE1 HIS 8 1HE HIS 8 4.859 12.160 -18.018 62 HE2 HIS 8 2HE HIS 8 3.583 11.800 -15.870 63 H SER 9 HN SER 9 2.217 18.106 -13.509 64 HA SER 9 HA SER 9 3.781 20.568 -13.945 65 HB2 SER 9 2HB SER 9 1.369 20.921 -14.384 66 HB3 SER 9 1HB SER 9 0.998 20.347 -12.760 67 HG SER 9 HG SER 9 1.187 22.384 -12.277 68 H HIS 10 HN HIS 10 4.723 21.514 -12.165 69 HA HIS 10 HA HIS 10 4.881 19.948 -9.730 70 HB2 HIS 10 2HB HIS 10 6.270 22.404 -10.753 71 HB3 HIS 10 1HB HIS 10 6.318 22.032 -9.035 72 HD1 HIS 10 1HD HIS 10 8.906 21.710 -9.269 73 HD2 HIS 10 2HD HIS 10 6.603 19.002 -11.435 74 HE1 HIS 10 1HE HIS 10 10.471 19.847 -9.917 75 HE2 HIS 10 2HE HIS 10 9.045 18.182 -11.163 76 H MET 11 HN MET 11 3.267 20.085 -8.343 77 HA MET 11 HA MET 11 1.402 22.243 -8.403 78 HB2 MET 11 2HB MET 11 0.233 21.067 -6.647 79 HB3 MET 11 1HB MET 11 0.756 19.916 -7.867 80 HG2 MET 11 2HG MET 11 2.634 19.262 -6.443 81 HG3 MET 11 1HG MET 11 2.103 20.416 -5.223 82 HE1 MET 11 3HE MET 11 -0.237 20.239 -3.961 83 HE2 MET 11 1HE MET 11 -1.350 18.878 -4.126 84 HE3 MET 11 2HE MET 11 -1.138 20.009 -5.461 85 H ASP 12 HN ASP 12 0.989 23.815 -6.920 86 HA ASP 12 HA ASP 12 3.185 24.441 -5.072 87 HB2 ASP 12 2HB ASP 12 0.874 26.184 -5.970 88 HB3 ASP 12 1HB ASP 12 2.242 26.697 -4.990 89 H TYR 13 HN TYR 13 -0.188 23.718 -5.328 90 HA TYR 13 HA TYR 13 -1.759 23.073 -3.854 91 HB2 TYR 13 2HB TYR 13 -0.143 21.524 -2.958 92 HB3 TYR 13 1HB TYR 13 0.599 22.790 -1.988 93 HD1 TYR 13 1HD TYR 13 -2.852 21.405 -2.485 94 HD2 TYR 13 2HD TYR 13 0.157 22.656 0.254 95 HE1 TYR 13 1HE TYR 13 -4.328 20.823 -0.602 96 HE2 TYR 13 2HE TYR 13 -1.310 22.083 2.138 97 HH TYR 13 HH TYR 13 -3.622 21.773 2.635 98 HA PRO 14 HA PRO 14 -2.281 27.222 -2.052 99 HB2 PRO 14 2HB PRO 14 -4.923 27.115 -3.243 100 HB3 PRO 14 1HB PRO 14 -3.600 28.230 -3.593 101 HG2 PRO 14 2HG PRO 14 -4.480 26.345 -5.358 102 HG3 PRO 14 1HG PRO 14 -2.819 26.964 -5.332 103 HD2 PRO 14 2HD PRO 14 -3.909 24.409 -4.203 104 HD3 PRO 14 1HD PRO 14 -2.387 24.698 -5.077 105 H SER 15 HN SER 15 -2.782 27.099 0.043 106 HA SER 15 HA SER 15 -4.668 25.081 0.943 107 HB2 SER 15 2HB SER 15 -2.984 26.991 2.579 108 HB3 SER 15 1HB SER 15 -3.860 25.583 3.181 109 HG SER 15 HG SER 15 -1.419 25.734 1.981 110 H PHE 16 HN PHE 16 -6.671 25.893 0.338 111 HA PHE 16 HA PHE 16 -7.611 28.038 2.082 112 HB2 PHE 16 2HB PHE 16 -8.954 29.041 0.295 113 HB3 PHE 16 1HB PHE 16 -7.244 29.094 -0.106 114 HD1 PHE 16 1HD PHE 16 -6.336 27.530 -1.807 115 HD2 PHE 16 2HD PHE 16 -10.511 27.904 -1.063 116 HE1 PHE 16 1HE PHE 16 -6.816 26.473 -3.977 117 HE2 PHE 16 2HE PHE 16 -10.999 26.847 -3.229 118 HZ PHE 16 HZ PHE 16 -9.148 26.128 -4.690 119 H ASP 17 HN ASP 17 -9.621 27.725 2.901 120 HA ASP 17 HA ASP 17 -10.795 25.091 2.361 121 HB2 ASP 17 2HB ASP 17 -11.889 25.271 4.504 122 HB3 ASP 17 1HB ASP 17 -10.192 25.685 4.718 123 H LYS 18 HN LYS 18 -13.291 25.114 2.739 124 HA LYS 18 HA LYS 18 -14.368 27.326 1.137 125 HB2 LYS 18 2HB LYS 18 -15.963 25.755 0.132 126 HB3 LYS 18 1HB LYS 18 -14.303 25.320 -0.221 127 HG2 LYS 18 2HG LYS 18 -15.888 24.017 1.972 128 HG3 LYS 18 1HG LYS 18 -15.896 23.435 0.308 129 HD2 LYS 18 2HD LYS 18 -13.372 23.299 0.481 130 HD3 LYS 18 1HD LYS 18 -13.564 23.581 2.213 131 HE2 LYS 18 2HE LYS 18 -13.414 21.229 1.900 132 HE3 LYS 18 1HE LYS 18 -15.099 21.597 2.265 133 HZ1 LYS 18 3HZ LYS 18 -15.024 20.055 0.460 134 HZ2 LYS 18 1HZ LYS 18 -13.935 21.018 -0.409 135 HZ3 LYS 18 2HZ LYS 18 -15.526 21.547 -0.168 136 H PHE 19 HN PHE 19 -16.394 28.127 1.630 137 HA PHE 19 HA PHE 19 -18.055 27.230 3.695 138 HB2 PHE 19 2HB PHE 19 -16.243 27.778 5.201 139 HB3 PHE 19 1HB PHE 19 -16.000 29.338 4.441 140 HD1 PHE 19 1HD PHE 19 -18.631 27.390 6.239 141 HD2 PHE 19 2HD PHE 19 -16.905 31.195 5.438 142 HE1 PHE 19 1HE PHE 19 -20.132 28.418 7.898 143 HE2 PHE 19 2HE PHE 19 -18.403 32.230 7.088 144 HZ PHE 19 HZ PHE 19 -20.018 30.841 8.323 145 H LEU 20 HN LEU 20 -19.561 29.445 1.378 146 HA LEU 20 HA LEU 20 -20.729 27.541 1.326 147 HB2 LEU 20 2HB LEU 20 -17.908 26.505 1.387 148 HB3 LEU 20 1HB LEU 20 -19.313 25.638 0.820 149 HG LEU 20 HG LEU 20 -18.135 28.112 -0.426 150 HD11 LEU 20 1HD1 LEU 20 -17.729 26.633 -2.336 151 HD12 LEU 20 2HD1 LEU 20 -18.335 25.267 -1.400 152 HD13 LEU 20 3HD1 LEU 20 -16.867 26.102 -0.893 153 HD21 LEU 20 3HD2 LEU 20 -20.549 26.517 -1.281 154 HD22 LEU 20 1HD2 LEU 20 -19.844 27.888 -2.136 155 HD23 LEU 20 2HD2 LEU 20 -20.588 28.123 -0.553 156 H GLY 21 HN GLY 21 -19.860 24.931 2.288 157 HA2 GLY 21 2HA GLY 21 -19.735 25.158 5.175 158 HA3 GLY 21 1HA GLY 21 -21.270 24.567 4.553 159 H THR 22 HN THR 22 -21.435 22.501 3.806 160 HA THR 22 HA THR 22 -19.080 20.810 4.263 161 HB THR 22 HB THR 22 -21.195 20.251 5.482 162 HG1 THR 22 1HG THR 22 -19.486 18.668 4.542 163 HG21 THR 22 3HG2 THR 22 -23.009 19.160 4.241 164 HG22 THR 22 1HG2 THR 22 -22.199 19.556 2.720 165 HG23 THR 22 2HG2 THR 22 -22.814 20.843 3.758 166 H GLU 23 HN GLU 23 -18.377 19.316 2.709 167 HA GLU 23 HA GLU 23 -19.588 19.093 0.133 168 HB2 GLU 23 2HB GLU 23 -18.651 21.363 -0.054 169 HB3 GLU 23 1HB GLU 23 -17.061 20.742 0.363 170 HG2 GLU 23 2HG GLU 23 -16.999 19.444 -1.670 171 HG3 GLU 23 1HG GLU 23 -18.639 19.954 -2.074 172 H ASN 24 HN ASN 24 -18.862 17.295 -0.878 173 HA ASN 24 HA ASN 24 -16.666 15.843 0.460 174 HB2 ASN 24 2HB ASN 24 -18.974 14.902 0.712 175 HB3 ASN 24 1HB ASN 24 -19.041 14.696 -1.034 176 HD21 ASN 24 1HD2 ASN 24 -18.048 12.971 -1.960 177 HD22 ASN 24 2HD2 ASN 24 -17.242 11.718 -1.072 178 H ALA 25 HN ALA 25 -17.001 17.660 -2.099 179 HA ALA 25 HA ALA 25 -16.530 16.194 -4.401 180 HB1 ALA 25 1HB ALA 25 -15.466 18.927 -3.716 181 HB2 ALA 25 2HB ALA 25 -17.050 18.574 -4.406 182 HB3 ALA 25 3HB ALA 25 -15.589 18.241 -5.336 183 H GLU 26 HN GLU 26 -14.210 17.300 -1.973 184 HA GLU 26 HA GLU 26 -11.854 16.671 -3.331 185 HB2 GLU 26 2HB GLU 26 -12.490 16.742 -0.409 186 HB3 GLU 26 1HB GLU 26 -10.868 16.460 -1.036 187 HG2 GLU 26 2HG GLU 26 -10.928 18.724 -0.621 188 HG3 GLU 26 1HG GLU 26 -11.177 18.609 -2.346 189 H LEU 27 HN LEU 27 -13.895 14.723 -1.246 190 HA LEU 27 HA LEU 27 -12.240 12.432 -1.210 191 HB2 LEU 27 2HB LEU 27 -15.154 12.880 -0.607 192 HB3 LEU 27 1HB LEU 27 -14.408 11.309 -0.485 193 HG LEU 27 HG LEU 27 -14.491 12.195 1.708 194 HD11 LEU 27 1HD1 LEU 27 -12.425 11.049 1.207 195 HD12 LEU 27 2HD1 LEU 27 -12.126 12.376 2.329 196 HD13 LEU 27 3HD1 LEU 27 -11.705 12.551 0.625 197 HD21 LEU 27 3HD2 LEU 27 -14.868 14.524 1.207 198 HD22 LEU 27 1HD2 LEU 27 -13.216 14.690 0.606 199 HD23 LEU 27 2HD2 LEU 27 -13.504 14.365 2.314 200 H VAL 28 HN VAL 28 -14.835 13.544 -3.291 201 HA VAL 28 HA VAL 28 -15.232 11.166 -4.748 202 HB VAL 28 HB VAL 28 -15.568 14.015 -5.706 203 HG11 VAL 28 1HG1 VAL 28 -15.508 12.421 -7.548 204 HG12 VAL 28 2HG1 VAL 28 -17.127 13.083 -7.334 205 HG13 VAL 28 3HG1 VAL 28 -16.757 11.455 -6.763 206 HG21 VAL 28 3HG2 VAL 28 -16.860 13.588 -3.699 207 HG22 VAL 28 1HG2 VAL 28 -17.544 12.134 -4.428 208 HG23 VAL 28 2HG2 VAL 28 -17.925 13.718 -5.100 209 H TYR 29 HN TYR 29 -12.909 13.788 -5.078 210 HA TYR 29 HA TYR 29 -11.804 12.940 -7.552 211 HB2 TYR 29 2HB TYR 29 -11.519 15.220 -6.544 212 HB3 TYR 29 1HB TYR 29 -10.436 14.514 -5.352 213 HD1 TYR 29 2HD TYR 29 -10.864 15.243 -8.949 214 HD2 TYR 29 1HD TYR 29 -8.157 14.058 -5.883 215 HE1 TYR 29 2HE TYR 29 -8.980 15.578 -10.493 216 HE2 TYR 29 1HE TYR 29 -6.265 14.388 -7.421 217 HH TYR 29 HH TYR 29 -6.567 16.033 -10.392 218 H VAL 30 HN VAL 30 -11.366 11.955 -4.256 219 HA VAL 30 HA VAL 30 -8.897 10.558 -4.648 220 HB VAL 30 HB VAL 30 -10.942 10.261 -2.441 221 HG11 VAL 30 1HG1 VAL 30 -9.465 8.326 -2.570 222 HG12 VAL 30 2HG1 VAL 30 -9.109 9.291 -1.136 223 HG13 VAL 30 3HG1 VAL 30 -8.056 9.389 -2.547 224 HG21 VAL 30 3HG2 VAL 30 -8.423 11.914 -2.542 225 HG22 VAL 30 1HG2 VAL 30 -9.475 11.719 -1.143 226 HG23 VAL 30 2HG2 VAL 30 -10.073 12.535 -2.587 227 H LEU 31 HN LEU 31 -12.301 9.739 -4.794 228 HA LEU 31 HA LEU 31 -12.063 6.925 -4.828 229 HB2 LEU 31 2HB LEU 31 -14.162 8.604 -6.196 230 HB3 LEU 31 1HB LEU 31 -14.306 6.919 -5.741 231 HG LEU 31 HG LEU 31 -14.033 9.202 -3.789 232 HD11 LEU 31 1HD1 LEU 31 -16.406 8.800 -3.326 233 HD12 LEU 31 2HD1 LEU 31 -16.459 7.628 -4.641 234 HD13 LEU 31 3HD1 LEU 31 -16.142 9.328 -4.987 235 HD21 LEU 31 3HD2 LEU 31 -13.174 7.065 -2.956 236 HD22 LEU 31 1HD2 LEU 31 -14.707 6.294 -3.364 237 HD23 LEU 31 2HD2 LEU 31 -14.652 7.540 -2.119 238 H ARG 32 HN ARG 32 -10.710 5.954 -6.287 239 HA ARG 32 HA ARG 32 -10.814 6.919 -9.043 240 HB2 ARG 32 2HB ARG 32 -8.593 6.556 -7.914 241 HB3 ARG 32 1HB ARG 32 -8.929 4.828 -7.959 242 HG2 ARG 32 2HG ARG 32 -8.991 4.834 -10.351 243 HG3 ARG 32 1HG ARG 32 -8.885 6.593 -10.395 244 HD2 ARG 32 2HD ARG 32 -6.649 6.425 -9.329 245 HD3 ARG 32 1HD ARG 32 -6.757 4.669 -9.467 246 HE ARG 32 HE ARG 32 -7.236 5.713 -11.994 247 HH11 ARG 32 1HH1 ARG 32 -4.599 5.631 -9.694 248 HH12 ARG 32 2HH1 ARG 32 -3.358 5.728 -10.908 249 HH21 ARG 32 1HH2 ARG 32 -5.625 5.875 -13.592 250 HH22 ARG 32 2HH2 ARG 32 -3.950 5.866 -13.129 251 H HIS 33 HN HIS 33 -10.228 3.537 -8.039 252 HA HIS 33 HA HIS 33 -12.721 2.549 -8.936 253 HB2 HIS 33 2HB HIS 33 -11.645 3.500 -11.074 254 HB3 HIS 33 1HB HIS 33 -10.548 2.127 -10.982 255 HD1 HIS 33 1HD HIS 33 -11.271 0.341 -12.509 256 HD2 HIS 33 2HD HIS 33 -14.513 2.357 -10.852 257 HE1 HIS 33 1HE HIS 33 -13.320 -0.753 -13.472 258 HE2 HIS 33 2HE HIS 33 -15.253 0.611 -12.611 259 H LYS 34 HN LYS 34 -10.699 2.040 -6.869 260 HA LYS 34 HA LYS 34 -9.910 0.279 -5.661 261 HB2 LYS 34 2HB LYS 34 -12.230 -0.564 -6.285 262 HB3 LYS 34 1HB LYS 34 -11.464 -1.482 -7.570 263 HG2 LYS 34 2HG LYS 34 -10.099 -2.635 -5.835 264 HG3 LYS 34 1HG LYS 34 -11.058 -1.806 -4.608 265 HD2 LYS 34 2HD LYS 34 -13.085 -2.855 -5.463 266 HD3 LYS 34 1HD LYS 34 -12.152 -3.649 -6.735 267 HE2 LYS 34 2HE LYS 34 -10.878 -4.867 -5.051 268 HE3 LYS 34 1HE LYS 34 -11.775 -4.056 -3.770 269 HZ1 LYS 34 3HZ LYS 34 -13.823 -5.069 -4.745 270 HZ2 LYS 34 1HZ LYS 34 -12.733 -6.181 -4.075 271 HZ3 LYS 34 2HZ LYS 34 -12.824 -5.996 -5.757 272 H HIS 35 HN HIS 35 -8.905 -2.129 -6.097 273 HA HIS 35 HA HIS 35 -7.646 -2.606 -8.579 274 HB2 HIS 35 2HB HIS 35 -6.221 -0.844 -6.845 275 HB3 HIS 35 1HB HIS 35 -5.357 -2.379 -6.893 276 HD1 HIS 35 1HD HIS 35 -6.834 0.114 -9.357 277 HD2 HIS 35 2HD HIS 35 -3.728 -2.634 -9.067 278 HE1 HIS 35 1HE HIS 35 -5.494 0.380 -11.470 279 HE2 HIS 35 2HE HIS 35 -3.730 -1.415 -11.358 280 H GLY 36 HN GLY 36 -5.566 -4.226 -7.851 281 HA2 GLY 36 2HA GLY 36 -6.971 -6.554 -7.096 282 HA3 GLY 36 1HA GLY 36 -5.239 -6.431 -7.344 283 H GLN 37 HN GLN 37 -5.809 -8.135 -5.530 284 HA GLN 37 HA GLN 37 -6.362 -7.136 -2.925 285 HB2 GLN 37 2HB GLN 37 -5.117 -9.768 -3.729 286 HB3 GLN 37 1HB GLN 37 -5.785 -9.385 -2.150 287 HG2 GLN 37 2HG GLN 37 -7.997 -9.073 -3.202 288 HG3 GLN 37 1HG GLN 37 -7.300 -9.573 -4.742 289 HE21 GLN 37 1HE2 GLN 37 -6.445 -10.957 -1.639 290 HE22 GLN 37 2HE2 GLN 37 -7.123 -12.519 -1.942 291 H PHE 38 HN PHE 38 -3.403 -8.894 -3.850 292 HA PHE 38 HA PHE 38 -1.965 -7.382 -1.804 293 HB2 PHE 38 2HB PHE 38 -1.314 -9.919 -3.301 294 HB3 PHE 38 1HB PHE 38 -0.160 -9.114 -2.246 295 HD1 PHE 38 1HD PHE 38 -3.405 -10.873 -2.341 296 HD2 PHE 38 2HD PHE 38 -0.282 -9.322 0.097 297 HE1 PHE 38 1HE PHE 38 -4.321 -12.084 -0.402 298 HE2 PHE 38 2HE PHE 38 -1.190 -10.529 2.037 299 HZ PHE 38 HZ PHE 38 -3.209 -11.911 1.790 300 H ILE 39 HN ILE 39 -1.218 -5.493 -2.575 301 HA ILE 39 HA ILE 39 0.531 -5.621 -4.934 302 HB ILE 39 HB ILE 39 -1.563 -3.493 -4.454 303 HG12 ILE 39 2HG1 ILE 39 -1.235 -5.502 -6.696 304 HG13 ILE 39 1HG1 ILE 39 -2.445 -5.579 -5.422 305 HG21 ILE 39 1HG2 ILE 39 -0.764 -2.465 -6.524 306 HG22 ILE 39 2HG2 ILE 39 0.519 -3.672 -6.630 307 HG23 ILE 39 3HG2 ILE 39 0.506 -2.512 -5.300 308 HD11 ILE 39 3HD1 ILE 39 -3.413 -4.752 -7.473 309 HD12 ILE 39 1HD1 ILE 39 -2.223 -3.451 -7.534 310 HD13 ILE 39 2HD1 ILE 39 -3.422 -3.489 -6.242 311 H TYR 40 HN TYR 40 2.434 -4.685 -4.640 312 HA TYR 40 HA TYR 40 2.773 -2.795 -2.409 313 HB2 TYR 40 2HB TYR 40 4.266 -4.770 -2.391 314 HB3 TYR 40 1HB TYR 40 4.857 -4.333 -3.989 315 HD1 TYR 40 1HD TYR 40 6.297 -2.344 -4.277 316 HD2 TYR 40 2HD TYR 40 5.060 -3.649 -0.422 317 HE1 TYR 40 1HE TYR 40 8.056 -0.968 -3.250 318 HE2 TYR 40 2HE TYR 40 6.810 -2.269 0.613 319 HH TYR 40 HH TYR 40 8.467 0.131 -1.044 320 H VAL 41 HN VAL 41 2.944 -0.691 -2.899 321 HA VAL 41 HA VAL 41 3.799 0.021 -5.629 322 HB VAL 41 HB VAL 41 2.294 2.049 -5.412 323 HG11 VAL 41 1HG1 VAL 41 1.012 -0.678 -5.487 324 HG12 VAL 41 2HG1 VAL 41 1.741 0.167 -6.852 325 HG13 VAL 41 3HG1 VAL 41 0.285 0.810 -6.093 326 HG21 VAL 41 3HG2 VAL 41 1.090 0.409 -3.182 327 HG22 VAL 41 1HG2 VAL 41 0.377 1.860 -3.890 328 HG23 VAL 41 2HG2 VAL 41 1.899 1.965 -3.005 329 H TRP 42 HN TRP 42 5.735 0.905 -5.494 330 HA TRP 42 HA TRP 42 6.255 2.771 -3.283 331 HB2 TRP 42 2HB TRP 42 8.662 2.285 -3.604 332 HB3 TRP 42 1HB TRP 42 7.740 0.851 -3.175 333 HD1 TRP 42 1HD TRP 42 7.015 -0.685 -5.520 334 HE1 TRP 42 1HE TRP 42 8.586 -1.336 -7.453 335 HE3 TRP 42 3HE TRP 42 10.627 2.875 -4.863 336 HZ2 TRP 42 2HZ TRP 42 11.028 -0.455 -8.553 337 HZ3 TRP 42 3HZ TRP 42 12.548 2.900 -6.401 338 HH2 TRP 42 2HH TRP 42 12.745 1.268 -8.207 339 H GLY 43 HN GLY 43 6.820 2.210 -6.740 340 HA2 GLY 43 2HA GLY 43 6.770 3.799 -8.451 341 HA3 GLY 43 1HA GLY 43 6.654 5.065 -7.235 342 H GLU 44 HN GLU 44 8.529 4.224 -9.639 343 HA GLU 44 HA GLU 44 11.076 3.812 -8.480 344 HB2 GLU 44 2HB GLU 44 10.473 3.164 -10.797 345 HB3 GLU 44 1HB GLU 44 10.429 4.864 -11.236 346 HG2 GLU 44 2HG GLU 44 12.758 5.111 -10.876 347 HG3 GLU 44 1HG GLU 44 12.873 3.520 -10.124 348 H GLU 45 HN GLU 45 9.471 6.724 -9.746 349 HA GLU 45 HA GLU 45 11.602 8.364 -8.582 350 HB2 GLU 45 2HB GLU 45 9.183 9.213 -10.195 351 HB3 GLU 45 1HB GLU 45 10.496 10.259 -9.681 352 HG2 GLU 45 2HG GLU 45 11.298 9.869 -11.729 353 HG3 GLU 45 1HG GLU 45 11.869 8.356 -11.026 354 H GLY 46 HN GLY 46 9.307 6.791 -7.212 355 HA2 GLY 46 2HA GLY 46 8.520 7.257 -5.010 356 HA3 GLY 46 1HA GLY 46 8.532 8.973 -5.400 357 H ALA 47 HN ALA 47 6.467 9.561 -5.088 358 HA ALA 47 HA ALA 47 4.330 10.007 -5.697 359 HB1 ALA 47 1HB ALA 47 5.033 9.647 -8.023 360 HB2 ALA 47 2HB ALA 47 3.366 9.154 -7.732 361 HB3 ALA 47 3HB ALA 47 4.635 7.936 -7.864 362 H GLY 48 HN GLY 48 5.255 6.667 -5.197 363 HA2 GLY 48 2HA GLY 48 2.613 5.702 -4.710 364 HA3 GLY 48 1HA GLY 48 4.109 4.905 -4.248 365 H LYS 49 HN LYS 49 4.803 7.545 -2.864 366 HA LYS 49 HA LYS 49 4.357 6.716 -0.273 367 HB2 LYS 49 2HB LYS 49 6.116 8.271 -0.848 368 HB3 LYS 49 1HB LYS 49 4.938 9.486 -1.321 369 HG2 LYS 49 2HG LYS 49 5.905 9.986 0.851 370 HG3 LYS 49 1HG LYS 49 4.175 9.667 0.979 371 HD2 LYS 49 2HD LYS 49 4.680 7.364 1.699 372 HD3 LYS 49 1HD LYS 49 6.403 7.741 1.634 373 HE2 LYS 49 2HE LYS 49 6.138 9.423 3.348 374 HE3 LYS 49 1HE LYS 49 4.391 9.177 3.356 375 HZ1 LYS 49 3HZ LYS 49 5.464 8.033 5.190 376 HZ2 LYS 49 1HZ LYS 49 6.421 7.143 4.104 377 HZ3 LYS 49 2HZ LYS 49 4.735 6.924 4.127 378 H SER 50 HN SER 50 2.328 6.264 0.355 379 HA SER 50 HA SER 50 0.497 6.658 1.601 380 HB2 SER 50 2HB SER 50 1.297 9.566 1.434 381 HB3 SER 50 1HB SER 50 0.114 8.886 2.551 382 HG SER 50 HG SER 50 2.258 7.422 2.867 383 H HIS 51 HN HIS 51 0.553 9.403 -0.709 384 HA HIS 51 HA HIS 51 -2.231 9.704 -0.646 385 HB2 HIS 51 2HB HIS 51 -2.013 11.283 -2.475 386 HB3 HIS 51 1HB HIS 51 -0.771 11.549 -1.266 387 HD1 HIS 51 1HD HIS 51 1.682 11.148 -1.983 388 HD2 HIS 51 2HD HIS 51 -1.104 10.530 -5.004 389 HE1 HIS 51 1HE HIS 51 2.998 11.133 -4.121 390 HE2 HIS 51 2HE HIS 51 1.274 10.934 -5.950 391 H LEU 52 HN LEU 52 -0.286 7.652 -2.690 392 HA LEU 52 HA LEU 52 -2.284 7.256 -4.667 393 HB2 LEU 52 2HB LEU 52 0.007 6.887 -5.222 394 HB3 LEU 52 1HB LEU 52 0.218 5.771 -3.888 395 HG LEU 52 HG LEU 52 -1.332 4.215 -5.006 396 HD11 LEU 52 1HD1 LEU 52 -2.579 5.776 -6.378 397 HD12 LEU 52 2HD1 LEU 52 -1.822 4.551 -7.396 398 HD13 LEU 52 3HD1 LEU 52 -1.122 6.167 -7.292 399 HD21 LEU 52 3HD2 LEU 52 1.115 5.039 -6.555 400 HD22 LEU 52 1HD2 LEU 52 0.270 3.502 -6.742 401 HD23 LEU 52 2HD2 LEU 52 1.050 3.900 -5.211 402 H LEU 53 HN LEU 53 -1.593 5.867 -1.545 403 HA LEU 53 HA LEU 53 -3.021 3.425 -1.947 404 HB2 LEU 53 2HB LEU 53 -1.961 4.804 0.507 405 HB3 LEU 53 1HB LEU 53 -2.879 3.314 0.605 406 HG LEU 53 HG LEU 53 -1.129 2.273 -0.906 407 HD11 LEU 53 1HD1 LEU 53 1.047 3.334 -1.008 408 HD12 LEU 53 2HD1 LEU 53 0.416 4.753 -0.170 409 HD13 LEU 53 3HD1 LEU 53 -0.174 4.346 -1.782 410 HD21 LEU 53 3HD2 LEU 53 -0.277 3.280 1.806 411 HD22 LEU 53 1HD2 LEU 53 0.464 1.941 0.928 412 HD23 LEU 53 2HD2 LEU 53 -1.207 1.819 1.475 413 H GLN 54 HN GLN 54 -3.864 6.603 -0.737 414 HA GLN 54 HA GLN 54 -6.172 5.886 0.708 415 HB2 GLN 54 2HB GLN 54 -6.726 8.223 0.720 416 HB3 GLN 54 1HB GLN 54 -4.992 8.058 0.917 417 HG2 GLN 54 2HG GLN 54 -4.729 8.556 -1.495 418 HG3 GLN 54 1HG GLN 54 -6.463 8.863 -1.571 419 HE21 GLN 54 1HE2 GLN 54 -6.185 11.003 -2.160 420 HE22 GLN 54 2HE2 GLN 54 -5.634 12.203 -1.044 421 H ALA 55 HN ALA 55 -5.661 6.679 -2.645 422 HA ALA 55 HA ALA 55 -8.324 6.983 -3.474 423 HB1 ALA 55 1HB ALA 55 -6.419 7.651 -4.844 424 HB2 ALA 55 2HB ALA 55 -7.487 6.564 -5.734 425 HB3 ALA 55 3HB ALA 55 -5.972 5.959 -5.062 426 H TRP 56 HN TRP 56 -6.460 4.163 -2.764 427 HA TRP 56 HA TRP 56 -8.290 2.324 -4.052 428 HB2 TRP 56 2HB TRP 56 -5.905 1.832 -4.011 429 HB3 TRP 56 1HB TRP 56 -5.891 1.909 -2.257 430 HD1 TRP 56 1HD TRP 56 -7.382 -0.295 -5.076 431 HE1 TRP 56 1HE TRP 56 -7.532 -2.710 -4.180 432 HE3 TRP 56 3HE TRP 56 -5.889 0.531 -0.254 433 HZ2 TRP 56 2HZ TRP 56 -7.083 -4.069 -1.751 434 HZ3 TRP 56 3HZ TRP 56 -5.776 -1.376 1.292 435 HH2 TRP 56 2HH TRP 56 -6.363 -3.632 0.556 436 H VAL 57 HN VAL 57 -7.458 3.393 -0.808 437 HA VAL 57 HA VAL 57 -9.099 1.530 0.566 438 HB VAL 57 HB VAL 57 -8.025 4.190 1.513 439 HG11 VAL 57 1HG1 VAL 57 -8.305 3.268 3.773 440 HG12 VAL 57 2HG1 VAL 57 -9.095 1.849 3.085 441 HG13 VAL 57 3HG1 VAL 57 -9.845 3.437 2.932 442 HG21 VAL 57 3HG2 VAL 57 -6.253 2.689 0.783 443 HG22 VAL 57 1HG2 VAL 57 -6.901 1.408 1.810 444 HG23 VAL 57 2HG2 VAL 57 -6.241 2.872 2.535 445 H ALA 58 HN ALA 58 -9.558 4.983 -0.232 446 HA ALA 58 HA ALA 58 -12.002 5.246 1.146 447 HB1 ALA 58 1HB ALA 58 -10.612 7.149 0.500 448 HB2 ALA 58 2HB ALA 58 -12.268 7.331 -0.081 449 HB3 ALA 58 3HB ALA 58 -10.988 6.849 -1.196 450 H GLN 59 HN GLN 59 -11.262 4.264 -2.151 451 HA GLN 59 HA GLN 59 -13.930 4.443 -3.117 452 HB2 GLN 59 2HB GLN 59 -11.741 4.333 -4.467 453 HB3 GLN 59 1HB GLN 59 -11.815 2.597 -4.214 454 HG2 GLN 59 2HG GLN 59 -14.103 4.098 -5.435 455 HG3 GLN 59 1HG GLN 59 -12.735 3.549 -6.399 456 HE21 GLN 59 1HE2 GLN 59 -15.559 2.800 -6.493 457 HE22 GLN 59 2HE2 GLN 59 -15.592 1.079 -6.286 458 H ALA 60 HN ALA 60 -11.991 1.838 -1.729 459 HA ALA 60 HA ALA 60 -13.927 -0.209 -2.052 460 HB1 ALA 60 1HB ALA 60 -12.546 -1.490 -0.523 461 HB2 ALA 60 2HB ALA 60 -11.673 -0.032 -0.059 462 HB3 ALA 60 3HB ALA 60 -11.534 -0.655 -1.703 463 H LEU 61 HN LEU 61 -13.263 2.136 0.465 464 HA LEU 61 HA LEU 61 -14.896 1.116 2.490 465 HB2 LEU 61 2HB LEU 61 -13.906 3.852 1.787 466 HB3 LEU 61 1HB LEU 61 -15.067 3.660 3.084 467 HG LEU 61 HG LEU 61 -12.371 2.302 2.985 468 HD11 LEU 61 1HD1 LEU 61 -13.292 4.702 4.566 469 HD12 LEU 61 2HD1 LEU 61 -12.137 4.718 3.233 470 HD13 LEU 61 3HD1 LEU 61 -11.736 3.888 4.738 471 HD21 LEU 61 3HD2 LEU 61 -12.850 1.777 5.332 472 HD22 LEU 61 1HD2 LEU 61 -14.037 1.054 4.245 473 HD23 LEU 61 2HD2 LEU 61 -14.449 2.502 5.162 474 H GLU 62 HN GLU 62 -15.674 3.501 -0.063 475 HA GLU 62 HA GLU 62 -18.417 3.585 0.787 476 HB2 GLU 62 2HB GLU 62 -17.126 4.738 -1.675 477 HB3 GLU 62 1HB GLU 62 -18.784 5.039 -1.162 478 HG2 GLU 62 2HG GLU 62 -17.740 5.798 1.050 479 HG3 GLU 62 1HG GLU 62 -16.241 5.871 0.136 480 H ALA 63 HN ALA 63 -16.604 1.524 -1.140 481 HA ALA 63 HA ALA 63 -18.725 0.552 -2.797 482 HB1 ALA 63 1HB ALA 63 -16.166 -0.820 -1.968 483 HB2 ALA 63 2HB ALA 63 -16.366 0.215 -3.383 484 HB3 ALA 63 3HB ALA 63 -17.235 -1.316 -3.282 485 H GLY 64 HN GLY 64 -18.052 0.329 0.503 486 HA2 GLY 64 2HA GLY 64 -19.746 -0.515 1.958 487 HA3 GLY 64 1HA GLY 64 -20.157 -1.710 0.737 488 H LYS 65 HN LYS 65 -16.812 -1.437 1.092 489 HA LYS 65 HA LYS 65 -16.808 -3.850 2.765 490 HB2 LYS 65 2HB LYS 65 -14.609 -3.020 0.874 491 HB3 LYS 65 1HB LYS 65 -14.850 -4.587 1.628 492 HG2 LYS 65 2HG LYS 65 -16.508 -3.348 -0.554 493 HG3 LYS 65 1HG LYS 65 -15.435 -4.741 -0.685 494 HD2 LYS 65 2HD LYS 65 -16.878 -6.041 0.752 495 HD3 LYS 65 1HD LYS 65 -17.901 -4.634 1.052 496 HE2 LYS 65 2HE LYS 65 -18.351 -4.563 -1.418 497 HE3 LYS 65 1HE LYS 65 -17.521 -6.113 -1.545 498 HZ1 LYS 65 3HZ LYS 65 -19.975 -5.547 0.029 499 HZ2 LYS 65 1HZ LYS 65 -19.154 -7.032 0.029 500 HZ3 LYS 65 2HZ LYS 65 -19.879 -6.462 -1.395 501 H ASN 66 HN ASN 66 -15.025 -4.058 4.256 502 HA ASN 66 HA ASN 66 -14.548 -1.510 5.542 503 HB2 ASN 66 2HB ASN 66 -15.098 -3.822 6.655 504 HB3 ASN 66 1HB ASN 66 -13.367 -4.072 6.535 505 HD21 ASN 66 1HD2 ASN 66 -13.341 -4.122 8.850 506 HD22 ASN 66 2HD2 ASN 66 -13.359 -2.642 9.745 507 H ALA 67 HN ALA 67 -12.680 -0.434 5.661 508 HA ALA 67 HA ALA 67 -10.201 -1.586 4.695 509 HB1 ALA 67 1HB ALA 67 -11.261 -0.915 2.617 510 HB2 ALA 67 2HB ALA 67 -9.896 0.147 2.964 511 HB3 ALA 67 3HB ALA 67 -11.544 0.703 3.256 512 H ALA 68 HN ALA 68 -8.391 -0.412 5.312 513 HA ALA 68 HA ALA 68 -8.674 2.214 6.492 514 HB1 ALA 68 1HB ALA 68 -7.783 -0.128 8.174 515 HB2 ALA 68 2HB ALA 68 -9.274 0.792 8.378 516 HB3 ALA 68 3HB ALA 68 -7.715 1.567 8.658 517 H TYR 69 HN TYR 69 -6.705 3.324 6.591 518 HA TYR 69 HA TYR 69 -4.394 1.820 5.597 519 HB2 TYR 69 2HB TYR 69 -3.618 3.771 4.423 520 HB3 TYR 69 1HB TYR 69 -5.266 3.447 3.926 521 HD1 TYR 69 2HD TYR 69 -7.080 4.973 4.580 522 HD2 TYR 69 1HD TYR 69 -3.033 5.769 5.628 523 HE1 TYR 69 2HE TYR 69 -7.671 7.311 5.069 524 HE2 TYR 69 1HE TYR 69 -3.613 8.105 6.116 525 HH TYR 69 HH TYR 69 -6.800 9.197 6.434 526 H ILE 70 HN ILE 70 -2.495 2.083 6.621 527 HA ILE 70 HA ILE 70 -2.351 4.010 8.827 528 HB ILE 70 HB ILE 70 -1.673 1.072 9.041 529 HG12 ILE 70 2HG1 ILE 70 -3.674 2.763 10.553 530 HG13 ILE 70 1HG1 ILE 70 -4.073 1.610 9.290 531 HG21 ILE 70 1HG2 ILE 70 -1.003 1.555 11.349 532 HG22 ILE 70 2HG2 ILE 70 -1.238 3.278 11.049 533 HG23 ILE 70 3HG2 ILE 70 0.016 2.395 10.180 534 HD11 ILE 70 3HD1 ILE 70 -4.520 0.649 11.442 535 HD12 ILE 70 1HD1 ILE 70 -2.873 0.983 11.973 536 HD13 ILE 70 2HD1 ILE 70 -3.164 -0.198 10.696 537 H ASP 71 HN ASP 71 -0.598 5.192 8.609 538 HA ASP 71 HA ASP 71 1.739 4.056 7.234 539 HB2 ASP 71 2HB ASP 71 2.386 6.300 6.639 540 HB3 ASP 71 1HB ASP 71 0.717 6.061 6.170 541 H ALA 72 HN ALA 72 3.204 3.361 8.451 542 HA ALA 72 HA ALA 72 2.988 3.177 11.157 543 HB1 ALA 72 1HB ALA 72 5.227 2.253 11.169 544 HB2 ALA 72 2HB ALA 72 5.527 2.934 9.570 545 HB3 ALA 72 3HB ALA 72 4.309 1.675 9.778 546 H ALA 73 HN ALA 73 4.670 5.750 9.425 547 HA ALA 73 HA ALA 73 6.039 6.492 11.902 548 HB1 ALA 73 1HB ALA 73 6.204 7.857 9.229 549 HB2 ALA 73 2HB ALA 73 7.271 6.568 9.782 550 HB3 ALA 73 3HB ALA 73 7.257 8.119 10.621 551 H SER 74 HN SER 74 3.027 7.107 10.776 552 HA SER 74 HA SER 74 2.953 9.622 12.303 553 HB2 SER 74 2HB SER 74 2.684 10.099 9.897 554 HB3 SER 74 1HB SER 74 1.317 8.990 9.836 555 HG SER 74 HG SER 74 0.233 10.740 10.249 556 H MET 75 HN MET 75 1.473 6.588 11.479 557 HA MET 75 HA MET 75 -0.277 6.887 13.817 558 HB2 MET 75 2HB MET 75 -1.066 5.779 11.115 559 HB3 MET 75 1HB MET 75 -2.026 5.575 12.572 560 HG2 MET 75 2HG MET 75 -2.139 8.057 12.753 561 HG3 MET 75 1HG MET 75 -1.351 8.152 11.180 562 HE1 MET 75 3HE MET 75 -2.420 7.271 8.933 563 HE2 MET 75 1HE MET 75 -3.993 6.483 8.824 564 HE3 MET 75 2HE MET 75 -2.656 5.671 9.639 565 HA PRO 76 HA PRO 76 1.518 2.968 14.782 566 HB2 PRO 76 2HB PRO 76 -0.019 2.290 16.882 567 HB3 PRO 76 1HB PRO 76 1.170 3.593 16.963 568 HG2 PRO 76 2HG PRO 76 -1.792 3.739 16.693 569 HG3 PRO 76 1HG PRO 76 -0.692 4.809 17.576 570 HD2 PRO 76 2HD PRO 76 -1.784 5.329 15.073 571 HD3 PRO 76 1HD PRO 76 -0.352 6.126 15.752 572 H LEU 77 HN LEU 77 1.178 0.768 14.606 573 HA LEU 77 HA LEU 77 -1.224 0.001 13.144 574 HB2 LEU 77 2HB LEU 77 1.027 -0.739 12.391 575 HB3 LEU 77 1HB LEU 77 1.202 -1.651 13.878 576 HG LEU 77 HG LEU 77 -0.705 -3.072 13.229 577 HD11 LEU 77 1HD1 LEU 77 -0.645 -1.485 10.664 578 HD12 LEU 77 2HD1 LEU 77 -1.930 -1.464 11.872 579 HD13 LEU 77 3HD1 LEU 77 -1.604 -2.936 10.958 580 HD21 LEU 77 3HD2 LEU 77 0.417 -4.279 11.448 581 HD22 LEU 77 1HD2 LEU 77 1.582 -3.716 12.645 582 HD23 LEU 77 2HD2 LEU 77 1.423 -2.870 11.106 583 H THR 78 HN THR 78 -2.696 -1.548 13.863 584 HA THR 78 HA THR 78 -2.516 -2.305 16.684 585 HB THR 78 HB THR 78 -4.998 -1.762 16.849 586 HG1 THR 78 1HG THR 78 -4.676 0.161 14.866 587 HG21 THR 78 3HG2 THR 78 -4.608 0.618 17.316 588 HG22 THR 78 1HG2 THR 78 -3.071 0.531 16.457 589 HG23 THR 78 2HG2 THR 78 -3.302 -0.386 17.945 590 H ASP 79 HN ASP 79 -3.991 -4.025 17.273 591 HA ASP 79 HA ASP 79 -4.148 -6.072 15.288 592 HB2 ASP 79 2HB ASP 79 -5.033 -7.472 17.045 593 HB3 ASP 79 1HB ASP 79 -3.721 -6.510 17.712 594 H ALA 80 HN ALA 80 -6.161 -3.510 16.170 595 HA ALA 80 HA ALA 80 -8.712 -4.513 15.585 596 HB1 ALA 80 1HB ALA 80 -7.673 -1.721 15.119 597 HB2 ALA 80 2HB ALA 80 -8.313 -2.335 16.643 598 HB3 ALA 80 3HB ALA 80 -9.365 -2.203 15.237 599 H ALA 81 HN ALA 81 -6.036 -3.737 13.544 600 HA ALA 81 HA ALA 81 -7.274 -3.119 11.133 601 HB1 ALA 81 1HB ALA 81 -4.705 -4.644 11.533 602 HB2 ALA 81 2HB ALA 81 -4.871 -2.888 11.539 603 HB3 ALA 81 3HB ALA 81 -5.201 -3.800 10.064 604 H PHE 82 HN PHE 82 -7.106 -6.161 12.770 605 HA PHE 82 HA PHE 82 -7.418 -7.860 10.522 606 HB2 PHE 82 2HB PHE 82 -7.962 -8.238 13.460 607 HB3 PHE 82 1HB PHE 82 -8.264 -9.505 12.281 608 HD1 PHE 82 2HD PHE 82 -6.386 -10.497 11.026 609 HD2 PHE 82 1HD PHE 82 -5.759 -7.715 14.178 610 HE1 PHE 82 2HE PHE 82 -4.037 -11.210 11.184 611 HE2 PHE 82 1HE PHE 82 -3.409 -8.422 14.342 612 HZ PHE 82 HZ PHE 82 -2.547 -10.173 12.842 613 H GLU 83 HN GLU 83 -9.572 -5.719 12.022 614 HA GLU 83 HA GLU 83 -11.992 -7.151 11.451 615 HB2 GLU 83 2HB GLU 83 -11.536 -4.229 12.038 616 HB3 GLU 83 1HB GLU 83 -13.096 -5.028 11.998 617 HG2 GLU 83 2HG GLU 83 -12.355 -6.482 13.847 618 HG3 GLU 83 1HG GLU 83 -10.855 -5.564 13.921 619 H ALA 84 HN ALA 84 -9.872 -5.111 9.701 620 HA ALA 84 HA ALA 84 -11.863 -4.441 7.693 621 HB1 ALA 84 1HB ALA 84 -8.944 -3.686 7.829 622 HB2 ALA 84 2HB ALA 84 -10.278 -2.711 8.451 623 HB3 ALA 84 3HB ALA 84 -10.149 -3.032 6.721 624 H GLU 85 HN GLU 85 -11.744 -5.087 5.568 625 HA GLU 85 HA GLU 85 -10.242 -7.549 5.102 626 HB2 GLU 85 2HB GLU 85 -12.745 -7.071 4.500 627 HB3 GLU 85 1HB GLU 85 -12.062 -6.272 3.094 628 HG2 GLU 85 2HG GLU 85 -12.635 -8.500 2.485 629 HG3 GLU 85 1HG GLU 85 -10.877 -8.373 2.532 630 H TYR 86 HN TYR 86 -10.305 -4.213 4.216 631 HA TYR 86 HA TYR 86 -8.128 -4.614 2.273 632 HB2 TYR 86 2HB TYR 86 -10.086 -2.324 2.569 633 HB3 TYR 86 1HB TYR 86 -8.745 -2.341 1.435 634 HD1 TYR 86 2HD TYR 86 -11.680 -4.484 2.354 635 HD2 TYR 86 1HD TYR 86 -9.220 -2.914 -0.743 636 HE1 TYR 86 2HE TYR 86 -13.122 -5.549 0.675 637 HE2 TYR 86 1HE TYR 86 -10.654 -3.981 -2.429 638 HH TYR 86 HH TYR 86 -13.696 -5.369 -1.669 639 H LEU 87 HN LEU 87 -6.212 -4.327 3.266 640 HA LEU 87 HA LEU 87 -5.993 -2.091 5.181 641 HB2 LEU 87 2HB LEU 87 -4.578 -4.744 5.118 642 HB3 LEU 87 1HB LEU 87 -3.931 -3.380 6.003 643 HG LEU 87 HG LEU 87 -5.055 -4.742 7.570 644 HD11 LEU 87 1HD1 LEU 87 -5.424 -2.365 7.872 645 HD12 LEU 87 2HD1 LEU 87 -6.826 -3.294 8.406 646 HD13 LEU 87 3HD1 LEU 87 -6.867 -2.445 6.860 647 HD21 LEU 87 3HD2 LEU 87 -7.421 -5.392 7.321 648 HD22 LEU 87 1HD2 LEU 87 -6.378 -6.093 6.082 649 HD23 LEU 87 2HD2 LEU 87 -7.408 -4.716 5.691 650 H ALA 88 HN ALA 88 -4.780 -0.466 4.583 651 HA ALA 88 HA ALA 88 -2.666 -0.945 2.579 652 HB1 ALA 88 1HB ALA 88 -2.908 1.391 1.912 653 HB2 ALA 88 2HB ALA 88 -4.156 1.622 3.136 654 HB3 ALA 88 3HB ALA 88 -4.449 0.546 1.770 655 H VAL 89 HN VAL 89 -0.755 -1.049 3.545 656 HA VAL 89 HA VAL 89 -0.299 0.611 5.937 657 HB VAL 89 HB VAL 89 1.111 -1.964 5.216 658 HG11 VAL 89 1HG1 VAL 89 1.980 -1.857 7.505 659 HG12 VAL 89 2HG1 VAL 89 1.165 -0.310 7.739 660 HG13 VAL 89 3HG1 VAL 89 2.468 -0.449 6.560 661 HG21 VAL 89 3HG2 VAL 89 -0.175 -2.978 7.054 662 HG22 VAL 89 1HG2 VAL 89 -1.218 -2.413 5.748 663 HG23 VAL 89 2HG2 VAL 89 -1.080 -1.474 7.234 664 H ASP 90 HN ASP 90 1.013 2.261 5.615 665 HA ASP 90 HA ASP 90 2.924 2.131 3.397 666 HB2 ASP 90 2HB ASP 90 1.348 4.025 3.356 667 HB3 ASP 90 1HB ASP 90 1.939 4.548 4.931 668 H GLN 91 HN GLN 91 5.041 2.973 3.703 669 HA GLN 91 HA GLN 91 7.061 2.571 4.620 670 HB2 GLN 91 2HB GLN 91 7.535 3.986 6.627 671 HB3 GLN 91 1HB GLN 91 6.837 4.826 5.264 672 HG2 GLN 91 2HG GLN 91 4.604 4.545 6.482 673 HG3 GLN 91 1HG GLN 91 5.601 4.178 7.895 674 HE21 GLN 91 1HE2 GLN 91 3.859 6.472 7.446 675 HE22 GLN 91 2HE2 GLN 91 4.859 7.873 7.558 676 H VAL 92 HN VAL 92 6.120 0.315 4.854 677 HA VAL 92 HA VAL 92 5.694 -0.779 7.442 678 HB VAL 92 HB VAL 92 6.738 -2.170 4.967 679 HG11 VAL 92 1HG1 VAL 92 5.253 -3.277 7.341 680 HG12 VAL 92 2HG1 VAL 92 6.972 -3.491 7.009 681 HG13 VAL 92 3HG1 VAL 92 5.771 -4.185 5.920 682 HG21 VAL 92 3HG2 VAL 92 4.385 -2.733 4.522 683 HG22 VAL 92 1HG2 VAL 92 4.700 -1.000 4.432 684 HG23 VAL 92 2HG2 VAL 92 3.903 -1.680 5.852 685 H GLU 93 HN GLU 93 8.443 0.059 5.584 686 HA GLU 93 HA GLU 93 10.442 -1.426 6.891 687 HB2 GLU 93 2HB GLU 93 11.949 0.369 5.936 688 HB3 GLU 93 1HB GLU 93 10.928 -0.471 4.774 689 HG2 GLU 93 2HG GLU 93 9.328 1.426 4.889 690 HG3 GLU 93 1HG GLU 93 10.468 2.270 5.935 691 H LYS 94 HN LYS 94 8.504 1.064 8.077 692 HA LYS 94 HA LYS 94 10.569 1.968 9.956 693 HB2 LYS 94 2HB LYS 94 8.005 3.402 9.344 694 HB3 LYS 94 1HB LYS 94 9.444 4.034 10.089 695 HG2 LYS 94 2HG LYS 94 9.235 3.146 7.251 696 HG3 LYS 94 1HG LYS 94 9.036 4.806 7.807 697 HD2 LYS 94 2HD LYS 94 11.341 4.593 8.822 698 HD3 LYS 94 1HD LYS 94 11.502 3.100 7.878 699 HE2 LYS 94 2HE LYS 94 10.791 4.409 5.896 700 HE3 LYS 94 1HE LYS 94 10.934 5.857 6.877 701 HZ1 LYS 94 3HZ LYS 94 13.139 3.972 6.222 702 HZ2 LYS 94 1HZ LYS 94 13.288 5.333 7.224 703 HZ3 LYS 94 2HZ LYS 94 12.935 5.525 5.577 704 H LEU 95 HN LEU 95 8.390 -0.334 9.967 705 HA LEU 95 HA LEU 95 6.575 0.247 12.038 706 HB2 LEU 95 2HB LEU 95 7.680 -2.348 11.000 707 HB3 LEU 95 1HB LEU 95 6.496 -2.287 12.289 708 HG LEU 95 HG LEU 95 6.094 -1.252 9.481 709 HD11 LEU 95 1HD1 LEU 95 4.518 -3.106 9.282 710 HD12 LEU 95 2HD1 LEU 95 4.948 -3.651 10.903 711 HD13 LEU 95 3HD1 LEU 95 6.151 -3.687 9.612 712 HD21 LEU 95 3HD2 LEU 95 4.198 -1.389 11.825 713 HD22 LEU 95 1HD2 LEU 95 3.756 -0.953 10.174 714 HD23 LEU 95 2HD2 LEU 95 4.852 0.076 11.094 715 H GLY 96 HN GLY 96 6.585 -0.121 14.227 716 HA2 GLY 96 2HA GLY 96 9.239 -0.131 15.424 717 HA3 GLY 96 1HA GLY 96 7.728 0.243 16.234 718 H ASN 97 HN ASN 97 9.362 -2.495 14.676 719 HA ASN 97 HA ASN 97 9.752 -4.625 15.282 720 HB2 ASN 97 2HB ASN 97 10.892 -3.520 17.158 721 HB3 ASN 97 1HB ASN 97 9.407 -3.605 18.101 722 HD21 ASN 97 1HD2 ASN 97 8.907 -5.445 19.153 723 HD22 ASN 97 2HD2 ASN 97 9.870 -6.890 19.107 724 H GLU 98 HN GLU 98 7.450 -3.996 17.957 725 HA GLU 98 HA GLU 98 6.174 -6.471 17.754 726 HB2 GLU 98 2HB GLU 98 4.885 -3.905 18.713 727 HB3 GLU 98 1HB GLU 98 4.345 -5.534 19.075 728 HG2 GLU 98 2HG GLU 98 5.423 -4.866 21.004 729 HG3 GLU 98 1HG GLU 98 6.640 -5.835 20.173 730 H GLU 99 HN GLU 99 5.497 -3.436 16.167 731 HA GLU 99 HA GLU 99 3.004 -4.124 15.053 732 HB2 GLU 99 2HB GLU 99 5.045 -2.178 13.975 733 HB3 GLU 99 1HB GLU 99 3.322 -2.199 13.611 734 HG2 GLU 99 2HG GLU 99 2.829 -1.710 15.953 735 HG3 GLU 99 1HG GLU 99 4.557 -1.671 16.302 736 H GLN 100 HN GLN 100 6.282 -4.820 14.094 737 HA GLN 100 HA GLN 100 5.670 -5.513 11.395 738 HB2 GLN 100 2HB GLN 100 7.956 -4.902 12.224 739 HB3 GLN 100 1HB GLN 100 8.011 -6.445 13.065 740 HG2 GLN 100 2HG GLN 100 7.893 -7.642 10.990 741 HG3 GLN 100 1HG GLN 100 7.657 -6.142 10.095 742 HE21 GLN 100 1HE2 GLN 100 9.382 -4.736 9.839 743 HE22 GLN 100 2HE2 GLN 100 11.020 -5.257 10.025 744 H ALA 101 HN ALA 101 5.896 -7.262 14.443 745 HA ALA 101 HA ALA 101 5.388 -9.845 13.377 746 HB1 ALA 101 1HB ALA 101 6.349 -9.541 15.598 747 HB2 ALA 101 2HB ALA 101 4.856 -10.477 15.683 748 HB3 ALA 101 3HB ALA 101 4.859 -8.775 16.148 749 H LEU 102 HN LEU 102 3.343 -7.236 14.563 750 HA LEU 102 HA LEU 102 0.860 -8.561 14.372 751 HB2 LEU 102 2HB LEU 102 1.504 -6.267 15.422 752 HB3 LEU 102 1HB LEU 102 1.244 -5.629 13.813 753 HG LEU 102 HG LEU 102 -0.682 -5.323 15.330 754 HD11 LEU 102 1HD1 LEU 102 -1.066 -5.357 12.940 755 HD12 LEU 102 2HD1 LEU 102 -2.414 -6.110 13.794 756 HD13 LEU 102 3HD1 LEU 102 -1.220 -7.115 12.972 757 HD21 LEU 102 3HD2 LEU 102 -2.064 -7.239 15.939 758 HD22 LEU 102 1HD2 LEU 102 -0.447 -7.366 16.633 759 HD23 LEU 102 2HD2 LEU 102 -0.878 -8.327 15.217 760 H LEU 103 HN LEU 103 2.621 -6.492 12.095 761 HA LEU 103 HA LEU 103 0.932 -6.631 9.898 762 HB2 LEU 103 2HB LEU 103 3.013 -5.230 10.211 763 HB3 LEU 103 1HB LEU 103 3.951 -6.649 9.809 764 HG LEU 103 HG LEU 103 3.607 -4.933 7.978 765 HD11 LEU 103 1HD1 LEU 103 3.338 -6.609 6.224 766 HD12 LEU 103 2HD1 LEU 103 2.772 -7.772 7.423 767 HD13 LEU 103 3HD1 LEU 103 4.426 -7.163 7.496 768 HD21 LEU 103 3HD2 LEU 103 1.262 -4.461 8.353 769 HD22 LEU 103 1HD2 LEU 103 0.843 -6.130 7.968 770 HD23 LEU 103 2HD2 LEU 103 1.509 -5.077 6.720 771 H PHE 104 HN PHE 104 3.582 -8.828 10.804 772 HA PHE 104 HA PHE 104 3.379 -10.679 8.747 773 HB2 PHE 104 2HB PHE 104 5.180 -10.799 10.336 774 HB3 PHE 104 1HB PHE 104 4.064 -11.088 11.663 775 HD1 PHE 104 1HD PHE 104 5.021 -12.581 8.375 776 HD2 PHE 104 2HD PHE 104 3.798 -13.237 12.397 777 HE1 PHE 104 1HE PHE 104 5.249 -15.008 8.046 778 HE2 PHE 104 2HE PHE 104 4.022 -15.665 12.076 779 HZ PHE 104 HZ PHE 104 4.747 -16.555 9.899 780 H SER 105 HN SER 105 1.634 -10.569 11.807 781 HA SER 105 HA SER 105 0.130 -12.890 11.529 782 HB2 SER 105 2HB SER 105 -0.631 -10.309 12.914 783 HB3 SER 105 1HB SER 105 -1.313 -11.900 13.222 784 HG SER 105 HG SER 105 1.363 -11.058 13.678 785 H ILE 106 HN ILE 106 -0.452 -9.609 10.362 786 HA ILE 106 HA ILE 106 -3.062 -9.990 9.387 787 HB ILE 106 HB ILE 106 -0.905 -8.147 8.343 788 HG12 ILE 106 2HG1 ILE 106 -3.169 -7.638 10.288 789 HG13 ILE 106 1HG1 ILE 106 -1.473 -7.807 10.728 790 HG21 ILE 106 1HG2 ILE 106 -2.748 -6.848 7.379 791 HG22 ILE 106 2HG2 ILE 106 -3.890 -8.082 7.906 792 HG23 ILE 106 3HG2 ILE 106 -2.669 -8.471 6.693 793 HD11 ILE 106 3HD1 ILE 106 -2.145 -5.478 10.680 794 HD12 ILE 106 1HD1 ILE 106 -2.642 -5.642 8.996 795 HD13 ILE 106 2HD1 ILE 106 -0.941 -5.807 9.434 796 H PHE 107 HN PHE 107 0.093 -10.339 7.786 797 HA PHE 107 HA PHE 107 -0.870 -11.146 5.277 798 HB2 PHE 107 2HB PHE 107 1.714 -11.293 6.706 799 HB3 PHE 107 1HB PHE 107 1.493 -12.454 5.403 800 HD1 PHE 107 1HD PHE 107 1.352 -8.822 6.170 801 HD2 PHE 107 2HD PHE 107 1.809 -11.829 3.194 802 HE1 PHE 107 1HE PHE 107 1.957 -7.095 4.523 803 HE2 PHE 107 2HE PHE 107 2.410 -10.110 1.540 804 HZ PHE 107 HZ PHE 107 2.485 -7.738 2.205 805 H ASN 108 HN ASN 108 -0.009 -13.023 8.147 806 HA ASN 108 HA ASN 108 -0.449 -15.581 7.039 807 HB2 ASN 108 2HB ASN 108 0.763 -15.125 9.181 808 HB3 ASN 108 1HB ASN 108 -0.787 -14.757 9.931 809 HD21 ASN 108 1HD2 ASN 108 -2.132 -16.402 10.525 810 HD22 ASN 108 2HD2 ASN 108 -1.694 -18.078 10.410 811 H ARG 109 HN ARG 109 -2.567 -13.330 8.738 812 HA ARG 109 HA ARG 109 -4.855 -14.935 8.907 813 HB2 ARG 109 2HB ARG 109 -4.535 -12.833 10.135 814 HB3 ARG 109 1HB ARG 109 -4.604 -11.931 8.633 815 HG2 ARG 109 2HG ARG 109 -6.934 -13.616 9.418 816 HG3 ARG 109 1HG ARG 109 -6.673 -12.073 10.230 817 HD2 ARG 109 2HD ARG 109 -6.432 -11.183 7.772 818 HD3 ARG 109 1HD ARG 109 -7.348 -12.637 7.380 819 HE ARG 109 HE ARG 109 -8.559 -11.144 9.492 820 HH11 ARG 109 1HH1 ARG 109 -8.245 -11.375 6.021 821 HH12 ARG 109 2HH1 ARG 109 -9.687 -10.462 5.685 822 HH21 ARG 109 1HH2 ARG 109 -10.436 -9.913 9.076 823 HH22 ARG 109 2HH2 ARG 109 -10.932 -9.623 7.436 824 H PHE 110 HN PHE 110 -3.670 -12.852 6.315 825 HA PHE 110 HA PHE 110 -6.005 -13.082 4.699 826 HB2 PHE 110 2HB PHE 110 -3.184 -12.203 4.099 827 HB3 PHE 110 1HB PHE 110 -4.457 -12.210 2.885 828 HD1 PHE 110 2HD PHE 110 -6.216 -11.450 5.683 829 HD2 PHE 110 1HD PHE 110 -3.229 -9.741 3.181 830 HE1 PHE 110 2HE PHE 110 -6.918 -9.201 6.386 831 HE2 PHE 110 1HE PHE 110 -3.934 -7.490 3.875 832 HZ PHE 110 HZ PHE 110 -5.781 -7.219 5.480 833 H ARG 111 HN ARG 111 -2.764 -14.540 4.464 834 HA ARG 111 HA ARG 111 -3.397 -16.052 2.145 835 HB2 ARG 111 2HB ARG 111 -1.127 -16.299 4.114 836 HB3 ARG 111 1HB ARG 111 -1.227 -17.202 2.613 837 HG2 ARG 111 2HG ARG 111 -1.235 -14.202 2.739 838 HG3 ARG 111 1HG ARG 111 0.234 -15.165 2.584 839 HD2 ARG 111 2HD ARG 111 -0.344 -14.534 0.400 840 HD3 ARG 111 1HD ARG 111 -0.829 -16.218 0.545 841 HE ARG 111 HE ARG 111 -2.860 -14.169 0.999 842 HH11 ARG 111 1HH1 ARG 111 -1.539 -16.696 -1.030 843 HH12 ARG 111 2HH1 ARG 111 -2.896 -16.713 -2.118 844 HH21 ARG 111 1HH2 ARG 111 -4.665 -14.199 -0.423 845 HH22 ARG 111 2HH2 ARG 111 -4.667 -15.277 -1.786 846 H ASN 112 HN ASN 112 -3.983 -16.564 5.466 847 HA ASN 112 HA ASN 112 -3.927 -19.393 5.539 848 HB2 ASN 112 2HB ASN 112 -4.242 -17.414 7.403 849 HB3 ASN 112 1HB ASN 112 -5.872 -18.075 7.306 850 HD21 ASN 112 1HD2 ASN 112 -2.586 -18.668 8.170 851 HD22 ASN 112 2HD2 ASN 112 -2.854 -20.144 9.028 852 H SER 113 HN SER 113 -6.483 -17.047 4.867 853 HA SER 113 HA SER 113 -8.389 -19.206 4.388 854 HB2 SER 113 2HB SER 113 -10.015 -17.291 4.158 855 HB3 SER 113 1HB SER 113 -9.231 -17.399 5.734 856 HG SER 113 HG SER 113 -9.038 -15.303 5.189 857 H GLY 114 HN GLY 114 -6.611 -16.688 2.726 858 HA2 GLY 114 2HA GLY 114 -6.019 -17.077 0.386 859 HA3 GLY 114 1HA GLY 114 -7.632 -17.748 0.162 860 H LYS 115 HN LYS 115 -8.228 -15.393 2.175 861 HA LYS 115 HA LYS 115 -8.968 -13.490 0.114 862 HB2 LYS 115 2HB LYS 115 -9.723 -14.030 2.930 863 HB3 LYS 115 1HB LYS 115 -9.823 -12.366 2.403 864 HG2 LYS 115 2HG LYS 115 -11.183 -13.316 0.425 865 HG3 LYS 115 1HG LYS 115 -11.351 -14.737 1.452 866 HD2 LYS 115 2HD LYS 115 -12.175 -11.920 2.136 867 HD3 LYS 115 1HD LYS 115 -13.254 -13.264 1.763 868 HE2 LYS 115 2HE LYS 115 -12.544 -14.433 3.753 869 HE3 LYS 115 1HE LYS 115 -11.351 -13.182 4.100 870 HZ1 LYS 115 3HZ LYS 115 -13.412 -12.961 5.411 871 HZ2 LYS 115 1HZ LYS 115 -14.279 -12.719 3.972 872 HZ3 LYS 115 2HZ LYS 115 -13.094 -11.599 4.449 873 H GLY 116 HN GLY 116 -8.922 -11.151 1.490 874 HA2 GLY 116 2HA GLY 116 -7.524 -9.797 2.894 875 HA3 GLY 116 1HA GLY 116 -6.165 -10.809 2.440 876 H PHE 117 HN PHE 117 -7.478 -7.884 2.068 877 HA PHE 117 HA PHE 117 -6.169 -7.485 -0.537 878 HB2 PHE 117 2HB PHE 117 -8.277 -5.823 0.868 879 HB3 PHE 117 1HB PHE 117 -7.465 -5.345 -0.617 880 HD1 PHE 117 1HD PHE 117 -9.758 -7.826 0.866 881 HD2 PHE 117 2HD PHE 117 -8.147 -6.183 -2.713 882 HE1 PHE 117 1HE PHE 117 -11.462 -9.022 -0.447 883 HE2 PHE 117 2HE PHE 117 -9.845 -7.376 -4.030 884 HZ PHE 117 HZ PHE 117 -11.506 -8.797 -2.900 885 H LEU 118 HN LEU 118 -4.180 -6.680 -0.346 886 HA LEU 118 HA LEU 118 -3.570 -5.012 1.995 887 HB2 LEU 118 2HB LEU 118 -2.860 -7.558 2.012 888 HB3 LEU 118 1HB LEU 118 -1.576 -6.964 0.981 889 HG LEU 118 HG LEU 118 -0.951 -7.176 3.389 890 HD11 LEU 118 1HD1 LEU 118 -0.818 -4.405 2.225 891 HD12 LEU 118 2HD1 LEU 118 0.302 -5.728 1.900 892 HD13 LEU 118 3HD1 LEU 118 0.202 -5.034 3.518 893 HD21 LEU 118 3HD2 LEU 118 -3.072 -6.468 4.367 894 HD22 LEU 118 1HD2 LEU 118 -2.829 -4.842 3.727 895 HD23 LEU 118 2HD2 LEU 118 -1.732 -5.482 4.952 896 H LEU 119 HN LEU 119 -2.651 -3.216 1.447 897 HA LEU 119 HA LEU 119 -1.191 -3.038 -1.100 898 HB2 LEU 119 2HB LEU 119 -3.393 -1.874 -1.151 899 HB3 LEU 119 1HB LEU 119 -2.862 -0.874 0.188 900 HG LEU 119 HG LEU 119 -1.063 0.045 -1.233 901 HD11 LEU 119 1HD1 LEU 119 -2.376 -1.580 -3.409 902 HD12 LEU 119 2HD1 LEU 119 -0.763 -1.837 -2.742 903 HD13 LEU 119 3HD1 LEU 119 -1.118 -0.366 -3.646 904 HD21 LEU 119 3HD2 LEU 119 -2.517 1.393 -2.675 905 HD22 LEU 119 1HD2 LEU 119 -3.184 1.219 -1.053 906 HD23 LEU 119 2HD2 LEU 119 -3.843 0.268 -2.383 907 H LEU 120 HN LEU 120 0.889 -2.756 -0.715 908 HA LEU 120 HA LEU 120 1.711 -1.465 1.794 909 HB2 LEU 120 2HB LEU 120 3.241 -3.197 -0.147 910 HB3 LEU 120 1HB LEU 120 3.954 -2.431 1.258 911 HG LEU 120 HG LEU 120 1.730 -4.464 1.374 912 HD11 LEU 120 1HD1 LEU 120 4.687 -4.786 1.865 913 HD12 LEU 120 2HD1 LEU 120 3.778 -5.460 0.512 914 HD13 LEU 120 3HD1 LEU 120 3.453 -6.012 2.156 915 HD21 LEU 120 3HD2 LEU 120 2.290 -4.548 3.756 916 HD22 LEU 120 1HD2 LEU 120 1.760 -2.936 3.272 917 HD23 LEU 120 2HD2 LEU 120 3.474 -3.262 3.521 918 H GLY 121 HN GLY 121 2.645 0.475 1.797 919 HA2 GLY 121 2HA GLY 121 3.286 1.753 -0.752 920 HA3 GLY 121 1HA GLY 121 3.235 2.534 0.823 921 H SER 122 HN SER 122 5.083 2.943 1.819 922 HA SER 122 HA SER 122 7.247 2.839 2.498 923 HB2 SER 122 2HB SER 122 7.447 0.216 0.998 924 HB3 SER 122 1HB SER 122 8.550 0.810 2.240 925 HG SER 122 HG SER 122 5.950 -0.199 2.487 926 H GLU 123 HN GLU 123 9.635 2.291 1.270 927 HA GLU 123 HA GLU 123 9.380 4.144 -1.011 928 HB2 GLU 123 2HB GLU 123 10.318 5.081 1.091 929 HB3 GLU 123 1HB GLU 123 11.653 3.948 0.963 930 HG2 GLU 123 2HG GLU 123 12.417 4.987 -1.059 931 HG3 GLU 123 1HG GLU 123 10.995 6.028 -1.110 932 H TYR 124 HN TYR 124 10.641 1.029 -0.149 933 HA TYR 124 HA TYR 124 12.415 1.190 -2.499 934 HB2 TYR 124 2HB TYR 124 12.886 -0.509 -0.045 935 HB3 TYR 124 1HB TYR 124 13.972 -0.324 -1.421 936 HD1 TYR 124 1HD TYR 124 14.492 2.265 -1.970 937 HD2 TYR 124 2HD TYR 124 13.409 0.719 1.840 938 HE1 TYR 124 1HE TYR 124 15.496 4.232 -0.895 939 HE2 TYR 124 2HE TYR 124 14.415 2.683 2.927 940 HH TYR 124 HH TYR 124 15.096 5.480 1.334 941 H THR 125 HN THR 125 11.648 -1.731 -0.658 942 HA THR 125 HA THR 125 9.847 -2.737 -2.667 943 HB THR 125 HB THR 125 11.499 -4.825 -2.873 944 HG1 THR 125 1HG THR 125 13.369 -2.712 -2.964 945 HG21 THR 125 3HG2 THR 125 12.269 -3.936 -5.039 946 HG22 THR 125 1HG2 THR 125 11.702 -2.335 -4.570 947 HG23 THR 125 2HG2 THR 125 10.547 -3.655 -4.777 948 HA PRO 126 HA PRO 126 8.327 -4.905 0.752 949 HB2 PRO 126 2HB PRO 126 7.401 -7.240 -0.319 950 HB3 PRO 126 1HB PRO 126 6.598 -5.681 -0.526 951 HG2 PRO 126 2HG PRO 126 8.412 -7.142 -2.400 952 HG3 PRO 126 1HG PRO 126 6.923 -6.244 -2.751 953 HD2 PRO 126 2HD PRO 126 9.386 -5.210 -3.191 954 HD3 PRO 126 1HD PRO 126 8.001 -4.205 -2.722 955 H GLN 127 HN GLN 127 10.497 -6.851 -1.236 956 HA GLN 127 HA GLN 127 10.877 -8.744 0.940 957 HB2 GLN 127 2HB GLN 127 11.958 -8.741 -1.883 958 HB3 GLN 127 1HB GLN 127 12.187 -10.032 -0.710 959 HG2 GLN 127 2HG GLN 127 9.789 -10.431 -0.654 960 HG3 GLN 127 1HG GLN 127 9.529 -9.110 -1.791 961 HE21 GLN 127 1HE2 GLN 127 8.569 -10.460 -3.306 962 HE22 GLN 127 2HE2 GLN 127 9.481 -11.604 -4.232 963 H GLN 128 HN GLN 128 12.239 -5.865 -0.062 964 HA GLN 128 HA GLN 128 14.896 -6.641 0.931 965 HB2 GLN 128 2HB GLN 128 14.735 -5.699 -1.396 966 HB3 GLN 128 1HB GLN 128 14.214 -4.181 -0.682 967 HG2 GLN 128 2HG GLN 128 16.327 -3.982 0.496 968 HG3 GLN 128 1HG GLN 128 16.848 -5.539 -0.145 969 HE21 GLN 128 1HE2 GLN 128 16.263 -2.195 -0.863 970 HE22 GLN 128 2HE2 GLN 128 17.091 -2.164 -2.384 971 H LEU 129 HN LEU 129 12.105 -5.187 1.929 972 HA LEU 129 HA LEU 129 13.047 -3.004 3.438 973 HB2 LEU 129 2HB LEU 129 10.695 -4.837 3.922 974 HB3 LEU 129 1HB LEU 129 10.998 -3.367 4.819 975 HG LEU 129 HG LEU 129 10.367 -3.568 1.878 976 HD11 LEU 129 1HD1 LEU 129 8.802 -2.428 4.189 977 HD12 LEU 129 2HD1 LEU 129 8.446 -3.928 3.333 978 HD13 LEU 129 3HD1 LEU 129 8.322 -2.384 2.492 979 HD21 LEU 129 3HD2 LEU 129 10.918 -1.129 3.565 980 HD22 LEU 129 1HD2 LEU 129 10.369 -1.124 1.889 981 HD23 LEU 129 2HD2 LEU 129 11.959 -1.770 2.295 982 H VAL 130 HN VAL 130 13.083 -2.971 5.868 983 HA VAL 130 HA VAL 130 14.891 -4.987 6.822 984 HB VAL 130 HB VAL 130 13.573 -2.783 8.427 985 HG11 VAL 130 1HG1 VAL 130 16.094 -4.378 8.879 986 HG12 VAL 130 2HG1 VAL 130 14.593 -4.502 9.798 987 HG13 VAL 130 3HG1 VAL 130 15.552 -3.023 9.871 988 HG21 VAL 130 3HG2 VAL 130 14.704 -1.810 6.513 989 HG22 VAL 130 1HG2 VAL 130 16.163 -2.730 6.881 990 HG23 VAL 130 2HG2 VAL 130 15.610 -1.474 7.989 991 H ILE 131 HN ILE 131 13.548 -6.825 6.598 992 HA ILE 131 HA ILE 131 11.675 -7.193 8.825 993 HB ILE 131 HB ILE 131 10.214 -8.555 7.347 994 HG12 ILE 131 2HG1 ILE 131 11.885 -7.366 5.123 995 HG13 ILE 131 1HG1 ILE 131 11.891 -9.054 5.612 996 HG21 ILE 131 1HG2 ILE 131 9.594 -6.268 7.868 997 HG22 ILE 131 2HG2 ILE 131 9.127 -6.663 6.215 998 HG23 ILE 131 3HG2 ILE 131 10.557 -5.677 6.514 999 HD11 ILE 131 3HD1 ILE 131 9.536 -9.234 4.963 1000 HD12 ILE 131 1HD1 ILE 131 10.567 -8.747 3.619 1001 HD13 ILE 131 2HD1 ILE 131 9.567 -7.549 4.442 1002 H ARG 132 HN ARG 132 11.201 -9.566 9.141 1003 HA ARG 132 HA ARG 132 13.701 -11.056 8.957 1004 HB2 ARG 132 2HB ARG 132 11.135 -11.710 10.426 1005 HB3 ARG 132 1HB ARG 132 12.649 -12.600 10.551 1006 HG2 ARG 132 2HG ARG 132 13.741 -10.659 11.511 1007 HG3 ARG 132 1HG ARG 132 12.263 -9.714 11.327 1008 HD2 ARG 132 2HD ARG 132 11.115 -11.302 12.843 1009 HD3 ARG 132 1HD ARG 132 12.651 -12.137 13.082 1010 HE ARG 132 HE ARG 132 13.230 -9.561 13.723 1011 HH11 ARG 132 1HH1 ARG 132 10.794 -11.842 14.774 1012 HH12 ARG 132 2HH1 ARG 132 10.623 -11.143 16.358 1013 HH21 ARG 132 1HH2 ARG 132 13.019 -8.636 15.807 1014 HH22 ARG 132 2HH2 ARG 132 11.902 -9.320 16.945 1015 H GLU 133 HN GLU 133 13.321 -13.548 8.628 1016 HA GLU 133 HA GLU 133 12.737 -13.811 5.896 1017 HB2 GLU 133 2HB GLU 133 13.020 -15.977 7.980 1018 HB3 GLU 133 1HB GLU 133 13.067 -16.226 6.241 1019 HG2 GLU 133 2HG GLU 133 15.045 -14.699 6.166 1020 HG3 GLU 133 1HG GLU 133 15.043 -14.721 7.930 1021 H ASP 134 HN ASP 134 10.817 -14.447 8.739 1022 HA ASP 134 HA ASP 134 8.788 -16.013 7.657 1023 HB2 ASP 134 2HB ASP 134 8.573 -13.894 9.808 1024 HB3 ASP 134 1HB ASP 134 7.369 -15.137 9.485 1025 H LEU 135 HN LEU 135 9.209 -12.511 7.637 1026 HA LEU 135 HA LEU 135 6.724 -12.098 6.232 1027 HB2 LEU 135 2HB LEU 135 8.919 -10.332 7.205 1028 HB3 LEU 135 1HB LEU 135 7.841 -9.732 5.958 1029 HG LEU 135 HG LEU 135 6.970 -10.726 8.674 1030 HD11 LEU 135 1HD1 LEU 135 8.213 -8.606 8.768 1031 HD12 LEU 135 2HD1 LEU 135 6.507 -8.392 9.158 1032 HD13 LEU 135 3HD1 LEU 135 7.113 -7.921 7.571 1033 HD21 LEU 135 3HD2 LEU 135 5.433 -9.419 6.431 1034 HD22 LEU 135 1HD2 LEU 135 4.793 -9.800 8.030 1035 HD23 LEU 135 2HD2 LEU 135 5.293 -11.099 6.948 1036 H ARG 136 HN ARG 136 10.161 -12.195 5.446 1037 HA ARG 136 HA ARG 136 10.047 -11.081 2.892 1038 HB2 ARG 136 2HB ARG 136 12.131 -11.563 4.173 1039 HB3 ARG 136 1HB ARG 136 11.924 -13.270 3.800 1040 HG2 ARG 136 2HG ARG 136 12.180 -12.836 1.444 1041 HG3 ARG 136 1HG ARG 136 12.233 -11.097 1.735 1042 HD2 ARG 136 2HD ARG 136 14.473 -11.814 1.416 1043 HD3 ARG 136 1HD ARG 136 14.275 -11.490 3.137 1044 HE ARG 136 HE ARG 136 13.813 -14.112 3.055 1045 HH11 ARG 136 1HH1 ARG 136 16.345 -12.180 1.601 1046 HH12 ARG 136 2HH1 ARG 136 17.513 -13.473 1.601 1047 HH21 ARG 136 1HH2 ARG 136 15.350 -15.817 3.066 1048 HH22 ARG 136 2HH2 ARG 136 16.955 -15.522 2.455 1049 H THR 137 HN THR 137 9.432 -14.371 3.959 1050 HA THR 137 HA THR 137 9.254 -15.506 1.360 1051 HB THR 137 HB THR 137 7.945 -17.327 2.628 1052 HG1 THR 137 1HG THR 137 9.035 -16.234 4.966 1053 HG21 THR 137 3HG2 THR 137 10.745 -16.616 3.516 1054 HG22 THR 137 1HG2 THR 137 10.324 -17.514 2.060 1055 HG23 THR 137 2HG2 THR 137 9.993 -18.206 3.650 1056 H ARG 138 HN ARG 138 6.863 -14.143 3.605 1057 HA ARG 138 HA ARG 138 4.615 -14.844 1.994 1058 HB2 ARG 138 2HB ARG 138 4.739 -12.712 4.124 1059 HB3 ARG 138 1HB ARG 138 3.317 -13.585 3.563 1060 HG2 ARG 138 2HG ARG 138 5.653 -14.801 5.021 1061 HG3 ARG 138 1HG ARG 138 4.100 -14.383 5.733 1062 HD2 ARG 138 2HD ARG 138 2.967 -16.029 4.452 1063 HD3 ARG 138 1HD ARG 138 4.375 -16.288 3.420 1064 HE ARG 138 HE ARG 138 4.922 -16.841 6.170 1065 HH11 ARG 138 1HH1 ARG 138 3.449 -18.200 3.296 1066 HH12 ARG 138 2HH1 ARG 138 3.794 -19.838 3.743 1067 HH21 ARG 138 1HH2 ARG 138 5.365 -18.968 6.767 1068 HH22 ARG 138 2HH2 ARG 138 4.899 -20.285 5.725 1069 H MET 139 HN MET 139 6.818 -12.175 2.056 1070 HA MET 139 HA MET 139 5.250 -10.251 0.709 1071 HB2 MET 139 2HB MET 139 8.235 -10.648 0.868 1072 HB3 MET 139 1HB MET 139 7.491 -9.271 0.071 1073 HG2 MET 139 2HG MET 139 7.122 -9.996 2.964 1074 HG3 MET 139 1HG MET 139 8.253 -8.792 2.355 1075 HE1 MET 139 3HE MET 139 6.105 -8.166 4.610 1076 HE2 MET 139 1HE MET 139 5.512 -6.595 4.072 1077 HE3 MET 139 2HE MET 139 7.232 -6.969 3.976 1078 H ALA 140 HN ALA 140 6.723 -13.130 -0.363 1079 HA ALA 140 HA ALA 140 7.043 -12.384 -3.109 1080 HB1 ALA 140 1HB ALA 140 8.383 -14.168 -2.120 1081 HB2 ALA 140 2HB ALA 140 7.452 -14.760 -3.496 1082 HB3 ALA 140 3HB ALA 140 6.923 -15.121 -1.854 1083 H TYR 141 HN TYR 141 4.309 -12.809 -1.301 1084 HA TYR 141 HA TYR 141 2.777 -14.070 -3.451 1085 HB2 TYR 141 2HB TYR 141 2.046 -13.437 -0.589 1086 HB3 TYR 141 1HB TYR 141 0.949 -14.155 -1.759 1087 HD1 TYR 141 1HD TYR 141 1.765 -16.375 -2.872 1088 HD2 TYR 141 2HD TYR 141 3.331 -14.810 0.755 1089 HE1 TYR 141 1HE TYR 141 2.600 -18.611 -2.275 1090 HE2 TYR 141 2HE TYR 141 4.174 -17.038 1.364 1091 HH TYR 141 HH TYR 141 4.304 -19.621 -0.866 1092 H CYS 142 HN CYS 142 3.769 -11.095 -3.072 1093 HA CYS 142 HA CYS 142 1.172 -9.937 -3.794 1094 HB2 CYS 142 2HB CYS 142 1.853 -7.820 -2.808 1095 HB3 CYS 142 1HB CYS 142 1.927 -9.095 -1.599 1096 HG CYS 142 HG CYS 142 4.815 -9.356 -2.125 1097 H LEU 143 HN LEU 143 1.223 -8.287 -5.361 1098 HA LEU 143 HA LEU 143 3.324 -8.646 -7.322 1099 HB2 LEU 143 2HB LEU 143 0.793 -7.007 -7.359 1100 HB3 LEU 143 1HB LEU 143 1.924 -7.056 -8.689 1101 HG LEU 143 HG LEU 143 1.489 -9.586 -8.686 1102 HD11 LEU 143 1HD1 LEU 143 -0.917 -8.665 -7.129 1103 HD12 LEU 143 2HD1 LEU 143 0.348 -9.751 -6.552 1104 HD13 LEU 143 3HD1 LEU 143 -0.719 -10.257 -7.861 1105 HD21 LEU 143 3HD2 LEU 143 0.735 -8.076 -10.443 1106 HD22 LEU 143 1HD2 LEU 143 -0.702 -7.686 -9.495 1107 HD23 LEU 143 2HD2 LEU 143 -0.470 -9.320 -10.115 1108 H VAL 144 HN VAL 144 4.502 -6.851 -8.233 1109 HA VAL 144 HA VAL 144 4.870 -4.663 -6.294 1110 HB VAL 144 HB VAL 144 7.005 -5.852 -8.074 1111 HG11 VAL 144 1HG1 VAL 144 8.544 -4.500 -6.725 1112 HG12 VAL 144 2HG1 VAL 144 7.173 -3.831 -5.839 1113 HG13 VAL 144 3HG1 VAL 144 7.358 -3.494 -7.559 1114 HG21 VAL 144 3HG2 VAL 144 7.967 -6.764 -5.991 1115 HG22 VAL 144 1HG2 VAL 144 6.390 -7.462 -6.369 1116 HG23 VAL 144 2HG2 VAL 144 6.532 -6.228 -5.118 1117 H TYR 145 HN TYR 145 4.242 -2.798 -7.078 1118 HA TYR 145 HA TYR 145 4.301 -2.390 -9.992 1119 HB2 TYR 145 2HB TYR 145 2.393 -1.440 -7.881 1120 HB3 TYR 145 1HB TYR 145 2.527 -0.593 -9.415 1121 HD1 TYR 145 1HD TYR 145 2.026 -4.061 -8.102 1122 HD2 TYR 145 2HD TYR 145 1.134 -1.217 -11.132 1123 HE1 TYR 145 1HE TYR 145 0.449 -5.649 -9.120 1124 HE2 TYR 145 2HE TYR 145 -0.448 -2.792 -12.157 1125 HH TYR 145 HH TYR 145 -0.918 -5.133 -12.240 1126 H GLU 146 HN GLU 146 5.859 -1.085 -10.624 1127 HA GLU 146 HA GLU 146 6.675 1.158 -8.959 1128 HB2 GLU 146 2HB GLU 146 8.268 1.625 -10.856 1129 HB3 GLU 146 1HB GLU 146 8.497 0.065 -10.080 1130 HG2 GLU 146 2HG GLU 146 7.371 -1.050 -11.907 1131 HG3 GLU 146 1HG GLU 146 7.014 0.501 -12.665 1132 H VAL 147 HN VAL 147 5.483 2.940 -9.022 1133 HA VAL 147 HA VAL 147 3.818 3.408 -11.390 1134 HB VAL 147 HB VAL 147 3.521 4.570 -8.613 1135 HG11 VAL 147 1HG1 VAL 147 1.674 4.666 -10.996 1136 HG12 VAL 147 2HG1 VAL 147 2.605 6.015 -10.346 1137 HG13 VAL 147 3HG1 VAL 147 1.314 5.294 -9.386 1138 HG21 VAL 147 3HG2 VAL 147 3.113 2.181 -8.586 1139 HG22 VAL 147 1HG2 VAL 147 2.020 2.327 -9.960 1140 HG23 VAL 147 2HG2 VAL 147 1.590 3.053 -8.411 1141 H LYS 148 HN LYS 148 4.401 4.945 -12.744 1142 HA LYS 148 HA LYS 148 5.606 7.382 -11.645 1143 HB2 LYS 148 2HB LYS 148 6.974 7.517 -13.786 1144 HB3 LYS 148 1HB LYS 148 7.483 6.324 -12.601 1145 HG2 LYS 148 2HG LYS 148 6.309 4.580 -13.918 1146 HG3 LYS 148 1HG LYS 148 5.936 5.803 -15.135 1147 HD2 LYS 148 2HD LYS 148 7.894 4.534 -15.800 1148 HD3 LYS 148 1HD LYS 148 8.342 6.203 -15.449 1149 HE2 LYS 148 2HE LYS 148 9.109 5.507 -13.216 1150 HE3 LYS 148 1HE LYS 148 8.697 3.837 -13.609 1151 HZ1 LYS 148 3HZ LYS 148 10.328 3.847 -15.354 1152 HZ2 LYS 148 1HZ LYS 148 11.074 4.342 -13.912 1153 HZ3 LYS 148 2HZ LYS 148 10.671 5.487 -15.094 1154 HA PRO 149 HA PRO 149 1.934 8.502 -14.068 1155 HB2 PRO 149 2HB PRO 149 1.060 10.426 -12.388 1156 HB3 PRO 149 1HB PRO 149 0.766 8.709 -12.101 1157 HG2 PRO 149 2HG PRO 149 2.733 10.535 -10.821 1158 HG3 PRO 149 1HG PRO 149 1.846 9.170 -10.126 1159 HD2 PRO 149 2HD PRO 149 4.497 9.119 -10.978 1160 HD3 PRO 149 1HD PRO 149 3.475 7.698 -10.698 Start of MODEL 7 1 H1 MET 1 H1 MET 1 27.408 8.410 40.264 2 H2 MET 1 H2 MET 1 27.848 9.621 39.170 3 H3 MET 1 H3 MET 1 26.540 8.602 38.820 4 HA MET 1 HA MET 1 25.334 9.492 40.730 5 HB2 MET 1 2HB MET 1 27.719 11.351 40.858 6 HB3 MET 1 1HB MET 1 26.212 11.614 41.722 7 HG2 MET 1 2HG MET 1 28.036 9.250 42.082 8 HG3 MET 1 1HG MET 1 27.956 10.656 43.143 9 HE1 MET 1 2HE MET 1 27.596 9.032 45.211 10 HE2 MET 1 3HE MET 1 27.650 7.630 44.142 11 HE3 MET 1 1HE MET 1 26.326 7.812 45.291 12 H GLY 2 HN GLY 2 24.645 12.081 40.687 13 HA2 GLY 2 2HA GLY 2 24.431 13.985 39.202 14 HA3 GLY 2 1HA GLY 2 24.635 12.882 37.849 15 H HIS 3 HN HIS 3 22.431 14.359 40.015 16 HA HIS 3 HA HIS 3 20.188 12.676 39.303 17 HB2 HIS 3 2HB HIS 3 20.177 15.393 40.637 18 HB3 HIS 3 1HB HIS 3 18.827 14.275 40.549 19 HD1 HIS 3 1HD HIS 3 20.044 15.400 43.204 20 HD2 HIS 3 2HD HIS 3 20.879 11.681 41.541 21 HE1 HIS 3 1HE HIS 3 20.835 13.962 45.114 22 HE2 HIS 3 2HE HIS 3 21.588 11.818 44.026 23 H HIS 4 HN HIS 4 20.152 12.805 37.029 24 HA HIS 4 HA HIS 4 19.456 15.455 35.961 25 HB2 HIS 4 2HB HIS 4 20.208 14.706 33.777 26 HB3 HIS 4 1HB HIS 4 21.484 14.456 34.955 27 HD1 HIS 4 1HD HIS 4 19.997 12.854 32.183 28 HD2 HIS 4 2HD HIS 4 21.333 11.533 35.896 29 HE1 HIS 4 1HE HIS 4 20.340 10.376 31.940 30 HE2 HIS 4 2HE HIS 4 20.955 9.574 34.243 31 H HIS 5 HN HIS 5 17.390 15.760 35.639 32 HA HIS 5 HA HIS 5 15.749 13.914 34.237 33 HB2 HIS 5 2HB HIS 5 15.828 12.910 36.570 34 HB3 HIS 5 1HB HIS 5 14.982 14.348 37.131 35 HD1 HIS 5 1HD HIS 5 12.519 14.156 37.162 36 HD2 HIS 5 2HD HIS 5 14.252 11.497 34.476 37 HE1 HIS 5 1HE HIS 5 10.621 12.765 36.264 38 HE2 HIS 5 2HE HIS 5 11.725 11.036 34.794 39 H HIS 6 HN HIS 6 14.698 15.290 32.991 40 HA HIS 6 HA HIS 6 13.121 17.417 34.137 41 HB2 HIS 6 2HB HIS 6 15.391 18.448 33.873 42 HB3 HIS 6 1HB HIS 6 15.288 18.129 32.146 43 HD1 HIS 6 1HD HIS 6 14.229 19.914 30.750 44 HD2 HIS 6 2HD HIS 6 13.323 20.307 34.797 45 HE1 HIS 6 1HE HIS 6 13.009 22.108 30.972 46 HE2 HIS 6 2HE HIS 6 12.537 22.364 33.434 47 H HIS 7 HN HIS 7 11.266 17.514 33.017 48 HA HIS 7 HA HIS 7 11.214 16.980 30.169 49 HB2 HIS 7 2HB HIS 7 11.194 14.717 31.186 50 HB3 HIS 7 1HB HIS 7 9.753 15.155 32.093 51 HD1 HIS 7 1HD HIS 7 7.541 14.910 30.938 52 HD2 HIS 7 2HD HIS 7 10.768 14.485 28.350 53 HE1 HIS 7 1HE HIS 7 6.571 14.069 28.773 54 HE2 HIS 7 2HE HIS 7 8.566 13.619 27.297 55 H HIS 8 HN HIS 8 9.595 18.066 29.207 56 HA HIS 8 HA HIS 8 7.185 18.724 30.688 57 HB2 HIS 8 2HB HIS 8 7.313 21.141 30.197 58 HB3 HIS 8 1HB HIS 8 8.606 20.623 31.267 59 HD1 HIS 8 1HD HIS 8 8.038 22.667 28.407 60 HD2 HIS 8 2HD HIS 8 11.120 20.162 29.648 61 HE1 HIS 8 1HE HIS 8 10.067 23.386 27.105 62 HE2 HIS 8 2HE HIS 8 11.928 21.871 27.878 63 H SER 9 HN SER 9 5.760 17.849 29.339 64 HA SER 9 HA SER 9 5.736 18.732 26.553 65 HB2 SER 9 2HB SER 9 5.657 15.799 27.304 66 HB3 SER 9 1HB SER 9 5.569 16.469 25.675 67 HG SER 9 HG SER 9 7.680 17.122 25.829 68 H HIS 10 HN HIS 10 3.840 19.861 27.051 69 HA HIS 10 HA HIS 10 1.444 18.410 26.693 70 HB2 HIS 10 2HB HIS 10 1.706 17.839 29.047 71 HB3 HIS 10 1HB HIS 10 1.901 19.536 29.468 72 HD1 HIS 10 1HD HIS 10 -0.167 20.812 30.025 73 HD2 HIS 10 2HD HIS 10 -1.002 17.182 28.168 74 HE1 HIS 10 1HE HIS 10 -2.670 20.546 30.146 75 HE2 HIS 10 2HE HIS 10 -3.129 18.265 29.186 76 H MET 11 HN MET 11 1.547 19.994 24.985 77 HA MET 11 HA MET 11 -0.346 22.004 25.411 78 HB2 MET 11 2HB MET 11 0.980 24.045 25.012 79 HB3 MET 11 1HB MET 11 1.368 23.272 26.538 80 HG2 MET 11 2HG MET 11 3.392 22.342 25.587 81 HG3 MET 11 1HG MET 11 3.000 23.044 24.020 82 HE1 MET 11 3HE MET 11 5.783 23.449 25.509 83 HE2 MET 11 1HE MET 11 6.059 25.168 25.223 84 HE3 MET 11 2HE MET 11 5.406 24.153 23.937 85 H ASP 12 HN ASP 12 -1.387 21.662 23.593 86 HA ASP 12 HA ASP 12 -0.564 22.772 21.183 87 HB2 ASP 12 2HB ASP 12 0.938 20.735 21.132 88 HB3 ASP 12 1HB ASP 12 -0.518 19.745 21.040 89 H TYR 13 HN TYR 13 -2.581 23.610 21.004 90 HA TYR 13 HA TYR 13 -4.776 21.674 20.736 91 HB2 TYR 13 2HB TYR 13 -4.885 24.251 22.315 92 HB3 TYR 13 1HB TYR 13 -6.280 23.245 21.944 93 HD1 TYR 13 1HD TYR 13 -6.496 21.000 22.977 94 HD2 TYR 13 2HD TYR 13 -3.358 23.668 24.061 95 HE1 TYR 13 1HE TYR 13 -6.078 19.681 25.008 96 HE2 TYR 13 2HE TYR 13 -2.929 22.348 26.091 97 HH TYR 13 HH TYR 13 -4.291 19.253 26.582 98 HA PRO 14 HA PRO 14 -5.455 24.489 17.244 99 HB2 PRO 14 2HB PRO 14 -4.950 22.659 15.269 100 HB3 PRO 14 1HB PRO 14 -3.729 23.751 15.927 101 HG2 PRO 14 2HG PRO 14 -3.918 20.876 16.201 102 HG3 PRO 14 1HG PRO 14 -2.612 21.953 16.712 103 HD2 PRO 14 2HD PRO 14 -4.783 20.778 18.297 104 HD3 PRO 14 1HD PRO 14 -3.267 21.523 18.843 105 H SER 15 HN SER 15 -7.621 24.650 16.962 106 HA SER 15 HA SER 15 -9.133 22.166 16.531 107 HB2 SER 15 2HB SER 15 -9.368 22.896 18.886 108 HB3 SER 15 1HB SER 15 -10.004 24.441 18.327 109 HG SER 15 HG SER 15 -11.182 21.975 17.574 110 H PHE 16 HN PHE 16 -9.301 22.563 14.348 111 HA PHE 16 HA PHE 16 -11.604 24.038 13.634 112 HB2 PHE 16 2HB PHE 16 -10.591 25.574 11.981 113 HB3 PHE 16 1HB PHE 16 -10.124 25.966 13.627 114 HD1 PHE 16 2HD PHE 16 -7.817 25.063 14.408 115 HD2 PHE 16 1HD PHE 16 -8.989 25.399 10.333 116 HE1 PHE 16 2HE PHE 16 -5.450 25.060 13.732 117 HE2 PHE 16 1HE PHE 16 -6.628 25.397 9.648 118 HZ PHE 16 HZ PHE 16 -4.857 25.231 11.345 119 H ASP 17 HN ASP 17 -12.569 22.669 12.324 120 HA ASP 17 HA ASP 17 -10.986 20.787 10.807 121 HB2 ASP 17 2HB ASP 17 -13.235 19.856 10.116 122 HB3 ASP 17 1HB ASP 17 -12.887 19.806 11.838 123 H LYS 18 HN LYS 18 -13.945 22.136 9.437 124 HA LYS 18 HA LYS 18 -12.457 23.785 7.575 125 HB2 LYS 18 2HB LYS 18 -13.829 21.253 6.719 126 HB3 LYS 18 1HB LYS 18 -13.704 22.616 5.618 127 HG2 LYS 18 2HG LYS 18 -11.208 22.543 6.016 128 HG3 LYS 18 1HG LYS 18 -11.480 20.997 6.822 129 HD2 LYS 18 2HD LYS 18 -12.399 20.053 4.816 130 HD3 LYS 18 1HD LYS 18 -12.342 21.618 4.003 131 HE2 LYS 18 2HE LYS 18 -9.858 21.591 4.345 132 HE3 LYS 18 1HE LYS 18 -10.022 19.924 4.895 133 HZ1 LYS 18 3HZ LYS 18 -10.728 20.989 2.216 134 HZ2 LYS 18 1HZ LYS 18 -11.054 19.411 2.735 135 HZ3 LYS 18 2HZ LYS 18 -9.454 19.937 2.588 136 H PHE 19 HN PHE 19 -13.607 25.405 6.744 137 HA PHE 19 HA PHE 19 -16.521 25.387 6.946 138 HB2 PHE 19 2HB PHE 19 -14.594 27.345 8.158 139 HB3 PHE 19 1HB PHE 19 -16.160 27.908 7.601 140 HD1 PHE 19 1HD PHE 19 -18.208 27.158 8.686 141 HD2 PHE 19 2HD PHE 19 -14.382 25.981 10.114 142 HE1 PHE 19 1HE PHE 19 -19.226 26.456 10.811 143 HE2 PHE 19 2HE PHE 19 -15.390 25.274 12.243 144 HZ PHE 19 HZ PHE 19 -17.818 25.510 12.592 145 H LEU 20 HN LEU 20 -16.585 27.568 4.102 146 HA LEU 20 HA LEU 20 -17.784 26.647 6.611 147 HB2 LEU 20 2HB LEU 20 -18.651 29.032 4.972 148 HB3 LEU 20 1HB LEU 20 -19.200 28.576 6.564 149 HG LEU 20 HG LEU 20 -16.665 28.937 7.205 150 HD11 LEU 20 1HD1 LEU 20 -15.899 29.356 4.936 151 HD12 LEU 20 2HD1 LEU 20 -15.666 30.777 5.953 152 HD13 LEU 20 3HD1 LEU 20 -17.003 30.725 4.803 153 HD21 LEU 20 3HD2 LEU 20 -17.194 31.265 7.777 154 HD22 LEU 20 1HD2 LEU 20 -18.499 30.155 8.192 155 HD23 LEU 20 2HD2 LEU 20 -18.631 31.173 6.759 156 H GLY 21 HN GLY 21 -18.698 24.759 5.883 157 HA2 GLY 21 2HA GLY 21 -21.034 24.321 4.849 158 HA3 GLY 21 1HA GLY 21 -20.235 24.849 3.374 159 H THR 22 HN THR 22 -18.804 23.491 2.330 160 HA THR 22 HA THR 22 -17.732 21.125 3.402 161 HB THR 22 HB THR 22 -20.103 20.405 3.458 162 HG1 THR 22 1HG THR 22 -19.735 18.437 2.202 163 HG21 THR 22 3HG2 THR 22 -20.970 21.672 1.571 164 HG22 THR 22 1HG2 THR 22 -21.279 19.952 1.338 165 HG23 THR 22 2HG2 THR 22 -19.969 20.740 0.459 166 H GLU 23 HN GLU 23 -16.506 19.938 1.862 167 HA GLU 23 HA GLU 23 -16.460 20.990 -0.870 168 HB2 GLU 23 2HB GLU 23 -14.695 22.115 0.470 169 HB3 GLU 23 1HB GLU 23 -13.966 20.534 0.742 170 HG2 GLU 23 2HG GLU 23 -12.995 21.891 -1.118 171 HG3 GLU 23 1HG GLU 23 -13.473 20.257 -1.544 172 H ASN 24 HN ASN 24 -16.715 19.370 -2.220 173 HA ASN 24 HA ASN 24 -15.963 16.674 -1.343 174 HB2 ASN 24 2HB ASN 24 -17.586 15.851 -2.973 175 HB3 ASN 24 1HB ASN 24 -18.347 16.972 -1.857 176 HD21 ASN 24 1HD2 ASN 24 -19.165 16.146 -4.522 177 HD22 ASN 24 2HD2 ASN 24 -19.292 17.601 -5.461 178 H ALA 25 HN ALA 25 -15.061 19.165 -3.435 179 HA ALA 25 HA ALA 25 -14.218 17.808 -5.729 180 HB1 ALA 25 1HB ALA 25 -12.735 19.693 -6.118 181 HB2 ALA 25 2HB ALA 25 -12.926 20.211 -4.443 182 HB3 ALA 25 3HB ALA 25 -14.305 20.253 -5.543 183 H GLU 26 HN GLU 26 -12.507 18.420 -2.694 184 HA GLU 26 HA GLU 26 -10.053 17.248 -3.453 185 HB2 GLU 26 2HB GLU 26 -11.276 17.653 -0.721 186 HB3 GLU 26 1HB GLU 26 -9.600 17.203 -1.012 187 HG2 GLU 26 2HG GLU 26 -9.191 19.281 -2.144 188 HG3 GLU 26 1HG GLU 26 -10.891 19.726 -2.022 189 H LEU 27 HN LEU 27 -13.015 15.969 -2.192 190 HA LEU 27 HA LEU 27 -12.002 13.424 -1.431 191 HB2 LEU 27 2HB LEU 27 -14.005 14.291 -0.411 192 HB3 LEU 27 1HB LEU 27 -14.783 14.452 -1.974 193 HG LEU 27 HG LEU 27 -14.746 11.994 -2.201 194 HD11 LEU 27 1HD1 LEU 27 -14.300 10.625 -0.217 195 HD12 LEU 27 2HD1 LEU 27 -13.780 12.069 0.654 196 HD13 LEU 27 3HD1 LEU 27 -12.861 11.501 -0.740 197 HD21 LEU 27 3HD2 LEU 27 -16.719 13.177 -1.366 198 HD22 LEU 27 1HD2 LEU 27 -16.108 13.028 0.281 199 HD23 LEU 27 2HD2 LEU 27 -16.561 11.584 -0.629 200 H VAL 28 HN VAL 28 -13.717 14.696 -4.267 201 HA VAL 28 HA VAL 28 -13.849 12.257 -5.690 202 HB VAL 28 HB VAL 28 -13.800 15.077 -6.789 203 HG11 VAL 28 1HG1 VAL 28 -14.954 14.120 -8.732 204 HG12 VAL 28 2HG1 VAL 28 -14.767 12.507 -8.039 205 HG13 VAL 28 3HG1 VAL 28 -13.344 13.431 -8.516 206 HG21 VAL 28 3HG2 VAL 28 -15.589 14.768 -5.172 207 HG22 VAL 28 1HG2 VAL 28 -16.127 13.318 -6.020 208 HG23 VAL 28 2HG2 VAL 28 -16.242 14.893 -6.805 209 H TYR 29 HN TYR 29 -11.409 14.758 -5.433 210 HA TYR 29 HA TYR 29 -9.666 14.022 -7.473 211 HB2 TYR 29 2HB TYR 29 -9.282 16.054 -6.284 212 HB3 TYR 29 1HB TYR 29 -9.189 15.215 -4.742 213 HD1 TYR 29 2HD TYR 29 -7.396 15.726 -7.957 214 HD2 TYR 29 1HD TYR 29 -7.147 14.425 -3.914 215 HE1 TYR 29 2HE TYR 29 -4.945 15.613 -8.147 216 HE2 TYR 29 1HE TYR 29 -4.699 14.319 -4.089 217 HH TYR 29 HH TYR 29 -2.970 15.750 -6.557 218 H VAL 30 HN VAL 30 -10.054 12.676 -4.240 219 HA VAL 30 HA VAL 30 -7.784 10.952 -4.402 220 HB VAL 30 HB VAL 30 -10.168 10.801 -2.550 221 HG11 VAL 30 1HG1 VAL 30 -8.717 9.487 -1.095 222 HG12 VAL 30 2HG1 VAL 30 -7.434 9.556 -2.304 223 HG13 VAL 30 3HG1 VAL 30 -8.936 8.700 -2.659 224 HG21 VAL 30 3HG2 VAL 30 -9.037 12.934 -2.354 225 HG22 VAL 30 1HG2 VAL 30 -7.482 12.119 -2.180 226 HG23 VAL 30 2HG2 VAL 30 -8.715 11.941 -0.933 227 H LEU 31 HN LEU 31 -11.177 10.675 -5.196 228 HA LEU 31 HA LEU 31 -11.436 7.889 -5.195 229 HB2 LEU 31 2HB LEU 31 -12.889 9.911 -6.889 230 HB3 LEU 31 1HB LEU 31 -13.395 8.254 -6.631 231 HG LEU 31 HG LEU 31 -13.228 10.399 -4.515 232 HD11 LEU 31 1HD1 LEU 31 -15.588 9.067 -5.833 233 HD12 LEU 31 2HD1 LEU 31 -15.080 10.744 -6.039 234 HD13 LEU 31 3HD1 LEU 31 -15.671 10.186 -4.474 235 HD21 LEU 31 3HD2 LEU 31 -12.698 8.221 -3.587 236 HD22 LEU 31 1HD2 LEU 31 -14.136 7.529 -4.338 237 HD23 LEU 31 2HD2 LEU 31 -14.301 8.736 -3.064 238 H ARG 32 HN ARG 32 -10.084 6.605 -6.267 239 HA ARG 32 HA ARG 32 -9.938 6.943 -9.185 240 HB2 ARG 32 2HB ARG 32 -7.739 6.568 -7.258 241 HB3 ARG 32 1HB ARG 32 -7.692 5.474 -8.634 242 HG2 ARG 32 2HG ARG 32 -6.371 7.447 -9.088 243 HG3 ARG 32 1HG ARG 32 -7.772 7.396 -10.157 244 HD2 ARG 32 2HD ARG 32 -8.929 8.945 -8.575 245 HD3 ARG 32 1HD ARG 32 -7.412 9.090 -7.692 246 HE ARG 32 HE ARG 32 -6.544 9.856 -10.014 247 HH11 ARG 32 1HH1 ARG 32 -9.722 10.510 -8.701 248 HH12 ARG 32 2HH1 ARG 32 -9.880 12.042 -9.497 249 HH21 ARG 32 1HH2 ARG 32 -6.746 11.859 -11.090 250 HH22 ARG 32 2HH2 ARG 32 -8.166 12.834 -10.833 251 H HIS 33 HN HIS 33 -8.845 4.539 -9.891 252 HA HIS 33 HA HIS 33 -11.104 2.815 -9.448 253 HB2 HIS 33 2HB HIS 33 -9.747 3.151 -11.638 254 HB3 HIS 33 1HB HIS 33 -8.617 2.000 -10.930 255 HD1 HIS 33 1HD HIS 33 -12.130 2.268 -12.233 256 HD2 HIS 33 2HD HIS 33 -9.436 -0.655 -11.005 257 HE1 HIS 33 1HE HIS 33 -13.188 0.070 -12.843 258 HE2 HIS 33 2HE HIS 33 -11.455 -1.673 -12.273 259 H LYS 34 HN LYS 34 -11.117 0.783 -8.502 260 HA LYS 34 HA LYS 34 -9.400 0.445 -6.254 261 HB2 LYS 34 2HB LYS 34 -11.867 -0.242 -6.549 262 HB3 LYS 34 1HB LYS 34 -11.242 -1.656 -7.380 263 HG2 LYS 34 2HG LYS 34 -9.999 -2.284 -5.370 264 HG3 LYS 34 1HG LYS 34 -10.639 -0.868 -4.538 265 HD2 LYS 34 2HD LYS 34 -12.287 -3.137 -5.663 266 HD3 LYS 34 1HD LYS 34 -11.872 -2.919 -3.963 267 HE2 LYS 34 2HE LYS 34 -14.017 -2.047 -4.090 268 HE3 LYS 34 1HE LYS 34 -13.003 -0.614 -4.216 269 HZ1 LYS 34 3HZ LYS 34 -14.347 -2.035 -6.456 270 HZ2 LYS 34 1HZ LYS 34 -13.284 -0.730 -6.649 271 HZ3 LYS 34 2HZ LYS 34 -14.750 -0.510 -5.834 272 H HIS 35 HN HIS 35 -8.356 -1.771 -5.838 273 HA HIS 35 HA HIS 35 -6.887 -2.607 -8.248 274 HB2 HIS 35 2HB HIS 35 -5.782 -2.170 -5.465 275 HB3 HIS 35 1HB HIS 35 -4.887 -2.916 -6.783 276 HD1 HIS 35 1HD HIS 35 -3.970 -1.377 -8.624 277 HD2 HIS 35 2HD HIS 35 -6.145 0.619 -5.689 278 HE1 HIS 35 1HE HIS 35 -3.508 1.067 -8.977 279 HE2 HIS 35 2HE HIS 35 -5.010 2.253 -7.346 280 H GLY 36 HN GLY 36 -5.383 -4.630 -7.159 281 HA2 GLY 36 2HA GLY 36 -7.350 -6.722 -7.069 282 HA3 GLY 36 1HA GLY 36 -5.610 -6.925 -7.095 283 H GLN 37 HN GLN 37 -5.983 -8.638 -5.558 284 HA GLN 37 HA GLN 37 -7.095 -7.967 -2.976 285 HB2 GLN 37 2HB GLN 37 -7.317 -10.210 -4.241 286 HB3 GLN 37 1HB GLN 37 -5.695 -10.541 -3.647 287 HG2 GLN 37 2HG GLN 37 -6.515 -10.194 -1.341 288 HG3 GLN 37 1HG GLN 37 -8.141 -9.998 -1.989 289 HE21 GLN 37 1HE2 GLN 37 -7.237 -11.947 -0.108 290 HE22 GLN 37 2HE2 GLN 37 -7.489 -13.507 -0.822 291 H PHE 38 HN PHE 38 -3.996 -9.470 -3.913 292 HA PHE 38 HA PHE 38 -2.724 -7.993 -1.697 293 HB2 PHE 38 2HB PHE 38 -1.910 -10.651 -2.895 294 HB3 PHE 38 1HB PHE 38 -1.040 -9.800 -1.627 295 HD1 PHE 38 2HD PHE 38 -2.550 -9.205 0.484 296 HD2 PHE 38 1HD PHE 38 -3.317 -12.342 -2.289 297 HE1 PHE 38 2HE PHE 38 -3.897 -10.371 2.180 298 HE2 PHE 38 1HE PHE 38 -4.663 -13.515 -0.597 299 HZ PHE 38 HZ PHE 38 -4.955 -12.528 1.645 300 H ILE 39 HN ILE 39 -1.712 -6.285 -2.554 301 HA ILE 39 HA ILE 39 0.088 -6.749 -4.826 302 HB ILE 39 HB ILE 39 -1.884 -4.466 -4.642 303 HG12 ILE 39 2HG1 ILE 39 -1.555 -6.680 -6.684 304 HG13 ILE 39 1HG1 ILE 39 -2.852 -6.552 -5.503 305 HG21 ILE 39 1HG2 ILE 39 0.259 -3.641 -5.436 306 HG22 ILE 39 2HG2 ILE 39 -0.912 -3.671 -6.756 307 HG23 ILE 39 3HG2 ILE 39 0.325 -4.922 -6.648 308 HD11 ILE 39 3HD1 ILE 39 -2.327 -4.671 -7.788 309 HD12 ILE 39 1HD1 ILE 39 -3.589 -4.469 -6.574 310 HD13 ILE 39 2HD1 ILE 39 -3.632 -5.851 -7.668 311 H TYR 40 HN TYR 40 2.016 -5.794 -4.649 312 HA TYR 40 HA TYR 40 2.364 -3.698 -2.612 313 HB2 TYR 40 2HB TYR 40 3.719 -5.697 -2.150 314 HB3 TYR 40 1HB TYR 40 4.428 -5.601 -3.759 315 HD1 TYR 40 1HD TYR 40 4.366 -4.120 -0.408 316 HD2 TYR 40 2HD TYR 40 6.126 -3.946 -4.272 317 HE1 TYR 40 1HE TYR 40 6.135 -2.659 0.473 318 HE2 TYR 40 2HE TYR 40 7.898 -2.483 -3.404 319 HH TYR 40 HH TYR 40 8.504 -2.035 -0.145 320 H VAL 41 HN VAL 41 2.893 -1.735 -3.293 321 HA VAL 41 HA VAL 41 3.915 -1.455 -6.040 322 HB VAL 41 HB VAL 41 3.023 0.858 -6.013 323 HG11 VAL 41 1HG1 VAL 41 0.671 0.259 -6.304 324 HG12 VAL 41 2HG1 VAL 41 0.953 -1.276 -5.481 325 HG13 VAL 41 3HG1 VAL 41 1.732 -0.950 -7.030 326 HG21 VAL 41 3HG2 VAL 41 1.381 1.497 -4.304 327 HG22 VAL 41 1HG2 VAL 41 2.985 1.250 -3.615 328 HG23 VAL 41 2HG2 VAL 41 1.740 0.017 -3.416 329 H TRP 42 HN TRP 42 5.776 -0.327 -6.363 330 HA TRP 42 HA TRP 42 7.107 0.671 -3.931 331 HB2 TRP 42 2HB TRP 42 9.238 -0.033 -4.871 332 HB3 TRP 42 1HB TRP 42 8.134 -1.399 -4.799 333 HD1 TRP 42 1HD TRP 42 6.942 -2.052 -7.259 334 HE1 TRP 42 1HE TRP 42 8.009 -2.001 -9.603 335 HE3 TRP 42 3HE TRP 42 10.877 1.067 -6.296 336 HZ2 TRP 42 2HZ TRP 42 10.227 -0.808 -10.866 337 HZ3 TRP 42 3HZ TRP 42 12.424 1.610 -8.127 338 HH2 TRP 42 2HH TRP 42 12.104 0.689 -10.363 339 H GLY 43 HN GLY 43 5.559 1.811 -6.455 340 HA2 GLY 43 2HA GLY 43 7.071 4.263 -6.516 341 HA3 GLY 43 1HA GLY 43 7.108 3.378 -8.032 342 H GLU 44 HN GLU 44 4.984 4.931 -5.692 343 HA GLU 44 HA GLU 44 2.827 5.070 -7.636 344 HB2 GLU 44 2HB GLU 44 1.700 6.420 -5.796 345 HB3 GLU 44 1HB GLU 44 2.053 4.740 -5.421 346 HG2 GLU 44 2HG GLU 44 3.326 5.304 -3.691 347 HG3 GLU 44 1HG GLU 44 4.235 6.476 -4.646 348 H GLU 45 HN GLU 45 3.696 6.316 -9.279 349 HA GLU 45 HA GLU 45 4.221 8.197 -10.446 350 HB2 GLU 45 2HB GLU 45 3.489 9.623 -7.877 351 HB3 GLU 45 1HB GLU 45 3.895 10.442 -9.379 352 HG2 GLU 45 2HG GLU 45 1.965 9.643 -10.458 353 HG3 GLU 45 1HG GLU 45 1.666 8.440 -9.204 354 H GLY 46 HN GLY 46 5.422 8.487 -7.120 355 HA2 GLY 46 2HA GLY 46 8.139 8.108 -8.003 356 HA3 GLY 46 1HA GLY 46 7.809 9.735 -7.411 357 H ALA 47 HN ALA 47 7.538 10.096 -5.275 358 HA ALA 47 HA ALA 47 7.113 7.868 -3.455 359 HB1 ALA 47 1HB ALA 47 8.978 8.433 -2.007 360 HB2 ALA 47 2HB ALA 47 9.472 9.724 -3.102 361 HB3 ALA 47 3HB ALA 47 9.571 8.043 -3.624 362 H GLY 48 HN GLY 48 5.061 8.993 -3.369 363 HA2 GLY 48 2HA GLY 48 5.139 11.634 -2.084 364 HA3 GLY 48 1HA GLY 48 3.744 10.913 -2.875 365 H LYS 49 HN LYS 49 2.406 9.556 -1.744 366 HA LYS 49 HA LYS 49 2.864 8.288 0.657 367 HB2 LYS 49 2HB LYS 49 3.249 10.519 1.626 368 HB3 LYS 49 1HB LYS 49 1.643 11.019 1.105 369 HG2 LYS 49 2HG LYS 49 0.798 9.038 2.486 370 HG3 LYS 49 1HG LYS 49 2.401 9.049 3.224 371 HD2 LYS 49 2HD LYS 49 2.087 11.235 4.071 372 HD3 LYS 49 1HD LYS 49 0.640 11.483 3.086 373 HE2 LYS 49 2HE LYS 49 0.967 9.570 5.391 374 HE3 LYS 49 1HE LYS 49 -0.026 11.028 5.355 375 HZ1 LYS 49 3HZ LYS 49 -0.438 8.648 3.619 376 HZ2 LYS 49 1HZ LYS 49 -1.422 10.028 3.676 377 HZ3 LYS 49 2HZ LYS 49 -1.329 8.990 5.020 378 H SER 50 HN SER 50 1.430 6.752 0.169 379 HA SER 50 HA SER 50 -0.563 5.669 0.037 380 HB2 SER 50 2HB SER 50 -1.941 8.026 1.266 381 HB3 SER 50 1HB SER 50 -2.146 6.310 1.606 382 HG SER 50 HG SER 50 -0.739 6.520 3.157 383 H HIS 51 HN HIS 51 0.049 7.429 -2.309 384 HA HIS 51 HA HIS 51 -2.227 8.984 -2.978 385 HB2 HIS 51 2HB HIS 51 0.009 7.839 -4.640 386 HB3 HIS 51 1HB HIS 51 -1.310 8.742 -5.374 387 HD1 HIS 51 1HD HIS 51 0.399 10.555 -6.127 388 HD2 HIS 51 2HD HIS 51 0.061 10.094 -2.003 389 HE1 HIS 51 1HE HIS 51 1.497 12.585 -5.118 390 HE2 HIS 51 2HE HIS 51 1.237 12.313 -2.624 391 H LEU 52 HN LEU 52 -1.223 5.853 -4.374 392 HA LEU 52 HA LEU 52 -3.856 5.442 -5.446 393 HB2 LEU 52 2HB LEU 52 -3.000 3.273 -6.226 394 HB3 LEU 52 1HB LEU 52 -1.998 4.618 -6.721 395 HG LEU 52 HG LEU 52 -0.601 3.928 -4.582 396 HD11 LEU 52 1HD1 LEU 52 -0.564 1.491 -4.304 397 HD12 LEU 52 2HD1 LEU 52 -1.959 1.355 -5.375 398 HD13 LEU 52 3HD1 LEU 52 -2.113 2.184 -3.825 399 HD21 LEU 52 3HD2 LEU 52 -0.515 2.434 -7.197 400 HD22 LEU 52 1HD2 LEU 52 0.805 2.565 -6.035 401 HD23 LEU 52 2HD2 LEU 52 0.224 4.003 -6.875 402 H LEU 53 HN LEU 53 -2.237 4.724 -2.528 403 HA LEU 53 HA LEU 53 -3.675 2.387 -1.802 404 HB2 LEU 53 2HB LEU 53 -2.118 4.340 -0.110 405 HB3 LEU 53 1HB LEU 53 -2.788 2.837 0.490 406 HG LEU 53 HG LEU 53 -1.346 1.728 -1.370 407 HD11 LEU 53 1HD1 LEU 53 0.058 4.377 -1.069 408 HD12 LEU 53 2HD1 LEU 53 -0.701 3.755 -2.535 409 HD13 LEU 53 3HD1 LEU 53 0.719 2.949 -1.868 410 HD21 LEU 53 3HD2 LEU 53 -0.080 2.961 1.070 411 HD22 LEU 53 1HD2 LEU 53 0.546 1.586 0.160 412 HD23 LEU 53 2HD2 LEU 53 -0.986 1.449 1.024 413 H GLN 54 HN GLN 54 -4.068 5.830 -1.001 414 HA GLN 54 HA GLN 54 -6.144 5.426 0.892 415 HB2 GLN 54 2HB GLN 54 -4.670 7.488 0.624 416 HB3 GLN 54 1HB GLN 54 -5.698 7.934 -0.729 417 HG2 GLN 54 2HG GLN 54 -7.635 7.972 0.776 418 HG3 GLN 54 1HG GLN 54 -6.578 7.566 2.127 419 HE21 GLN 54 1HE2 GLN 54 -5.089 9.113 2.861 420 HE22 GLN 54 2HE2 GLN 54 -5.267 10.790 2.489 421 H ALA 55 HN ALA 55 -6.084 6.014 -2.562 422 HA ALA 55 HA ALA 55 -8.837 6.392 -2.985 423 HB1 ALA 55 1HB ALA 55 -6.767 5.210 -4.834 424 HB2 ALA 55 2HB ALA 55 -7.164 6.921 -4.679 425 HB3 ALA 55 3HB ALA 55 -8.361 5.793 -5.315 426 H TRP 56 HN TRP 56 -6.823 3.505 -2.977 427 HA TRP 56 HA TRP 56 -8.724 1.617 -3.782 428 HB2 TRP 56 2HB TRP 56 -6.304 1.196 -3.688 429 HB3 TRP 56 1HB TRP 56 -6.342 1.305 -1.935 430 HD1 TRP 56 1HD TRP 56 -7.844 -0.935 -4.723 431 HE1 TRP 56 1HE TRP 56 -7.948 -3.349 -3.820 432 HE3 TRP 56 3HE TRP 56 -6.233 -0.083 0.051 433 HZ2 TRP 56 2HZ TRP 56 -7.430 -4.696 -1.406 434 HZ3 TRP 56 3HZ TRP 56 -6.069 -1.991 1.595 435 HH2 TRP 56 2HH TRP 56 -6.656 -4.248 0.882 436 H VAL 57 HN VAL 57 -7.815 2.768 -0.564 437 HA VAL 57 HA VAL 57 -9.515 1.053 0.895 438 HB VAL 57 HB VAL 57 -8.335 3.730 1.640 439 HG11 VAL 57 1HG1 VAL 57 -10.294 3.280 3.027 440 HG12 VAL 57 2HG1 VAL 57 -8.807 3.145 3.965 441 HG13 VAL 57 3HG1 VAL 57 -9.649 1.689 3.434 442 HG21 VAL 57 3HG2 VAL 57 -6.764 2.329 2.943 443 HG22 VAL 57 1HG2 VAL 57 -6.654 2.070 1.203 444 HG23 VAL 57 2HG2 VAL 57 -7.492 0.897 2.218 445 H ALA 58 HN ALA 58 -9.937 4.434 -0.158 446 HA ALA 58 HA ALA 58 -12.435 4.846 1.069 447 HB1 ALA 58 1HB ALA 58 -10.998 6.650 0.206 448 HB2 ALA 58 2HB ALA 58 -12.654 6.778 -0.380 449 HB3 ALA 58 3HB ALA 58 -11.386 6.159 -1.441 450 H GLN 59 HN GLN 59 -11.600 3.574 -2.127 451 HA GLN 59 HA GLN 59 -14.245 3.453 -3.109 452 HB2 GLN 59 2HB GLN 59 -11.699 2.059 -3.853 453 HB3 GLN 59 1HB GLN 59 -13.218 1.606 -4.612 454 HG2 GLN 59 2HG GLN 59 -11.998 4.358 -4.624 455 HG3 GLN 59 1HG GLN 59 -11.977 3.206 -5.959 456 HE21 GLN 59 1HE2 GLN 59 -13.905 5.432 -4.127 457 HE22 GLN 59 2HE2 GLN 59 -15.270 5.444 -5.187 458 H ALA 60 HN ALA 60 -12.274 1.160 -1.289 459 HA ALA 60 HA ALA 60 -14.115 -0.992 -1.385 460 HB1 ALA 60 1HB ALA 60 -12.021 -0.382 0.699 461 HB2 ALA 60 2HB ALA 60 -11.756 -1.279 -0.796 462 HB3 ALA 60 3HB ALA 60 -12.822 -1.933 0.448 463 H LEU 61 HN LEU 61 -13.615 1.682 0.839 464 HA LEU 61 HA LEU 61 -15.421 0.966 2.844 465 HB2 LEU 61 2HB LEU 61 -14.454 3.643 1.857 466 HB3 LEU 61 1HB LEU 61 -15.508 3.488 3.246 467 HG LEU 61 HG LEU 61 -12.754 2.274 3.016 468 HD11 LEU 61 1HD1 LEU 61 -12.109 3.964 4.652 469 HD12 LEU 61 2HD1 LEU 61 -13.729 4.655 4.586 470 HD13 LEU 61 3HD1 LEU 61 -12.691 4.707 3.162 471 HD21 LEU 61 3HD2 LEU 61 -13.025 1.772 5.386 472 HD22 LEU 61 1HD2 LEU 61 -14.275 0.976 4.428 473 HD23 LEU 61 2HD2 LEU 61 -14.660 2.431 5.349 474 H GLU 62 HN GLU 62 -15.940 2.987 -0.039 475 HA GLU 62 HA GLU 62 -18.725 3.326 0.566 476 HB2 GLU 62 2HB GLU 62 -17.167 3.974 -1.939 477 HB3 GLU 62 1HB GLU 62 -18.841 4.434 -1.644 478 HG2 GLU 62 2HG GLU 62 -18.082 5.660 0.374 479 HG3 GLU 62 1HG GLU 62 -16.421 5.307 -0.105 480 H ALA 63 HN ALA 63 -16.916 0.881 -0.864 481 HA ALA 63 HA ALA 63 -19.052 -0.210 -2.473 482 HB1 ALA 63 1HB ALA 63 -16.736 -0.645 -3.095 483 HB2 ALA 63 2HB ALA 63 -17.583 -2.151 -2.742 484 HB3 ALA 63 3HB ALA 63 -16.468 -1.471 -1.558 485 H GLY 64 HN GLY 64 -18.558 0.076 0.774 486 HA2 GLY 64 2HA GLY 64 -20.136 -0.656 2.361 487 HA3 GLY 64 1HA GLY 64 -20.600 -1.953 1.271 488 H LYS 65 HN LYS 65 -17.254 -1.698 1.520 489 HA LYS 65 HA LYS 65 -17.240 -4.008 3.328 490 HB2 LYS 65 2HB LYS 65 -15.020 -3.232 1.438 491 HB3 LYS 65 1HB LYS 65 -15.265 -4.773 2.242 492 HG2 LYS 65 2HG LYS 65 -16.871 -3.622 -0.025 493 HG3 LYS 65 1HG LYS 65 -15.796 -5.018 -0.071 494 HD2 LYS 65 2HD LYS 65 -17.305 -6.187 1.500 495 HD3 LYS 65 1HD LYS 65 -18.395 -4.800 1.446 496 HE2 LYS 65 2HE LYS 65 -17.670 -6.688 -0.780 497 HE3 LYS 65 1HE LYS 65 -19.259 -6.404 -0.071 498 HZ1 LYS 65 3HZ LYS 65 -19.069 -4.073 -0.954 499 HZ2 LYS 65 1HZ LYS 65 -19.206 -5.281 -2.139 500 HZ3 LYS 65 2HZ LYS 65 -17.698 -4.581 -1.816 501 H ASN 66 HN ASN 66 -15.301 -4.170 4.711 502 HA ASN 66 HA ASN 66 -14.808 -1.571 5.911 503 HB2 ASN 66 2HB ASN 66 -15.421 -3.692 7.237 504 HB3 ASN 66 1HB ASN 66 -13.763 -4.198 6.954 505 HD21 ASN 66 1HD2 ASN 66 -13.461 -4.140 9.252 506 HD22 ASN 66 2HD2 ASN 66 -13.190 -2.623 10.055 507 H ALA 67 HN ALA 67 -12.903 -0.539 5.919 508 HA ALA 67 HA ALA 67 -10.500 -1.858 4.960 509 HB1 ALA 67 1HB ALA 67 -11.667 0.523 3.519 510 HB2 ALA 67 2HB ALA 67 -11.616 -1.131 2.907 511 HB3 ALA 67 3HB ALA 67 -10.115 -0.246 3.180 512 H ALA 68 HN ALA 68 -8.588 -0.617 5.322 513 HA ALA 68 HA ALA 68 -8.827 1.908 6.734 514 HB1 ALA 68 1HB ALA 68 -7.555 -0.483 8.066 515 HB2 ALA 68 2HB ALA 68 -9.089 0.254 8.529 516 HB3 ALA 68 3HB ALA 68 -7.585 1.164 8.694 517 H TYR 69 HN TYR 69 -7.070 3.175 6.419 518 HA TYR 69 HA TYR 69 -4.733 1.952 5.128 519 HB2 TYR 69 2HB TYR 69 -4.225 4.186 4.225 520 HB3 TYR 69 1HB TYR 69 -5.823 3.651 3.724 521 HD1 TYR 69 2HD TYR 69 -7.846 4.654 4.815 522 HD2 TYR 69 1HD TYR 69 -3.930 6.181 5.482 523 HE1 TYR 69 2HE TYR 69 -8.813 6.753 5.657 524 HE2 TYR 69 1HE TYR 69 -4.888 8.284 6.320 525 HH TYR 69 HH TYR 69 -8.159 8.621 7.139 526 H ILE 70 HN ILE 70 -2.856 2.010 6.150 527 HA ILE 70 HA ILE 70 -2.651 3.684 8.561 528 HB ILE 70 HB ILE 70 -1.571 0.884 8.205 529 HG12 ILE 70 2HG1 ILE 70 -3.743 1.931 10.040 530 HG13 ILE 70 1HG1 ILE 70 -4.026 1.012 8.567 531 HG21 ILE 70 1HG2 ILE 70 -1.419 2.743 10.576 532 HG22 ILE 70 2HG2 ILE 70 -0.075 2.273 9.534 533 HG23 ILE 70 3HG2 ILE 70 -0.873 1.066 10.542 534 HD11 ILE 70 3HD1 ILE 70 -2.871 -0.904 9.537 535 HD12 ILE 70 1HD1 ILE 70 -4.232 -0.389 10.534 536 HD13 ILE 70 2HD1 ILE 70 -2.586 0.018 11.014 537 H ASP 71 HN ASP 71 -1.195 5.180 8.251 538 HA ASP 71 HA ASP 71 1.002 4.702 6.382 539 HB2 ASP 71 2HB ASP 71 0.306 7.313 7.729 540 HB3 ASP 71 1HB ASP 71 1.313 7.072 6.309 541 H ALA 72 HN ALA 72 2.789 3.903 7.303 542 HA ALA 72 HA ALA 72 3.152 3.639 10.048 543 HB1 ALA 72 1HB ALA 72 4.243 2.215 8.400 544 HB2 ALA 72 2HB ALA 72 5.414 2.893 9.532 545 HB3 ALA 72 3HB ALA 72 5.268 3.561 7.908 546 H ALA 73 HN ALA 73 3.984 6.303 7.992 547 HA ALA 73 HA ALA 73 5.593 7.518 10.124 548 HB1 ALA 73 1HB ALA 73 6.639 7.420 7.918 549 HB2 ALA 73 2HB ALA 73 6.369 9.086 8.426 550 HB3 ALA 73 3HB ALA 73 5.298 8.346 7.237 551 H SER 74 HN SER 74 2.735 7.295 10.297 552 HA SER 74 HA SER 74 2.182 10.046 10.967 553 HB2 SER 74 2HB SER 74 1.455 9.974 8.608 554 HB3 SER 74 1HB SER 74 0.424 8.592 8.967 555 HG SER 74 HG SER 74 -0.962 10.210 9.157 556 H MET 75 HN MET 75 1.105 6.715 10.723 557 HA MET 75 HA MET 75 -0.193 6.940 13.342 558 HB2 MET 75 2HB MET 75 -1.404 5.767 10.833 559 HB3 MET 75 1HB MET 75 -2.051 5.490 12.441 560 HG2 MET 75 2HG MET 75 -2.328 7.950 12.680 561 HG3 MET 75 1HG MET 75 -1.828 8.117 11.001 562 HE1 MET 75 3HE MET 75 -4.695 6.215 9.117 563 HE2 MET 75 1HE MET 75 -3.137 5.590 9.659 564 HE3 MET 75 2HE MET 75 -3.238 7.192 8.931 565 HA PRO 76 HA PRO 76 1.989 3.110 13.834 566 HB2 PRO 76 2HB PRO 76 1.053 2.376 16.241 567 HB3 PRO 76 1HB PRO 76 2.134 3.758 16.040 568 HG2 PRO 76 2HG PRO 76 -0.811 3.701 16.487 569 HG3 PRO 76 1HG PRO 76 0.394 4.856 17.079 570 HD2 PRO 76 2HD PRO 76 -1.298 5.243 14.895 571 HD3 PRO 76 1HD PRO 76 0.175 6.167 15.239 572 H LEU 77 HN LEU 77 1.684 0.854 13.851 573 HA LEU 77 HA LEU 77 -0.789 -0.037 12.707 574 HB2 LEU 77 2HB LEU 77 1.400 -0.977 12.044 575 HB3 LEU 77 1HB LEU 77 1.593 -1.635 13.657 576 HG LEU 77 HG LEU 77 -0.345 -3.108 13.297 577 HD11 LEU 77 1HD1 LEU 77 -0.364 -1.975 10.501 578 HD12 LEU 77 2HD1 LEU 77 -1.583 -1.682 11.740 579 HD13 LEU 77 3HD1 LEU 77 -1.357 -3.308 11.094 580 HD21 LEU 77 3HD2 LEU 77 0.680 -4.585 11.646 581 HD22 LEU 77 1HD2 LEU 77 1.884 -3.916 12.746 582 HD23 LEU 77 2HD2 LEU 77 1.728 -3.269 11.113 583 H THR 78 HN THR 78 -2.311 -1.433 13.639 584 HA THR 78 HA THR 78 -2.150 -1.854 16.517 585 HB THR 78 HB THR 78 -4.660 -0.946 16.456 586 HG1 THR 78 1HG THR 78 -3.313 0.704 14.557 587 HG21 THR 78 3HG2 THR 78 -3.815 1.215 17.285 588 HG22 THR 78 1HG2 THR 78 -2.209 0.810 16.680 589 HG23 THR 78 2HG2 THR 78 -2.930 -0.144 17.978 590 H ASP 79 HN ASP 79 -4.002 -3.163 17.311 591 HA ASP 79 HA ASP 79 -4.263 -5.487 15.690 592 HB2 ASP 79 2HB ASP 79 -5.473 -6.436 17.562 593 HB3 ASP 79 1HB ASP 79 -4.081 -5.551 18.172 594 H ALA 80 HN ALA 80 -6.172 -2.668 16.169 595 HA ALA 80 HA ALA 80 -8.733 -3.554 15.543 596 HB1 ALA 80 1HB ALA 80 -7.491 -0.917 14.768 597 HB2 ALA 80 2HB ALA 80 -8.182 -1.289 16.347 598 HB3 ALA 80 3HB ALA 80 -9.214 -1.266 14.917 599 H ALA 81 HN ALA 81 -5.951 -3.215 13.534 600 HA ALA 81 HA ALA 81 -7.136 -2.873 11.020 601 HB1 ALA 81 1HB ALA 81 -4.739 -2.570 11.467 602 HB2 ALA 81 2HB ALA 81 -5.031 -3.653 10.106 603 HB3 ALA 81 3HB ALA 81 -4.570 -4.314 11.674 604 H PHE 82 HN PHE 82 -6.902 -5.694 13.041 605 HA PHE 82 HA PHE 82 -7.188 -7.655 11.020 606 HB2 PHE 82 2HB PHE 82 -7.568 -7.621 13.982 607 HB3 PHE 82 1HB PHE 82 -8.193 -8.985 13.060 608 HD1 PHE 82 2HD PHE 82 -6.599 -10.282 11.612 609 HD2 PHE 82 1HD PHE 82 -5.295 -7.484 14.533 610 HE1 PHE 82 2HE PHE 82 -4.373 -11.332 11.617 611 HE2 PHE 82 1HE PHE 82 -3.066 -8.524 14.541 612 HZ PHE 82 HZ PHE 82 -2.602 -10.451 13.080 613 H GLU 83 HN GLU 83 -9.425 -5.436 12.343 614 HA GLU 83 HA GLU 83 -11.741 -7.078 11.818 615 HB2 GLU 83 2HB GLU 83 -11.502 -4.182 12.590 616 HB3 GLU 83 1HB GLU 83 -13.002 -5.086 12.500 617 HG2 GLU 83 2HG GLU 83 -12.037 -6.654 14.203 618 HG3 GLU 83 1HG GLU 83 -10.714 -5.510 14.387 619 H ALA 84 HN ALA 84 -9.794 -4.906 10.094 620 HA ALA 84 HA ALA 84 -11.806 -4.137 8.173 621 HB1 ALA 84 1HB ALA 84 -10.022 -2.574 8.732 622 HB2 ALA 84 2HB ALA 84 -9.966 -3.006 7.023 623 HB3 ALA 84 3HB ALA 84 -8.818 -3.725 8.152 624 H GLU 85 HN GLU 85 -12.056 -4.940 6.159 625 HA GLU 85 HA GLU 85 -10.878 -7.533 5.616 626 HB2 GLU 85 2HB GLU 85 -13.314 -6.831 5.160 627 HB3 GLU 85 1HB GLU 85 -12.672 -5.976 3.766 628 HG2 GLU 85 2HG GLU 85 -13.515 -8.138 3.099 629 HG3 GLU 85 1HG GLU 85 -11.766 -8.072 2.894 630 H TYR 86 HN TYR 86 -10.703 -4.242 4.455 631 HA TYR 86 HA TYR 86 -8.575 -5.004 2.555 632 HB2 TYR 86 2HB TYR 86 -10.329 -2.537 2.632 633 HB3 TYR 86 1HB TYR 86 -9.014 -2.786 1.496 634 HD1 TYR 86 2HD TYR 86 -12.152 -4.505 2.622 635 HD2 TYR 86 1HD TYR 86 -9.553 -3.563 -0.610 636 HE1 TYR 86 2HE TYR 86 -13.729 -5.552 1.056 637 HE2 TYR 86 1HE TYR 86 -11.129 -4.606 -2.186 638 HH TYR 86 HH TYR 86 -12.938 -6.266 -2.180 639 H LEU 87 HN LEU 87 -6.594 -4.692 3.409 640 HA LEU 87 HA LEU 87 -6.202 -2.363 5.176 641 HB2 LEU 87 2HB LEU 87 -4.813 -5.023 5.093 642 HB3 LEU 87 1HB LEU 87 -4.085 -3.635 5.872 643 HG LEU 87 HG LEU 87 -5.088 -4.903 7.586 644 HD11 LEU 87 1HD1 LEU 87 -5.444 -2.514 7.790 645 HD12 LEU 87 2HD1 LEU 87 -6.794 -3.414 8.481 646 HD13 LEU 87 3HD1 LEU 87 -6.961 -2.648 6.900 647 HD21 LEU 87 3HD2 LEU 87 -7.614 -4.955 5.943 648 HD22 LEU 87 1HD2 LEU 87 -7.418 -5.626 7.562 649 HD23 LEU 87 2HD2 LEU 87 -6.518 -6.310 6.208 650 H ALA 88 HN ALA 88 -4.984 -0.772 4.469 651 HA ALA 88 HA ALA 88 -2.950 -1.359 2.412 652 HB1 ALA 88 1HB ALA 88 -4.507 1.208 2.700 653 HB2 ALA 88 2HB ALA 88 -4.826 -0.040 1.498 654 HB3 ALA 88 3HB ALA 88 -3.299 0.841 1.470 655 H VAL 89 HN VAL 89 -0.927 -0.922 3.032 656 HA VAL 89 HA VAL 89 -0.566 0.876 5.341 657 HB VAL 89 HB VAL 89 1.135 -1.543 4.721 658 HG11 VAL 89 1HG1 VAL 89 2.072 -1.151 6.962 659 HG12 VAL 89 2HG1 VAL 89 1.101 0.316 7.097 660 HG13 VAL 89 3HG1 VAL 89 2.361 0.202 5.869 661 HG21 VAL 89 3HG2 VAL 89 -1.067 -2.274 5.418 662 HG22 VAL 89 1HG2 VAL 89 -1.014 -1.194 6.812 663 HG23 VAL 89 2HG2 VAL 89 0.096 -2.560 6.711 664 H ASP 90 HN ASP 90 0.415 2.662 4.769 665 HA ASP 90 HA ASP 90 2.185 2.707 2.449 666 HB2 ASP 90 2HB ASP 90 0.494 4.473 2.622 667 HB3 ASP 90 1HB ASP 90 1.125 4.946 4.193 668 H GLN 91 HN GLN 91 4.333 2.890 2.570 669 HA GLN 91 HA GLN 91 6.437 2.876 3.413 670 HB2 GLN 91 2HB GLN 91 5.124 4.634 5.486 671 HB3 GLN 91 1HB GLN 91 6.852 4.309 5.453 672 HG2 GLN 91 2HG GLN 91 7.105 5.388 3.356 673 HG3 GLN 91 1HG GLN 91 5.360 5.491 3.128 674 HE21 GLN 91 1HE2 GLN 91 4.191 7.043 4.191 675 HE22 GLN 91 2HE2 GLN 91 4.945 8.389 4.995 676 H VAL 92 HN VAL 92 4.911 0.655 3.917 677 HA VAL 92 HA VAL 92 4.663 -0.213 6.545 678 HB VAL 92 HB VAL 92 3.641 -1.353 4.629 679 HG11 VAL 92 1HG1 VAL 92 4.959 -2.896 3.247 680 HG12 VAL 92 2HG1 VAL 92 6.433 -2.296 4.006 681 HG13 VAL 92 3HG1 VAL 92 5.445 -1.213 3.023 682 HG21 VAL 92 3HG2 VAL 92 4.038 -3.676 5.359 683 HG22 VAL 92 1HG2 VAL 92 3.830 -2.572 6.719 684 HG23 VAL 92 2HG2 VAL 92 5.443 -3.129 6.274 685 H GLU 93 HN GLU 93 7.508 0.104 4.603 686 HA GLU 93 HA GLU 93 9.154 -1.771 5.929 687 HB2 GLU 93 2HB GLU 93 11.030 -0.538 4.914 688 HB3 GLU 93 1HB GLU 93 9.757 -0.887 3.749 689 HG2 GLU 93 2HG GLU 93 9.273 1.279 3.428 690 HG3 GLU 93 1HG GLU 93 9.527 1.699 5.120 691 H LYS 94 HN LYS 94 7.950 1.280 6.935 692 HA LYS 94 HA LYS 94 10.238 2.005 8.509 693 HB2 LYS 94 2HB LYS 94 7.465 3.159 8.664 694 HB3 LYS 94 1HB LYS 94 8.936 3.873 9.285 695 HG2 LYS 94 2HG LYS 94 7.954 3.691 6.488 696 HG3 LYS 94 1HG LYS 94 8.613 5.070 7.364 697 HD2 LYS 94 2HD LYS 94 10.178 2.689 6.379 698 HD3 LYS 94 1HD LYS 94 10.138 4.268 5.621 699 HE2 LYS 94 2HE LYS 94 11.129 5.241 7.659 700 HE3 LYS 94 1HE LYS 94 11.220 3.621 8.355 701 HZ1 LYS 94 3HZ LYS 94 12.735 4.748 6.086 702 HZ2 LYS 94 1HZ LYS 94 12.525 3.067 6.226 703 HZ3 LYS 94 2HZ LYS 94 13.313 3.933 7.457 704 H LEU 95 HN LEU 95 7.802 -0.224 8.918 705 HA LEU 95 HA LEU 95 7.170 0.159 11.667 706 HB2 LEU 95 2HB LEU 95 6.891 -2.279 9.910 707 HB3 LEU 95 1HB LEU 95 6.187 -2.104 11.505 708 HG LEU 95 HG LEU 95 5.486 -0.458 9.072 709 HD11 LEU 95 1HD1 LEU 95 3.942 -2.569 10.570 710 HD12 LEU 95 2HD1 LEU 95 4.614 -2.717 8.945 711 HD13 LEU 95 3HD1 LEU 95 3.309 -1.572 9.260 712 HD21 LEU 95 3HD2 LEU 95 3.719 0.490 10.485 713 HD22 LEU 95 1HD2 LEU 95 5.330 0.881 11.090 714 HD23 LEU 95 2HD2 LEU 95 4.375 -0.379 11.873 715 H GLY 96 HN GLY 96 7.979 -0.845 13.472 716 HA2 GLY 96 2HA GLY 96 10.741 -1.662 13.276 717 HA3 GLY 96 1HA GLY 96 9.814 -1.445 14.751 718 H ASN 97 HN ASN 97 9.721 -3.254 15.890 719 HA ASN 97 HA ASN 97 9.991 -5.817 14.495 720 HB2 ASN 97 2HB ASN 97 11.553 -5.400 16.321 721 HB3 ASN 97 1HB ASN 97 10.218 -5.108 17.429 722 HD21 ASN 97 1HD2 ASN 97 12.035 -7.493 15.687 723 HD22 ASN 97 2HD2 ASN 97 11.413 -8.877 16.535 724 H GLU 98 HN GLU 98 8.005 -4.323 17.026 725 HA GLU 98 HA GLU 98 6.302 -6.552 17.369 726 HB2 GLU 98 2HB GLU 98 5.788 -3.653 18.054 727 HB3 GLU 98 1HB GLU 98 4.928 -5.042 18.707 728 HG2 GLU 98 2HG GLU 98 7.003 -5.845 19.724 729 HG3 GLU 98 1HG GLU 98 7.852 -4.442 19.080 730 H GLU 99 HN GLU 99 6.090 -3.647 15.388 731 HA GLU 99 HA GLU 99 3.443 -4.039 14.493 732 HB2 GLU 99 2HB GLU 99 5.682 -2.723 12.950 733 HB3 GLU 99 1HB GLU 99 3.956 -2.486 12.722 734 HG2 GLU 99 2HG GLU 99 4.358 -0.647 13.948 735 HG3 GLU 99 1HG GLU 99 4.131 -1.776 15.281 736 H GLN 100 HN GLN 100 6.558 -5.150 13.224 737 HA GLN 100 HA GLN 100 5.438 -6.352 10.902 738 HB2 GLN 100 2HB GLN 100 8.097 -6.764 12.266 739 HB3 GLN 100 1HB GLN 100 7.647 -7.556 10.762 740 HG2 GLN 100 2HG GLN 100 7.309 -5.323 9.747 741 HG3 GLN 100 1HG GLN 100 7.914 -4.596 11.234 742 HE21 GLN 100 1HE2 GLN 100 9.673 -3.640 10.246 743 HE22 GLN 100 2HE2 GLN 100 11.023 -4.550 9.655 744 H ALA 101 HN ALA 101 5.644 -7.322 14.190 745 HA ALA 101 HA ALA 101 5.194 -10.116 13.713 746 HB1 ALA 101 1HB ALA 101 4.660 -8.484 16.199 747 HB2 ALA 101 2HB ALA 101 6.172 -9.313 15.823 748 HB3 ALA 101 3HB ALA 101 4.699 -10.243 16.098 749 H LEU 102 HN LEU 102 3.210 -7.301 14.439 750 HA LEU 102 HA LEU 102 0.712 -8.626 14.516 751 HB2 LEU 102 2HB LEU 102 1.389 -6.266 15.330 752 HB3 LEU 102 1HB LEU 102 1.134 -5.768 13.674 753 HG LEU 102 HG LEU 102 -0.770 -5.283 15.202 754 HD11 LEU 102 1HD1 LEU 102 -2.531 -6.062 13.713 755 HD12 LEU 102 2HD1 LEU 102 -1.400 -7.183 12.956 756 HD13 LEU 102 3HD1 LEU 102 -1.148 -5.444 12.810 757 HD21 LEU 102 3HD2 LEU 102 -2.219 -7.124 15.901 758 HD22 LEU 102 1HD2 LEU 102 -0.614 -7.243 16.622 759 HD23 LEU 102 2HD2 LEU 102 -1.051 -8.280 15.264 760 H LEU 103 HN LEU 103 2.365 -6.779 11.982 761 HA LEU 103 HA LEU 103 0.474 -7.008 9.948 762 HB2 LEU 103 2HB LEU 103 2.770 -5.706 10.179 763 HB3 LEU 103 1HB LEU 103 3.391 -7.091 9.310 764 HG LEU 103 HG LEU 103 2.907 -5.213 7.821 765 HD11 LEU 103 1HD1 LEU 103 1.557 -6.392 6.164 766 HD12 LEU 103 2HD1 LEU 103 1.065 -7.551 7.400 767 HD13 LEU 103 3HD1 LEU 103 2.757 -7.451 6.911 768 HD21 LEU 103 3HD2 LEU 103 1.087 -4.191 9.064 769 HD22 LEU 103 1HD2 LEU 103 0.051 -5.570 8.704 770 HD23 LEU 103 2HD2 LEU 103 0.602 -4.517 7.400 771 H PHE 104 HN PHE 104 3.241 -9.108 10.692 772 HA PHE 104 HA PHE 104 2.986 -10.949 8.630 773 HB2 PHE 104 2HB PHE 104 4.906 -10.945 10.112 774 HB3 PHE 104 1HB PHE 104 3.899 -11.404 11.476 775 HD1 PHE 104 2HD PHE 104 4.938 -12.589 8.105 776 HD2 PHE 104 1HD PHE 104 3.661 -13.626 12.031 777 HE1 PHE 104 2HE PHE 104 5.304 -14.968 7.595 778 HE2 PHE 104 1HE PHE 104 4.025 -16.004 11.527 779 HZ PHE 104 HZ PHE 104 4.846 -16.677 9.307 780 H SER 105 HN SER 105 1.437 -10.938 11.806 781 HA SER 105 HA SER 105 0.073 -13.352 11.599 782 HB2 SER 105 2HB SER 105 -0.765 -10.831 13.041 783 HB3 SER 105 1HB SER 105 -1.336 -12.457 13.373 784 HG SER 105 HG SER 105 1.115 -11.271 13.962 785 H ILE 106 HN ILE 106 -0.763 -10.114 10.470 786 HA ILE 106 HA ILE 106 -3.380 -10.651 9.592 787 HB ILE 106 HB ILE 106 -1.385 -8.710 8.396 788 HG12 ILE 106 2HG1 ILE 106 -3.502 -8.293 10.523 789 HG13 ILE 106 1HG1 ILE 106 -1.763 -8.324 10.797 790 HG21 ILE 106 1HG2 ILE 106 -4.394 -8.801 8.188 791 HG22 ILE 106 2HG2 ILE 106 -3.250 -9.154 6.892 792 HG23 ILE 106 3HG2 ILE 106 -3.358 -7.523 7.553 793 HD11 ILE 106 3HD1 ILE 106 -3.222 -6.309 9.105 794 HD12 ILE 106 1HD1 ILE 106 -1.496 -6.322 9.461 795 HD13 ILE 106 2HD1 ILE 106 -2.660 -6.050 10.757 796 H PHE 107 HN PHE 107 -0.249 -10.875 7.909 797 HA PHE 107 HA PHE 107 -1.178 -11.796 5.442 798 HB2 PHE 107 2HB PHE 107 1.398 -11.984 6.916 799 HB3 PHE 107 1HB PHE 107 1.162 -13.086 5.569 800 HD1 PHE 107 1HD PHE 107 0.000 -11.743 3.463 801 HD2 PHE 107 2HD PHE 107 2.638 -10.133 6.396 802 HE1 PHE 107 1HE PHE 107 0.685 -9.990 1.881 803 HE2 PHE 107 2HE PHE 107 3.323 -8.377 4.814 804 HZ PHE 107 HZ PHE 107 2.344 -8.305 2.558 805 H ASN 108 HN ASN 108 -0.204 -13.614 8.325 806 HA ASN 108 HA ASN 108 -0.547 -16.187 7.268 807 HB2 ASN 108 2HB ASN 108 0.638 -15.712 9.381 808 HB3 ASN 108 1HB ASN 108 -0.892 -15.286 10.140 809 HD21 ASN 108 1HD2 ASN 108 -0.702 -16.879 11.691 810 HD22 ASN 108 2HD2 ASN 108 -0.908 -18.559 11.323 811 H ARG 109 HN ARG 109 -2.804 -14.170 9.146 812 HA ARG 109 HA ARG 109 -4.982 -15.914 9.166 813 HB2 ARG 109 2HB ARG 109 -5.023 -13.937 10.540 814 HB3 ARG 109 1HB ARG 109 -4.889 -12.892 9.132 815 HG2 ARG 109 2HG ARG 109 -7.115 -13.747 8.383 816 HG3 ARG 109 1HG ARG 109 -7.248 -14.584 9.930 817 HD2 ARG 109 2HD ARG 109 -7.176 -12.507 11.125 818 HD3 ARG 109 1HD ARG 109 -6.819 -11.615 9.645 819 HE ARG 109 HE ARG 109 -9.361 -13.070 9.968 820 HH11 ARG 109 1HH1 ARG 109 -7.606 -10.102 9.356 821 HH12 ARG 109 2HH1 ARG 109 -9.022 -9.204 8.920 822 HH21 ARG 109 1HH2 ARG 109 -11.234 -11.874 9.389 823 HH22 ARG 109 2HH2 ARG 109 -11.065 -10.202 8.916 824 H PHE 110 HN PHE 110 -4.113 -13.418 6.795 825 HA PHE 110 HA PHE 110 -6.426 -13.762 5.204 826 HB2 PHE 110 2HB PHE 110 -3.779 -12.415 4.761 827 HB3 PHE 110 1HB PHE 110 -4.948 -12.547 3.452 828 HD1 PHE 110 1HD PHE 110 -6.838 -12.361 6.336 829 HD2 PHE 110 2HD PHE 110 -4.386 -9.939 3.845 830 HE1 PHE 110 1HE PHE 110 -8.001 -10.354 7.149 831 HE2 PHE 110 2HE PHE 110 -5.546 -7.927 4.655 832 HZ PHE 110 HZ PHE 110 -7.354 -8.134 6.307 833 H ARG 111 HN ARG 111 -3.089 -14.929 4.795 834 HA ARG 111 HA ARG 111 -3.639 -16.149 2.284 835 HB2 ARG 111 2HB ARG 111 -1.381 -15.378 3.127 836 HB3 ARG 111 1HB ARG 111 -1.351 -16.816 4.138 837 HG2 ARG 111 2HG ARG 111 -0.083 -17.153 2.096 838 HG3 ARG 111 1HG ARG 111 -1.486 -18.224 2.147 839 HD2 ARG 111 2HD ARG 111 -2.708 -16.691 0.685 840 HD3 ARG 111 1HD ARG 111 -1.316 -15.611 0.645 841 HE ARG 111 HE ARG 111 -0.442 -18.119 -0.198 842 HH11 ARG 111 1HH1 ARG 111 -2.660 -15.629 -1.275 843 HH12 ARG 111 2HH1 ARG 111 -2.468 -15.992 -2.959 844 HH21 ARG 111 1HH2 ARG 111 -0.178 -18.607 -2.413 845 HH22 ARG 111 2HH2 ARG 111 -1.069 -17.716 -3.611 846 H ASN 112 HN ASN 112 -3.882 -17.214 5.588 847 HA ASN 112 HA ASN 112 -3.892 -20.005 5.113 848 HB2 ASN 112 2HB ASN 112 -4.005 -18.389 7.352 849 HB3 ASN 112 1HB ASN 112 -5.603 -19.125 7.322 850 HD21 ASN 112 1HD2 ASN 112 -2.242 -19.604 7.817 851 HD22 ASN 112 2HD2 ASN 112 -2.330 -21.245 8.360 852 H SER 113 HN SER 113 -6.433 -17.566 5.149 853 HA SER 113 HA SER 113 -8.470 -19.591 4.645 854 HB2 SER 113 2HB SER 113 -8.909 -17.808 6.308 855 HB3 SER 113 1HB SER 113 -8.753 -16.601 5.033 856 HG SER 113 HG SER 113 -10.496 -18.125 4.032 857 H GLY 114 HN GLY 114 -6.580 -17.268 2.942 858 HA2 GLY 114 2HA GLY 114 -6.448 -16.911 0.644 859 HA3 GLY 114 1HA GLY 114 -7.857 -17.944 0.430 860 H LYS 115 HN LYS 115 -8.029 -15.470 2.772 861 HA LYS 115 HA LYS 115 -9.821 -13.906 1.058 862 HB2 LYS 115 2HB LYS 115 -11.022 -15.417 2.609 863 HB3 LYS 115 1HB LYS 115 -10.179 -14.691 3.962 864 HG2 LYS 115 2HG LYS 115 -11.334 -12.631 3.662 865 HG3 LYS 115 1HG LYS 115 -12.013 -13.187 2.130 866 HD2 LYS 115 2HD LYS 115 -13.372 -14.799 3.210 867 HD3 LYS 115 1HD LYS 115 -12.520 -14.592 4.739 868 HE2 LYS 115 2HE LYS 115 -14.147 -12.430 3.412 869 HE3 LYS 115 1HE LYS 115 -14.782 -13.526 4.640 870 HZ1 LYS 115 3HZ LYS 115 -12.660 -11.475 4.941 871 HZ2 LYS 115 1HZ LYS 115 -12.900 -12.712 6.086 872 HZ3 LYS 115 2HZ LYS 115 -14.136 -11.597 5.772 873 H GLY 116 HN GLY 116 -10.277 -11.724 2.317 874 HA2 GLY 116 2HA GLY 116 -9.440 -9.849 3.411 875 HA3 GLY 116 1HA GLY 116 -8.002 -10.766 3.832 876 H PHE 117 HN PHE 117 -8.210 -8.060 2.787 877 HA PHE 117 HA PHE 117 -6.743 -8.401 0.253 878 HB2 PHE 117 2HB PHE 117 -8.626 -6.173 1.057 879 HB3 PHE 117 1HB PHE 117 -7.619 -6.145 -0.384 880 HD1 PHE 117 1HD PHE 117 -10.299 -8.126 1.275 881 HD2 PHE 117 2HD PHE 117 -8.423 -7.004 -2.373 882 HE1 PHE 117 1HE PHE 117 -12.071 -9.274 0.016 883 HE2 PHE 117 2HE PHE 117 -10.187 -8.161 -3.639 884 HZ PHE 117 HZ PHE 117 -12.016 -9.297 -2.443 885 H LEU 118 HN LEU 118 -4.853 -7.245 0.012 886 HA LEU 118 HA LEU 118 -4.034 -5.484 2.205 887 HB2 LEU 118 2HB LEU 118 -3.239 -8.120 2.133 888 HB3 LEU 118 1HB LEU 118 -1.924 -7.298 1.318 889 HG LEU 118 HG LEU 118 -1.380 -7.545 3.652 890 HD11 LEU 118 1HD1 LEU 118 -2.117 -4.695 3.013 891 HD12 LEU 118 2HD1 LEU 118 -0.609 -5.507 2.594 892 HD13 LEU 118 3HD1 LEU 118 -1.010 -5.210 4.284 893 HD21 LEU 118 3HD2 LEU 118 -3.950 -6.075 4.197 894 HD22 LEU 118 1HD2 LEU 118 -2.734 -6.499 5.402 895 HD23 LEU 118 2HD2 LEU 118 -3.612 -7.769 4.552 896 H LEU 119 HN LEU 119 -3.185 -3.716 1.413 897 HA LEU 119 HA LEU 119 -1.784 -3.824 -1.176 898 HB2 LEU 119 2HB LEU 119 -3.944 -2.612 -1.314 899 HB3 LEU 119 1HB LEU 119 -3.392 -1.522 -0.057 900 HG LEU 119 HG LEU 119 -1.565 -0.766 -1.553 901 HD11 LEU 119 1HD1 LEU 119 -1.683 -1.321 -3.933 902 HD12 LEU 119 2HD1 LEU 119 -2.973 -2.475 -3.596 903 HD13 LEU 119 3HD1 LEU 119 -1.357 -2.745 -2.943 904 HD21 LEU 119 3HD2 LEU 119 -2.976 0.565 -3.017 905 HD22 LEU 119 1HD2 LEU 119 -3.669 0.467 -1.399 906 HD23 LEU 119 2HD2 LEU 119 -4.337 -0.511 -2.704 907 H LEU 120 HN LEU 120 0.301 -3.481 -0.929 908 HA LEU 120 HA LEU 120 1.200 -1.886 1.385 909 HB2 LEU 120 2HB LEU 120 2.545 -4.186 -0.029 910 HB3 LEU 120 1HB LEU 120 3.306 -3.216 1.219 911 HG LEU 120 HG LEU 120 0.784 -4.806 1.675 912 HD11 LEU 120 1HD1 LEU 120 2.199 -6.475 2.747 913 HD12 LEU 120 2HD1 LEU 120 3.639 -5.577 2.267 914 HD13 LEU 120 3HD1 LEU 120 2.604 -6.307 1.039 915 HD21 LEU 120 3HD2 LEU 120 1.151 -2.974 3.236 916 HD22 LEU 120 1HD2 LEU 120 2.785 -3.556 3.554 917 HD23 LEU 120 2HD2 LEU 120 1.396 -4.529 4.032 918 H GLY 121 HN GLY 121 2.694 -0.280 1.068 919 HA2 GLY 121 2HA GLY 121 3.939 -0.033 -1.564 920 HA3 GLY 121 1HA GLY 121 2.889 1.277 -1.047 921 H SER 122 HN SER 122 5.971 0.637 -1.413 922 HA SER 122 HA SER 122 6.671 2.703 0.482 923 HB2 SER 122 2HB SER 122 8.079 0.021 0.563 924 HB3 SER 122 1HB SER 122 8.601 1.469 1.423 925 HG SER 122 HG SER 122 5.993 0.937 1.907 926 H GLU 123 HN GLU 123 8.937 0.443 -1.026 927 HA GLU 123 HA GLU 123 9.280 1.590 -3.501 928 HB2 GLU 123 2HB GLU 123 11.186 3.062 -3.290 929 HB3 GLU 123 1HB GLU 123 9.864 3.674 -2.310 930 HG2 GLU 123 2HG GLU 123 10.925 2.885 -0.300 931 HG3 GLU 123 1HG GLU 123 12.194 2.095 -1.238 932 H TYR 124 HN TYR 124 11.924 1.468 -4.000 933 HA TYR 124 HA TYR 124 13.611 0.044 -4.493 934 HB2 TYR 124 2HB TYR 124 12.991 -1.192 -1.804 935 HB3 TYR 124 1HB TYR 124 14.433 -1.499 -2.759 936 HD1 TYR 124 1HD TYR 124 15.353 1.100 -3.585 937 HD2 TYR 124 2HD TYR 124 13.568 -0.061 0.102 938 HE1 TYR 124 1HE TYR 124 16.509 2.948 -2.446 939 HE2 TYR 124 2HE TYR 124 14.710 1.790 1.246 940 HH TYR 124 HH TYR 124 16.125 4.341 -0.329 941 H THR 125 HN THR 125 11.952 -2.373 -2.593 942 HA THR 125 HA THR 125 10.360 -3.662 -4.425 943 HB THR 125 HB THR 125 12.119 -5.729 -4.628 944 HG1 THR 125 1HG THR 125 13.727 -3.536 -5.372 945 HG21 THR 125 3HG2 THR 125 10.700 -4.894 -6.437 946 HG22 THR 125 1HG2 THR 125 12.353 -5.161 -6.997 947 HG23 THR 125 2HG2 THR 125 11.788 -3.525 -6.666 948 HA PRO 126 HA PRO 126 9.394 -5.940 -0.761 949 HB2 PRO 126 2HB PRO 126 9.138 -8.381 -2.430 950 HB3 PRO 126 1HB PRO 126 7.958 -7.616 -1.363 951 HG2 PRO 126 2HG PRO 126 7.723 -7.431 -4.009 952 HG3 PRO 126 1HG PRO 126 7.325 -6.058 -2.960 953 HD2 PRO 126 2HD PRO 126 9.763 -6.525 -4.632 954 HD3 PRO 126 1HD PRO 126 8.867 -5.020 -4.338 955 H GLN 127 HN GLN 127 11.824 -7.167 -2.920 956 HA GLN 127 HA GLN 127 12.858 -8.999 -0.887 957 HB2 GLN 127 2HB GLN 127 13.528 -8.673 -3.815 958 HB3 GLN 127 1HB GLN 127 14.328 -9.812 -2.743 959 HG2 GLN 127 2HG GLN 127 12.243 -10.982 -2.378 960 HG3 GLN 127 1HG GLN 127 11.380 -9.802 -3.359 961 HE21 GLN 127 1HE2 GLN 127 13.551 -9.634 -5.325 962 HE22 GLN 127 2HE2 GLN 127 13.448 -11.084 -6.262 963 H GLN 128 HN GLN 128 13.191 -5.865 -1.566 964 HA GLN 128 HA GLN 128 16.081 -5.811 -1.017 965 HB2 GLN 128 2HB GLN 128 15.364 -4.617 -3.062 966 HB3 GLN 128 1HB GLN 128 14.298 -3.612 -2.091 967 HG2 GLN 128 2HG GLN 128 16.291 -2.382 -2.599 968 HG3 GLN 128 1HG GLN 128 16.267 -2.753 -0.877 969 HE21 GLN 128 1HE2 GLN 128 17.078 -5.097 -3.353 970 HE22 GLN 128 2HE2 GLN 128 18.749 -5.249 -2.915 971 H LEU 129 HN LEU 129 12.927 -4.903 0.126 972 HA LEU 129 HA LEU 129 13.543 -2.939 1.997 973 HB2 LEU 129 2HB LEU 129 11.434 -5.092 2.136 974 HB3 LEU 129 1HB LEU 129 11.494 -3.686 3.176 975 HG LEU 129 HG LEU 129 11.104 -3.644 0.186 976 HD11 LEU 129 1HD1 LEU 129 9.178 -3.088 2.440 977 HD12 LEU 129 2HD1 LEU 129 9.171 -4.511 1.400 978 HD13 LEU 129 3HD1 LEU 129 8.837 -2.919 0.719 979 HD21 LEU 129 3HD2 LEU 129 10.721 -1.263 0.445 980 HD22 LEU 129 1HD2 LEU 129 12.327 -1.682 1.038 981 HD23 LEU 129 2HD2 LEU 129 11.018 -1.377 2.178 982 H VAL 130 HN VAL 130 14.371 -2.914 4.006 983 HA VAL 130 HA VAL 130 15.568 -5.381 4.990 984 HB VAL 130 HB VAL 130 15.750 -2.607 6.174 985 HG11 VAL 130 1HG1 VAL 130 17.742 -3.466 7.314 986 HG12 VAL 130 2HG1 VAL 130 17.466 -5.057 6.602 987 HG13 VAL 130 3HG1 VAL 130 16.304 -4.389 7.748 988 HG21 VAL 130 3HG2 VAL 130 17.944 -2.453 5.043 989 HG22 VAL 130 1HG2 VAL 130 16.608 -2.572 3.899 990 HG23 VAL 130 2HG2 VAL 130 17.614 -3.982 4.229 991 H ILE 131 HN ILE 131 13.744 -6.507 5.639 992 HA ILE 131 HA ILE 131 12.572 -5.617 8.179 993 HB ILE 131 HB ILE 131 10.366 -6.546 7.467 994 HG12 ILE 131 2HG1 ILE 131 11.611 -6.511 4.708 995 HG13 ILE 131 1HG1 ILE 131 11.206 -7.958 5.621 996 HG21 ILE 131 1HG2 ILE 131 9.714 -4.603 6.086 997 HG22 ILE 131 2HG2 ILE 131 11.424 -4.218 5.876 998 HG23 ILE 131 3HG2 ILE 131 10.700 -4.163 7.482 999 HD11 ILE 131 3HD1 ILE 131 9.252 -5.900 4.635 1000 HD12 ILE 131 1HD1 ILE 131 8.845 -7.348 5.554 1001 HD13 ILE 131 2HD1 ILE 131 9.530 -7.494 3.934 1002 H ARG 132 HN ARG 132 11.241 -7.587 9.105 1003 HA ARG 132 HA ARG 132 13.019 -9.713 9.540 1004 HB2 ARG 132 2HB ARG 132 11.247 -9.188 11.118 1005 HB3 ARG 132 1HB ARG 132 10.023 -9.608 9.934 1006 HG2 ARG 132 2HG ARG 132 10.541 -11.892 10.065 1007 HG3 ARG 132 1HG ARG 132 12.056 -11.587 10.909 1008 HD2 ARG 132 2HD ARG 132 10.412 -12.448 12.458 1009 HD3 ARG 132 1HD ARG 132 10.782 -10.772 12.852 1010 HE ARG 132 HE ARG 132 8.637 -10.310 11.508 1011 HH11 ARG 132 1HH1 ARG 132 9.200 -13.152 13.470 1012 HH12 ARG 132 2HH1 ARG 132 7.523 -13.347 13.887 1013 HH21 ARG 132 1HH2 ARG 132 6.412 -10.563 12.085 1014 HH22 ARG 132 2HH2 ARG 132 5.951 -11.880 13.127 1015 H GLU 133 HN GLU 133 13.454 -11.506 8.456 1016 HA GLU 133 HA GLU 133 12.668 -11.696 5.773 1017 HB2 GLU 133 2HB GLU 133 13.911 -13.823 5.743 1018 HB3 GLU 133 1HB GLU 133 14.821 -12.511 6.478 1019 HG2 GLU 133 2HG GLU 133 14.354 -13.367 8.681 1020 HG3 GLU 133 1HG GLU 133 13.319 -14.624 8.000 1021 H ASP 134 HN ASP 134 11.233 -13.008 8.636 1022 HA ASP 134 HA ASP 134 9.937 -15.198 7.317 1023 HB2 ASP 134 2HB ASP 134 10.408 -15.042 9.806 1024 HB3 ASP 134 1HB ASP 134 9.045 -13.931 9.904 1025 H LEU 135 HN LEU 135 9.140 -11.860 7.977 1026 HA LEU 135 HA LEU 135 6.499 -12.095 6.812 1027 HB2 LEU 135 2HB LEU 135 7.144 -10.446 8.628 1028 HB3 LEU 135 1HB LEU 135 8.080 -9.590 7.421 1029 HG LEU 135 HG LEU 135 5.130 -10.045 7.045 1030 HD11 LEU 135 1HD1 LEU 135 5.392 -8.984 9.218 1031 HD12 LEU 135 2HD1 LEU 135 4.749 -7.843 8.037 1032 HD13 LEU 135 3HD1 LEU 135 6.446 -7.761 8.507 1033 HD21 LEU 135 3HD2 LEU 135 5.310 -8.014 5.691 1034 HD22 LEU 135 1HD2 LEU 135 6.395 -9.276 5.106 1035 HD23 LEU 135 2HD2 LEU 135 7.037 -7.931 6.048 1036 H ARG 136 HN ARG 136 9.718 -11.159 5.945 1037 HA ARG 136 HA ARG 136 9.346 -9.830 3.524 1038 HB2 ARG 136 2HB ARG 136 11.440 -10.407 5.082 1039 HB3 ARG 136 1HB ARG 136 11.671 -11.658 3.874 1040 HG2 ARG 136 2HG ARG 136 11.824 -9.976 2.132 1041 HG3 ARG 136 1HG ARG 136 11.525 -8.701 3.322 1042 HD2 ARG 136 2HD ARG 136 13.526 -9.517 4.572 1043 HD3 ARG 136 1HD ARG 136 13.862 -10.600 3.228 1044 HE ARG 136 HE ARG 136 13.831 -7.662 2.960 1045 HH11 ARG 136 1HH1 ARG 136 15.130 -10.808 2.193 1046 HH12 ARG 136 2HH1 ARG 136 16.508 -10.182 1.336 1047 HH21 ARG 136 1HH2 ARG 136 15.663 -6.814 1.868 1048 HH22 ARG 136 2HH2 ARG 136 16.811 -7.906 1.154 1049 H THR 137 HN THR 137 9.594 -13.300 4.218 1050 HA THR 137 HA THR 137 9.682 -14.153 1.524 1051 HB THR 137 HB THR 137 8.786 -16.344 2.549 1052 HG1 THR 137 1HG THR 137 9.431 -16.050 5.003 1053 HG21 THR 137 3HG2 THR 137 10.962 -16.853 3.553 1054 HG22 THR 137 1HG2 THR 137 11.345 -15.132 3.598 1055 HG23 THR 137 2HG2 THR 137 11.149 -15.953 2.048 1056 H ARG 138 HN ARG 138 7.064 -13.251 3.649 1057 HA ARG 138 HA ARG 138 4.990 -14.419 2.040 1058 HB2 ARG 138 2HB ARG 138 4.516 -12.195 3.997 1059 HB3 ARG 138 1HB ARG 138 3.491 -13.571 3.612 1060 HG2 ARG 138 2HG ARG 138 6.073 -13.667 5.155 1061 HG3 ARG 138 1HG ARG 138 4.454 -13.771 5.832 1062 HD2 ARG 138 2HD ARG 138 4.080 -15.889 4.922 1063 HD3 ARG 138 1HD ARG 138 5.395 -15.720 3.758 1064 HE ARG 138 HE ARG 138 6.462 -15.577 6.346 1065 HH11 ARG 138 1HH1 ARG 138 4.944 -17.933 4.242 1066 HH12 ARG 138 2HH1 ARG 138 5.823 -19.269 4.905 1067 HH21 ARG 138 1HH2 ARG 138 7.613 -17.324 7.226 1068 HH22 ARG 138 2HH2 ARG 138 7.350 -18.921 6.595 1069 H MET 139 HN MET 139 6.861 -11.589 1.922 1070 HA MET 139 HA MET 139 5.095 -9.811 0.609 1071 HB2 MET 139 2HB MET 139 8.093 -10.051 0.751 1072 HB3 MET 139 1HB MET 139 7.330 -8.826 -0.245 1073 HG2 MET 139 2HG MET 139 6.832 -9.125 2.702 1074 HG3 MET 139 1HG MET 139 8.058 -8.060 2.007 1075 HE1 MET 139 3HE MET 139 7.089 -5.942 3.187 1076 HE2 MET 139 1HE MET 139 5.863 -6.930 3.975 1077 HE3 MET 139 2HE MET 139 5.392 -5.458 3.126 1078 H ALA 140 HN ALA 140 6.828 -12.599 -0.433 1079 HA ALA 140 HA ALA 140 6.916 -11.898 -3.221 1080 HB1 ALA 140 1HB ALA 140 7.821 -14.122 -3.559 1081 HB2 ALA 140 2HB ALA 140 7.396 -14.566 -1.905 1082 HB3 ALA 140 3HB ALA 140 8.620 -13.333 -2.199 1083 H TYR 141 HN TYR 141 4.424 -12.873 -1.246 1084 HA TYR 141 HA TYR 141 3.098 -14.495 -3.272 1085 HB2 TYR 141 2HB TYR 141 2.231 -13.727 -0.479 1086 HB3 TYR 141 1HB TYR 141 1.354 -14.807 -1.552 1087 HD1 TYR 141 1HD TYR 141 3.121 -16.695 -2.589 1088 HD2 TYR 141 2HD TYR 141 3.311 -14.819 1.226 1089 HE1 TYR 141 1HE TYR 141 4.413 -18.600 -1.722 1090 HE2 TYR 141 2HE TYR 141 4.606 -16.717 2.100 1091 HH TYR 141 HH TYR 141 6.074 -18.995 0.150 1092 H CYS 142 HN CYS 142 3.569 -11.358 -2.999 1093 HA CYS 142 HA CYS 142 0.819 -10.609 -3.690 1094 HB2 CYS 142 2HB CYS 142 3.004 -8.866 -2.523 1095 HB3 CYS 142 1HB CYS 142 1.367 -8.345 -2.909 1096 HG CYS 142 HG CYS 142 2.520 -9.885 -0.191 1097 H LEU 143 HN LEU 143 0.518 -9.298 -5.461 1098 HA LEU 143 HA LEU 143 2.434 -9.533 -7.561 1099 HB2 LEU 143 2HB LEU 143 -0.149 -7.999 -7.365 1100 HB3 LEU 143 1HB LEU 143 0.838 -8.008 -8.806 1101 HG LEU 143 HG LEU 143 0.547 -10.553 -8.742 1102 HD11 LEU 143 1HD1 LEU 143 -0.352 -10.716 -6.484 1103 HD12 LEU 143 2HD1 LEU 143 -1.477 -11.357 -7.680 1104 HD13 LEU 143 3HD1 LEU 143 -1.755 -9.764 -6.975 1105 HD21 LEU 143 3HD2 LEU 143 -0.461 -9.098 -10.408 1106 HD22 LEU 143 1HD2 LEU 143 -1.808 -8.774 -9.316 1107 HD23 LEU 143 2HD2 LEU 143 -1.561 -10.400 -9.952 1108 H VAL 144 HN VAL 144 3.393 -7.733 -8.723 1109 HA VAL 144 HA VAL 144 3.950 -5.447 -6.941 1110 HB VAL 144 HB VAL 144 5.845 -6.691 -8.953 1111 HG11 VAL 144 1HG1 VAL 144 6.146 -4.272 -8.707 1112 HG12 VAL 144 2HG1 VAL 144 7.512 -5.160 -8.028 1113 HG13 VAL 144 3HG1 VAL 144 6.291 -4.464 -6.961 1114 HG21 VAL 144 3HG2 VAL 144 5.894 -6.765 -5.937 1115 HG22 VAL 144 1HG2 VAL 144 7.155 -7.393 -6.998 1116 HG23 VAL 144 2HG2 VAL 144 5.551 -8.125 -7.004 1117 H TYR 145 HN TYR 145 3.061 -3.680 -7.712 1118 HA TYR 145 HA TYR 145 3.097 -3.230 -10.619 1119 HB2 TYR 145 2HB TYR 145 0.876 -2.664 -8.660 1120 HB3 TYR 145 1HB TYR 145 0.980 -1.837 -10.211 1121 HD1 TYR 145 2HD TYR 145 1.287 -3.486 -12.282 1122 HD2 TYR 145 1HD TYR 145 -0.410 -4.571 -8.537 1123 HE1 TYR 145 2HE TYR 145 0.117 -5.356 -13.363 1124 HE2 TYR 145 1HE TYR 145 -1.584 -6.448 -9.606 1125 HH TYR 145 HH TYR 145 -0.844 -7.570 -12.695 1126 H GLU 146 HN GLU 146 2.992 -0.932 -11.219 1127 HA GLU 146 HA GLU 146 3.808 1.005 -9.260 1128 HB2 GLU 146 2HB GLU 146 5.896 1.544 -10.447 1129 HB3 GLU 146 1HB GLU 146 5.938 -0.070 -9.757 1130 HG2 GLU 146 2HG GLU 146 5.393 -0.995 -11.971 1131 HG3 GLU 146 1HG GLU 146 5.437 0.635 -12.641 1132 H VAL 147 HN VAL 147 3.880 3.155 -10.165 1133 HA VAL 147 HA VAL 147 2.842 3.431 -12.894 1134 HB VAL 147 HB VAL 147 0.939 3.560 -11.274 1135 HG11 VAL 147 1HG1 VAL 147 0.697 5.501 -9.834 1136 HG12 VAL 147 2HG1 VAL 147 2.302 6.063 -10.306 1137 HG13 VAL 147 3HG1 VAL 147 2.125 4.561 -9.398 1138 HG21 VAL 147 3HG2 VAL 147 -0.037 5.634 -12.182 1139 HG22 VAL 147 1HG2 VAL 147 0.745 4.647 -13.420 1140 HG23 VAL 147 2HG2 VAL 147 1.554 6.087 -12.798 1141 H LYS 148 HN LYS 148 5.394 3.740 -11.404 1142 HA LYS 148 HA LYS 148 5.933 6.605 -11.587 1143 HB2 LYS 148 2HB LYS 148 7.927 6.168 -10.360 1144 HB3 LYS 148 1HB LYS 148 6.675 5.194 -9.605 1145 HG2 LYS 148 2HG LYS 148 8.212 3.565 -9.720 1146 HG3 LYS 148 1HG LYS 148 7.680 3.426 -11.399 1147 HD2 LYS 148 2HD LYS 148 9.447 5.049 -12.037 1148 HD3 LYS 148 1HD LYS 148 10.017 5.030 -10.368 1149 HE2 LYS 148 2HE LYS 148 11.415 3.555 -11.575 1150 HE3 LYS 148 1HE LYS 148 10.334 2.548 -10.616 1151 HZ1 LYS 148 3HZ LYS 148 9.062 2.011 -12.513 1152 HZ2 LYS 148 1HZ LYS 148 10.685 1.837 -12.972 1153 HZ3 LYS 148 2HZ LYS 148 9.814 3.208 -13.464 1154 HA PRO 149 HA PRO 149 8.157 6.219 -15.447 1155 HB2 PRO 149 2HB PRO 149 10.293 7.867 -15.041 1156 HB3 PRO 149 1HB PRO 149 8.662 8.457 -15.379 1157 HG2 PRO 149 2HG PRO 149 10.088 8.226 -12.764 1158 HG3 PRO 149 1HG PRO 149 9.047 9.530 -13.365 1159 HD2 PRO 149 2HD PRO 149 8.171 7.656 -11.613 1160 HD3 PRO 149 1HD PRO 149 7.110 8.407 -12.820 Start of MODEL 8 1 H1 MET 1 H1 MET 1 31.137 3.945 12.003 2 H2 MET 1 H2 MET 1 29.911 3.258 12.951 3 H3 MET 1 H3 MET 1 31.530 3.110 13.427 4 HA MET 1 HA MET 1 30.330 4.756 14.733 5 HB2 MET 1 2HB MET 1 31.976 6.552 14.521 6 HB3 MET 1 1HB MET 1 32.753 4.982 14.410 7 HG2 MET 1 2HG MET 1 33.813 6.128 12.740 8 HG3 MET 1 1HG MET 1 32.509 5.353 11.844 9 HE1 MET 1 2HE MET 1 32.352 8.478 14.262 10 HE2 MET 1 3HE MET 1 32.544 9.790 13.098 11 HE3 MET 1 1HE MET 1 33.874 8.670 13.390 12 H GLY 2 HN GLY 2 29.567 7.063 14.726 13 HA2 GLY 2 2HA GLY 2 28.871 8.548 12.533 14 HA3 GLY 2 1HA GLY 2 27.572 7.373 12.690 15 H HIS 3 HN HIS 3 26.957 10.005 12.886 16 HA HIS 3 HA HIS 3 25.944 10.134 15.578 17 HB2 HIS 3 2HB HIS 3 26.788 12.539 15.876 18 HB3 HIS 3 1HB HIS 3 27.915 11.228 16.179 19 HD1 HIS 3 1HD HIS 3 29.965 12.689 15.786 20 HD2 HIS 3 2HD HIS 3 27.409 12.538 12.502 21 HE1 HIS 3 1HE HIS 3 31.240 13.727 13.879 22 HE2 HIS 3 2HE HIS 3 29.747 13.464 11.871 23 H HIS 4 HN HIS 4 23.894 10.569 15.326 24 HA HIS 4 HA HIS 4 23.146 12.884 13.696 25 HB2 HIS 4 2HB HIS 4 22.025 10.110 13.398 26 HB3 HIS 4 1HB HIS 4 21.038 11.519 13.029 27 HD1 HIS 4 1HD HIS 4 22.798 9.142 11.258 28 HD2 HIS 4 2HD HIS 4 22.889 13.302 11.221 29 HE1 HIS 4 1HE HIS 4 23.740 9.786 9.011 30 HE2 HIS 4 2HE HIS 4 23.875 12.306 9.051 31 H HIS 5 HN HIS 5 22.869 13.993 15.642 32 HA HIS 5 HA HIS 5 20.983 12.908 17.586 33 HB2 HIS 5 2HB HIS 5 23.188 14.167 18.135 34 HB3 HIS 5 1HB HIS 5 22.269 15.621 17.763 35 HD1 HIS 5 1HD HIS 5 22.872 13.134 20.394 36 HD2 HIS 5 2HD HIS 5 20.067 16.101 19.579 37 HE1 HIS 5 1HE HIS 5 21.631 13.509 22.551 38 HE2 HIS 5 2HE HIS 5 20.005 15.373 22.071 39 H HIS 6 HN HIS 6 19.297 13.003 15.893 40 HA HIS 6 HA HIS 6 18.369 15.614 15.092 41 HB2 HIS 6 2HB HIS 6 16.569 14.386 13.916 42 HB3 HIS 6 1HB HIS 6 18.171 13.806 13.489 43 HD1 HIS 6 1HD HIS 6 18.304 11.334 13.362 44 HD2 HIS 6 2HD HIS 6 15.372 12.577 16.040 45 HE1 HIS 6 1HE HIS 6 17.236 9.232 14.225 46 HE2 HIS 6 2HE HIS 6 15.568 9.997 15.948 47 H HIS 7 HN HIS 7 16.570 16.691 15.785 48 HA HIS 7 HA HIS 7 14.602 15.420 17.446 49 HB2 HIS 7 2HB HIS 7 16.346 16.025 19.120 50 HB3 HIS 7 1HB HIS 7 16.190 17.711 18.633 51 HD1 HIS 7 1HD HIS 7 14.206 14.942 20.277 52 HD2 HIS 7 2HD HIS 7 14.120 19.082 19.836 53 HE1 HIS 7 1HE HIS 7 12.362 15.751 21.793 54 HE2 HIS 7 2HE HIS 7 12.371 18.262 21.567 55 H HIS 8 HN HIS 8 13.070 16.008 15.982 56 HA HIS 8 HA HIS 8 12.655 18.908 15.639 57 HB2 HIS 8 2HB HIS 8 11.925 16.599 13.828 58 HB3 HIS 8 1HB HIS 8 11.249 18.213 13.633 59 HD1 HIS 8 1HD HIS 8 12.632 19.905 12.404 60 HD2 HIS 8 2HD HIS 8 14.776 16.470 13.362 61 HE1 HIS 8 1HE HIS 8 14.839 20.124 11.212 62 HE2 HIS 8 2HE HIS 8 16.076 17.980 11.706 63 H SER 9 HN SER 9 11.235 19.533 17.127 64 HA SER 9 HA SER 9 8.860 17.839 17.536 65 HB2 SER 9 2HB SER 9 10.460 17.664 19.443 66 HB3 SER 9 1HB SER 9 10.296 19.401 19.696 67 HG SER 9 HG SER 9 8.566 18.993 20.786 68 H HIS 10 HN HIS 10 7.279 18.908 16.594 69 HA HIS 10 HA HIS 10 6.455 21.445 17.659 70 HB2 HIS 10 2HB HIS 10 8.084 22.040 15.799 71 HB3 HIS 10 1HB HIS 10 6.954 21.291 14.678 72 HD1 HIS 10 1HD HIS 10 4.671 22.519 14.312 73 HD2 HIS 10 2HD HIS 10 7.391 24.573 16.685 74 HE1 HIS 10 1HE HIS 10 3.811 24.878 14.435 75 HE2 HIS 10 2HE HIS 10 5.421 26.086 15.957 76 H MET 11 HN MET 11 5.014 19.536 18.224 77 HA MET 11 HA MET 11 3.172 18.928 16.018 78 HB2 MET 11 2HB MET 11 3.834 17.315 18.484 79 HB3 MET 11 1HB MET 11 2.492 16.938 17.414 80 HG2 MET 11 2HG MET 11 4.231 15.521 16.751 81 HG3 MET 11 1HG MET 11 4.204 16.804 15.548 82 HE1 MET 11 3HE MET 11 6.094 15.227 18.595 83 HE2 MET 11 1HE MET 11 5.648 16.815 19.227 84 HE3 MET 11 2HE MET 11 7.342 16.429 18.914 85 H ASP 12 HN ASP 12 2.019 20.867 16.364 86 HA ASP 12 HA ASP 12 -0.023 20.453 18.421 87 HB2 ASP 12 2HB ASP 12 -0.278 22.868 18.721 88 HB3 ASP 12 1HB ASP 12 1.361 22.373 19.115 89 H TYR 13 HN TYR 13 -2.102 20.580 17.670 90 HA TYR 13 HA TYR 13 -2.372 21.125 14.790 91 HB2 TYR 13 2HB TYR 13 -3.619 18.838 16.326 92 HB3 TYR 13 1HB TYR 13 -3.936 19.217 14.638 93 HD1 TYR 13 2HD TYR 13 -2.261 18.760 12.927 94 HD2 TYR 13 1HD TYR 13 -1.539 17.796 17.006 95 HE1 TYR 13 2HE TYR 13 -0.375 17.332 12.248 96 HE2 TYR 13 1HE TYR 13 0.344 16.362 16.343 97 HH TYR 13 HH TYR 13 1.663 16.395 13.179 98 HA PRO 14 HA PRO 14 -5.644 23.626 16.783 99 HB2 PRO 14 2HB PRO 14 -5.223 25.387 14.493 100 HB3 PRO 14 1HB PRO 14 -5.045 25.741 16.212 101 HG2 PRO 14 2HG PRO 14 -2.935 25.598 14.517 102 HG3 PRO 14 1HG PRO 14 -2.820 25.177 16.236 103 HD2 PRO 14 2HD PRO 14 -3.064 23.378 13.850 104 HD3 PRO 14 1HD PRO 14 -2.061 23.193 15.306 105 H SER 15 HN SER 15 -7.592 22.779 16.372 106 HA SER 15 HA SER 15 -8.655 22.930 13.675 107 HB2 SER 15 2HB SER 15 -9.455 20.504 13.866 108 HB3 SER 15 1HB SER 15 -7.741 20.744 13.522 109 HG SER 15 HG SER 15 -7.360 20.458 15.790 110 H PHE 16 HN PHE 16 -10.310 24.257 14.203 111 HA PHE 16 HA PHE 16 -12.317 23.120 16.009 112 HB2 PHE 16 2HB PHE 16 -11.099 24.844 17.283 113 HB3 PHE 16 1HB PHE 16 -11.471 26.025 16.032 114 HD1 PHE 16 1HD PHE 16 -13.089 23.722 18.465 115 HD2 PHE 16 2HD PHE 16 -13.415 27.291 16.161 116 HE1 PHE 16 1HE PHE 16 -15.197 24.269 19.611 117 HE2 PHE 16 2HE PHE 16 -15.524 27.838 17.303 118 HZ PHE 16 HZ PHE 16 -16.416 26.330 19.029 119 H ASP 17 HN ASP 17 -13.731 22.553 14.473 120 HA ASP 17 HA ASP 17 -15.459 24.560 13.464 121 HB2 ASP 17 2HB ASP 17 -13.558 24.592 11.745 122 HB3 ASP 17 1HB ASP 17 -14.056 22.959 11.311 123 H LYS 18 HN LYS 18 -17.443 23.665 13.404 124 HA LYS 18 HA LYS 18 -17.696 20.819 12.815 125 HB2 LYS 18 2HB LYS 18 -19.150 20.482 14.822 126 HB3 LYS 18 1HB LYS 18 -17.461 20.783 15.201 127 HG2 LYS 18 2HG LYS 18 -18.009 23.122 15.711 128 HG3 LYS 18 1HG LYS 18 -19.709 22.779 15.387 129 HD2 LYS 18 2HD LYS 18 -19.649 21.072 17.189 130 HD3 LYS 18 1HD LYS 18 -17.992 21.563 17.548 131 HE2 LYS 18 2HE LYS 18 -18.779 23.841 18.013 132 HE3 LYS 18 1HE LYS 18 -20.432 23.327 17.680 133 HZ1 LYS 18 3HZ LYS 18 -20.187 21.702 19.520 134 HZ2 LYS 18 1HZ LYS 18 -20.106 23.321 20.018 135 HZ3 LYS 18 2HZ LYS 18 -18.686 22.407 19.895 136 H PHE 19 HN PHE 19 -19.145 20.701 11.234 137 HA PHE 19 HA PHE 19 -21.692 22.029 11.639 138 HB2 PHE 19 2HB PHE 19 -20.276 23.496 10.126 139 HB3 PHE 19 1HB PHE 19 -20.299 22.186 8.953 140 HD1 PHE 19 2HD PHE 19 -22.359 21.612 7.778 141 HD2 PHE 19 1HD PHE 19 -22.215 24.846 10.531 142 HE1 PHE 19 2HE PHE 19 -24.481 22.469 6.875 143 HE2 PHE 19 1HE PHE 19 -24.336 25.711 9.635 144 HZ PHE 19 HZ PHE 19 -25.471 24.521 7.802 145 H LEU 20 HN LEU 20 -20.984 18.613 9.500 146 HA LEU 20 HA LEU 20 -19.345 21.022 9.219 147 HB2 LEU 20 2HB LEU 20 -18.865 18.095 8.663 148 HB3 LEU 20 1HB LEU 20 -17.813 19.335 8.012 149 HG LEU 20 HG LEU 20 -18.314 18.969 10.964 150 HD11 LEU 20 1HD1 LEU 20 -16.037 17.957 9.263 151 HD12 LEU 20 2HD1 LEU 20 -17.257 16.967 10.068 152 HD13 LEU 20 3HD1 LEU 20 -16.110 17.902 11.025 153 HD21 LEU 20 3HD2 LEU 20 -17.571 21.197 10.319 154 HD22 LEU 20 1HD2 LEU 20 -16.227 20.499 9.413 155 HD23 LEU 20 2HD2 LEU 20 -16.286 20.336 11.168 156 H GLY 21 HN GLY 21 -19.396 22.141 7.305 157 HA2 GLY 21 2HA GLY 21 -20.790 20.838 5.057 158 HA3 GLY 21 1HA GLY 21 -21.377 22.374 5.674 159 H THR 22 HN THR 22 -19.647 20.995 3.298 160 HA THR 22 HA THR 22 -18.819 23.570 2.330 161 HB THR 22 HB THR 22 -16.698 21.434 2.723 162 HG1 THR 22 1HG THR 22 -17.502 23.392 4.332 163 HG21 THR 22 3HG2 THR 22 -16.388 22.591 0.611 164 HG22 THR 22 1HG2 THR 22 -15.156 23.103 1.765 165 HG23 THR 22 2HG2 THR 22 -16.530 24.153 1.422 166 H GLU 23 HN GLU 23 -17.447 20.466 1.442 167 HA GLU 23 HA GLU 23 -19.326 19.839 -0.614 168 HB2 GLU 23 2HB GLU 23 -16.703 21.134 -1.306 169 HB3 GLU 23 1HB GLU 23 -17.384 19.917 -2.375 170 HG2 GLU 23 2HG GLU 23 -19.362 21.250 -2.700 171 HG3 GLU 23 1HG GLU 23 -18.788 22.441 -1.534 172 H ASN 24 HN ASN 24 -18.137 18.036 -2.047 173 HA ASN 24 HA ASN 24 -16.680 16.311 -0.146 174 HB2 ASN 24 2HB ASN 24 -18.962 15.617 -1.151 175 HB3 ASN 24 1HB ASN 24 -18.077 15.377 -2.652 176 HD21 ASN 24 1HD2 ASN 24 -16.704 13.634 -2.842 177 HD22 ASN 24 2HD2 ASN 24 -16.652 12.352 -1.683 178 H ALA 25 HN ALA 25 -15.718 18.486 -1.904 179 HA ALA 25 HA ALA 25 -14.596 17.592 -4.294 180 HB1 ALA 25 1HB ALA 25 -13.624 19.824 -2.520 181 HB2 ALA 25 2HB ALA 25 -14.910 19.951 -3.721 182 HB3 ALA 25 3HB ALA 25 -13.256 19.610 -4.231 183 H GLU 26 HN GLU 26 -13.138 17.795 -1.047 184 HA GLU 26 HA GLU 26 -10.542 17.079 -1.891 185 HB2 GLU 26 2HB GLU 26 -11.827 16.852 0.830 186 HB3 GLU 26 1HB GLU 26 -10.117 16.594 0.518 187 HG2 GLU 26 2HG GLU 26 -9.988 18.919 -0.351 188 HG3 GLU 26 1HG GLU 26 -11.658 19.149 0.162 189 H LEU 27 HN LEU 27 -13.263 15.180 -0.726 190 HA LEU 27 HA LEU 27 -11.821 12.745 -0.558 191 HB2 LEU 27 2HB LEU 27 -13.818 13.108 0.748 192 HB3 LEU 27 1HB LEU 27 -14.773 13.333 -0.706 193 HG LEU 27 HG LEU 27 -14.366 10.995 -1.319 194 HD11 LEU 27 1HD1 LEU 27 -13.033 10.813 1.377 195 HD12 LEU 27 2HD1 LEU 27 -12.231 10.672 -0.187 196 HD13 LEU 27 3HD1 LEU 27 -13.401 9.453 0.316 197 HD21 LEU 27 3HD2 LEU 27 -16.377 11.596 -0.079 198 HD22 LEU 27 1HD2 LEU 27 -15.512 11.373 1.441 199 HD23 LEU 27 2HD2 LEU 27 -15.807 9.992 0.385 200 H VAL 28 HN VAL 28 -13.864 14.242 -3.042 201 HA VAL 28 HA VAL 28 -13.778 12.058 -4.851 202 HB VAL 28 HB VAL 28 -14.223 15.002 -5.395 203 HG11 VAL 28 1HG1 VAL 28 -15.192 14.277 -7.534 204 HG12 VAL 28 2HG1 VAL 28 -14.684 12.624 -7.193 205 HG13 VAL 28 3HG1 VAL 28 -13.475 13.888 -7.423 206 HG21 VAL 28 3HG2 VAL 28 -16.159 12.708 -5.100 207 HG22 VAL 28 1HG2 VAL 28 -16.586 14.360 -5.546 208 HG23 VAL 28 2HG2 VAL 28 -15.914 14.024 -3.951 209 H TYR 29 HN TYR 29 -11.680 14.820 -4.294 210 HA TYR 29 HA TYR 29 -10.012 14.608 -6.527 211 HB2 TYR 29 2HB TYR 29 -9.890 16.539 -5.094 212 HB3 TYR 29 1HB TYR 29 -9.441 15.552 -3.709 213 HD1 TYR 29 2HD TYR 29 -8.240 16.690 -7.041 214 HD2 TYR 29 1HD TYR 29 -7.183 15.138 -3.223 215 HE1 TYR 29 2HE TYR 29 -5.860 17.049 -7.558 216 HE2 TYR 29 1HE TYR 29 -4.808 15.497 -3.729 217 HH TYR 29 HH TYR 29 -3.361 15.703 -5.702 218 H VAL 30 HN VAL 30 -10.100 12.791 -3.548 219 HA VAL 30 HA VAL 30 -7.567 11.522 -3.908 220 HB VAL 30 HB VAL 30 -9.900 10.773 -2.138 221 HG11 VAL 30 1HG1 VAL 30 -8.272 9.418 -0.892 222 HG12 VAL 30 2HG1 VAL 30 -7.051 9.783 -2.114 223 HG13 VAL 30 3HG1 VAL 30 -8.481 8.844 -2.548 224 HG21 VAL 30 3HG2 VAL 30 -8.974 12.956 -1.594 225 HG22 VAL 30 1HG2 VAL 30 -7.352 12.267 -1.528 226 HG23 VAL 30 2HG2 VAL 30 -8.565 11.780 -0.344 227 H LEU 31 HN LEU 31 -10.929 10.616 -4.513 228 HA LEU 31 HA LEU 31 -10.582 7.912 -5.054 229 HB2 LEU 31 2HB LEU 31 -12.606 9.847 -6.171 230 HB3 LEU 31 1HB LEU 31 -12.707 8.105 -6.345 231 HG LEU 31 HG LEU 31 -12.745 9.579 -3.710 232 HD11 LEU 31 1HD1 LEU 31 -15.107 8.973 -3.642 233 HD12 LEU 31 2HD1 LEU 31 -14.979 8.275 -5.257 234 HD13 LEU 31 3HD1 LEU 31 -14.754 10.009 -5.025 235 HD21 LEU 31 3HD2 LEU 31 -13.382 7.416 -2.778 236 HD22 LEU 31 1HD2 LEU 31 -11.804 7.325 -3.559 237 HD23 LEU 31 2HD2 LEU 31 -13.228 6.675 -4.371 238 H ARG 32 HN ARG 32 -9.785 6.782 -6.672 239 HA ARG 32 HA ARG 32 -9.511 8.029 -9.319 240 HB2 ARG 32 2HB ARG 32 -7.343 7.608 -7.778 241 HB3 ARG 32 1HB ARG 32 -7.480 6.012 -8.494 242 HG2 ARG 32 2HG ARG 32 -7.305 8.557 -10.094 243 HG3 ARG 32 1HG ARG 32 -5.917 7.566 -9.658 244 HD2 ARG 32 2HD ARG 32 -6.390 6.816 -11.784 245 HD3 ARG 32 1HD ARG 32 -7.255 5.649 -10.789 246 HE ARG 32 HE ARG 32 -8.904 7.866 -11.551 247 HH11 ARG 32 1HH1 ARG 32 -7.571 4.833 -12.721 248 HH12 ARG 32 2HH1 ARG 32 -8.887 4.538 -13.819 249 HH21 ARG 32 1HH2 ARG 32 -10.607 7.486 -13.017 250 HH22 ARG 32 2HH2 ARG 32 -10.607 6.048 -13.988 251 H HIS 33 HN HIS 33 -8.633 4.780 -8.154 252 HA HIS 33 HA HIS 33 -11.025 3.518 -8.985 253 HB2 HIS 33 2HB HIS 33 -10.032 4.121 -11.224 254 HB3 HIS 33 1HB HIS 33 -8.674 3.072 -10.838 255 HD1 HIS 33 1HD HIS 33 -8.904 0.725 -11.636 256 HD2 HIS 33 2HD HIS 33 -12.593 2.606 -11.223 257 HE1 HIS 33 1HE HIS 33 -10.605 -0.921 -12.481 258 HE2 HIS 33 2HE HIS 33 -12.840 0.209 -12.172 259 H LYS 34 HN LYS 34 -11.144 1.496 -8.194 260 HA LYS 34 HA LYS 34 -9.285 0.574 -6.313 261 HB2 LYS 34 2HB LYS 34 -11.589 -0.059 -6.144 262 HB3 LYS 34 1HB LYS 34 -11.567 -0.797 -7.736 263 HG2 LYS 34 2HG LYS 34 -10.181 -2.591 -6.952 264 HG3 LYS 34 1HG LYS 34 -9.989 -1.811 -5.382 265 HD2 LYS 34 2HD LYS 34 -12.273 -2.157 -4.832 266 HD3 LYS 34 1HD LYS 34 -12.669 -2.630 -6.486 267 HE2 LYS 34 2HE LYS 34 -10.774 -4.168 -4.716 268 HE3 LYS 34 1HE LYS 34 -12.498 -4.523 -4.843 269 HZ1 LYS 34 3HZ LYS 34 -12.258 -5.032 -7.134 270 HZ2 LYS 34 1HZ LYS 34 -11.050 -5.891 -6.313 271 HZ3 LYS 34 2HZ LYS 34 -10.656 -4.483 -7.174 272 H HIS 35 HN HIS 35 -7.849 -1.162 -6.314 273 HA HIS 35 HA HIS 35 -6.918 -2.028 -8.970 274 HB2 HIS 35 2HB HIS 35 -5.396 -1.076 -6.569 275 HB3 HIS 35 1HB HIS 35 -4.641 -2.225 -7.664 276 HD1 HIS 35 1HD HIS 35 -6.589 1.023 -8.189 277 HD2 HIS 35 2HD HIS 35 -3.102 -0.887 -9.417 278 HE1 HIS 35 1HE HIS 35 -5.485 2.598 -9.803 279 HE2 HIS 35 2HE HIS 35 -3.300 1.500 -10.411 280 H GLY 36 HN GLY 36 -5.009 -3.878 -8.100 281 HA2 GLY 36 2HA GLY 36 -6.577 -6.178 -7.855 282 HA3 GLY 36 1HA GLY 36 -4.841 -6.108 -7.646 283 H GLN 37 HN GLN 37 -5.491 -7.906 -6.159 284 HA GLN 37 HA GLN 37 -6.813 -7.070 -3.697 285 HB2 GLN 37 2HB GLN 37 -7.475 -9.181 -4.863 286 HB3 GLN 37 1HB GLN 37 -5.875 -9.825 -4.515 287 HG2 GLN 37 2HG GLN 37 -6.319 -9.586 -2.113 288 HG3 GLN 37 1HG GLN 37 -7.937 -8.996 -2.484 289 HE21 GLN 37 1HE2 GLN 37 -7.185 -11.317 -0.927 290 HE22 GLN 37 2HE2 GLN 37 -7.880 -12.695 -1.719 291 H PHE 38 HN PHE 38 -3.766 -8.562 -4.738 292 HA PHE 38 HA PHE 38 -2.553 -7.606 -2.223 293 HB2 PHE 38 2HB PHE 38 -2.014 -10.199 -3.680 294 HB3 PHE 38 1HB PHE 38 -0.946 -9.550 -2.445 295 HD1 PHE 38 2HD PHE 38 -1.942 -9.157 -0.122 296 HD2 PHE 38 1HD PHE 38 -3.811 -11.547 -3.105 297 HE1 PHE 38 2HE PHE 38 -3.265 -10.282 1.615 298 HE2 PHE 38 1HE PHE 38 -5.138 -12.679 -1.367 299 HZ PHE 38 HZ PHE 38 -4.864 -12.046 0.997 300 H ILE 39 HN ILE 39 -1.768 -5.730 -3.143 301 HA ILE 39 HA ILE 39 0.060 -6.092 -5.435 302 HB ILE 39 HB ILE 39 -1.516 -3.601 -4.772 303 HG12 ILE 39 2HG1 ILE 39 -3.043 -5.369 -5.470 304 HG13 ILE 39 1HG1 ILE 39 -2.897 -4.164 -6.741 305 HG21 ILE 39 1HG2 ILE 39 0.550 -3.136 -5.951 306 HG22 ILE 39 2HG2 ILE 39 -0.832 -2.869 -7.015 307 HG23 ILE 39 3HG2 ILE 39 0.142 -4.328 -7.183 308 HD11 ILE 39 3HD1 ILE 39 -1.512 -6.832 -6.681 309 HD12 ILE 39 1HD1 ILE 39 -1.374 -5.623 -7.957 310 HD13 ILE 39 2HD1 ILE 39 -2.923 -6.409 -7.651 311 H TYR 40 HN TYR 40 2.109 -5.553 -5.113 312 HA TYR 40 HA TYR 40 2.737 -3.611 -2.985 313 HB2 TYR 40 2HB TYR 40 3.653 -5.939 -2.640 314 HB3 TYR 40 1HB TYR 40 4.602 -5.720 -4.108 315 HD1 TYR 40 2HD TYR 40 4.159 -4.650 -0.630 316 HD2 TYR 40 1HD TYR 40 6.572 -4.307 -4.114 317 HE1 TYR 40 2HE TYR 40 5.920 -3.582 0.706 318 HE2 TYR 40 1HE TYR 40 8.346 -3.239 -2.782 319 HH TYR 40 HH TYR 40 8.524 -1.946 -0.649 320 H VAL 41 HN VAL 41 3.473 -1.711 -3.709 321 HA VAL 41 HA VAL 41 4.793 -1.655 -6.341 322 HB VAL 41 HB VAL 41 3.877 0.695 -6.586 323 HG11 VAL 41 1HG1 VAL 41 3.009 -1.153 -7.886 324 HG12 VAL 41 2HG1 VAL 41 1.691 -0.082 -7.408 325 HG13 VAL 41 3HG1 VAL 41 1.935 -1.612 -6.563 326 HG21 VAL 41 3HG2 VAL 41 3.203 1.065 -4.275 327 HG22 VAL 41 1HG2 VAL 41 2.022 -0.239 -4.398 328 HG23 VAL 41 2HG2 VAL 41 1.823 1.225 -5.361 329 H TRP 42 HN TRP 42 6.870 -1.467 -5.835 330 HA TRP 42 HA TRP 42 7.712 0.326 -3.706 331 HB2 TRP 42 2HB TRP 42 9.943 -0.614 -4.058 332 HB3 TRP 42 1HB TRP 42 8.760 -1.902 -3.881 333 HD1 TRP 42 1HD TRP 42 8.242 -3.403 -6.045 334 HE1 TRP 42 1HE TRP 42 9.565 -3.801 -8.221 335 HE3 TRP 42 3HE TRP 42 11.493 0.536 -5.745 336 HZ2 TRP 42 2HZ TRP 42 11.696 -2.595 -9.618 337 HZ3 TRP 42 3HZ TRP 42 13.146 0.838 -7.542 338 HH2 TRP 42 2HH TRP 42 13.244 -0.696 -9.438 339 H GLY 43 HN GLY 43 9.547 1.861 -4.173 340 HA2 GLY 43 2HA GLY 43 10.587 2.750 -6.431 341 HA3 GLY 43 1HA GLY 43 8.926 3.276 -6.656 342 H GLU 44 HN GLU 44 9.710 5.423 -6.752 343 HA GLU 44 HA GLU 44 10.907 6.534 -4.325 344 HB2 GLU 44 2HB GLU 44 11.662 6.884 -6.850 345 HB3 GLU 44 1HB GLU 44 10.420 8.123 -6.817 346 HG2 GLU 44 2HG GLU 44 12.713 8.006 -4.870 347 HG3 GLU 44 1HG GLU 44 12.747 8.918 -6.377 348 H GLU 45 HN GLU 45 10.026 8.516 -3.422 349 HA GLU 45 HA GLU 45 7.292 8.405 -2.868 350 HB2 GLU 45 2HB GLU 45 8.890 9.484 -1.387 351 HB3 GLU 45 1HB GLU 45 9.240 10.702 -2.605 352 HG2 GLU 45 2HG GLU 45 6.868 11.438 -2.446 353 HG3 GLU 45 1HG GLU 45 6.667 10.320 -1.098 354 H GLY 46 HN GLY 46 9.078 10.407 -5.187 355 HA2 GLY 46 2HA GLY 46 6.819 11.986 -5.936 356 HA3 GLY 46 1HA GLY 46 8.348 11.886 -6.794 357 H ALA 47 HN ALA 47 7.716 8.812 -6.681 358 HA ALA 47 HA ALA 47 6.318 8.818 -9.248 359 HB1 ALA 47 1HB ALA 47 7.135 6.531 -9.487 360 HB2 ALA 47 2HB ALA 47 7.816 6.598 -7.862 361 HB3 ALA 47 3HB ALA 47 8.455 7.646 -9.130 362 H GLY 48 HN GLY 48 6.108 7.416 -6.014 363 HA2 GLY 48 2HA GLY 48 3.701 5.944 -6.660 364 HA3 GLY 48 1HA GLY 48 4.487 6.026 -5.091 365 H LYS 49 HN LYS 49 4.149 7.912 -3.789 366 HA LYS 49 HA LYS 49 2.904 9.487 -2.756 367 HB2 LYS 49 2HB LYS 49 1.611 9.880 -5.465 368 HB3 LYS 49 1HB LYS 49 1.312 10.892 -4.057 369 HG2 LYS 49 2HG LYS 49 3.714 11.472 -4.010 370 HG3 LYS 49 1HG LYS 49 3.939 10.532 -5.485 371 HD2 LYS 49 2HD LYS 49 3.749 12.870 -6.045 372 HD3 LYS 49 1HD LYS 49 2.320 12.017 -6.626 373 HE2 LYS 49 2HE LYS 49 0.982 12.870 -4.868 374 HE3 LYS 49 1HE LYS 49 2.393 13.443 -3.981 375 HZ1 LYS 49 3HZ LYS 49 1.137 15.214 -5.142 376 HZ2 LYS 49 1HZ LYS 49 1.561 14.510 -6.626 377 HZ3 LYS 49 2HZ LYS 49 2.765 15.123 -5.605 378 H SER 50 HN SER 50 1.120 9.438 -1.473 379 HA SER 50 HA SER 50 -0.209 6.893 -1.484 380 HB2 SER 50 2HB SER 50 -0.708 9.159 0.439 381 HB3 SER 50 1HB SER 50 -0.852 7.424 0.728 382 HG SER 50 HG SER 50 1.412 7.255 0.555 383 H HIS 51 HN HIS 51 -0.894 9.560 -3.175 384 HA HIS 51 HA HIS 51 -3.582 10.155 -2.776 385 HB2 HIS 51 2HB HIS 51 -2.493 11.582 -4.256 386 HB3 HIS 51 1HB HIS 51 -1.752 10.263 -5.149 387 HD1 HIS 51 1HD HIS 51 -5.295 11.633 -4.640 388 HD2 HIS 51 2HD HIS 51 -2.911 9.858 -7.547 389 HE1 HIS 51 1HE HIS 51 -6.694 11.588 -6.728 390 HE2 HIS 51 2HE HIS 51 -5.192 10.616 -8.505 391 H LEU 52 HN LEU 52 -2.138 7.625 -4.833 392 HA LEU 52 HA LEU 52 -4.668 6.644 -5.700 393 HB2 LEU 52 2HB LEU 52 -2.742 6.428 -7.116 394 HB3 LEU 52 1HB LEU 52 -1.857 5.571 -5.867 395 HG LEU 52 HG LEU 52 -3.505 3.739 -6.042 396 HD11 LEU 52 1HD1 LEU 52 -5.384 4.930 -6.973 397 HD12 LEU 52 2HD1 LEU 52 -4.907 3.643 -8.080 398 HD13 LEU 52 3HD1 LEU 52 -4.460 5.312 -8.425 399 HD21 LEU 52 3HD2 LEU 52 -2.605 2.839 -8.148 400 HD22 LEU 52 1HD2 LEU 52 -1.355 3.589 -7.156 401 HD23 LEU 52 2HD2 LEU 52 -2.001 4.444 -8.556 402 H LEU 53 HN LEU 53 -2.538 6.052 -3.051 403 HA LEU 53 HA LEU 53 -3.365 3.435 -2.355 404 HB2 LEU 53 2HB LEU 53 -1.264 4.556 -1.613 405 HB3 LEU 53 1HB LEU 53 -2.225 5.594 -0.580 406 HG LEU 53 HG LEU 53 -3.031 3.477 0.575 407 HD11 LEU 53 1HD1 LEU 53 -0.684 2.309 -0.915 408 HD12 LEU 53 2HD1 LEU 53 -2.380 1.889 -1.154 409 HD13 LEU 53 3HD1 LEU 53 -1.589 1.518 0.378 410 HD21 LEU 53 3HD2 LEU 53 -1.411 5.000 1.568 411 HD22 LEU 53 1HD2 LEU 53 -0.105 4.178 0.715 412 HD23 LEU 53 2HD2 LEU 53 -1.026 3.323 1.954 413 H GLN 54 HN GLN 54 -4.407 6.661 -1.349 414 HA GLN 54 HA GLN 54 -6.182 5.739 0.686 415 HB2 GLN 54 2HB GLN 54 -6.029 8.406 -0.731 416 HB3 GLN 54 1HB GLN 54 -7.016 8.077 0.684 417 HG2 GLN 54 2HG GLN 54 -5.055 7.664 2.015 418 HG3 GLN 54 1HG GLN 54 -4.018 7.836 0.598 419 HE21 GLN 54 1HE2 GLN 54 -6.006 9.487 2.920 420 HE22 GLN 54 2HE2 GLN 54 -5.429 11.079 2.576 421 H ALA 55 HN ALA 55 -6.512 6.498 -2.714 422 HA ALA 55 HA ALA 55 -9.308 6.662 -2.879 423 HB1 ALA 55 1HB ALA 55 -7.345 5.704 -4.960 424 HB2 ALA 55 2HB ALA 55 -7.835 7.375 -4.684 425 HB3 ALA 55 3HB ALA 55 -9.012 6.198 -5.264 426 H TRP 56 HN TRP 56 -7.106 3.959 -2.910 427 HA TRP 56 HA TRP 56 -8.929 1.956 -3.737 428 HB2 TRP 56 2HB TRP 56 -6.448 1.781 -3.809 429 HB3 TRP 56 1HB TRP 56 -6.425 1.712 -2.054 430 HD1 TRP 56 1HD TRP 56 -7.804 -0.359 -5.025 431 HE1 TRP 56 1HE TRP 56 -7.717 -2.849 -4.349 432 HE3 TRP 56 3HE TRP 56 -6.189 0.179 -0.216 433 HZ2 TRP 56 2HZ TRP 56 -7.045 -4.370 -2.065 434 HZ3 TRP 56 3HZ TRP 56 -5.839 -1.835 1.152 435 HH2 TRP 56 2HH TRP 56 -6.259 -4.063 0.246 436 H VAL 57 HN VAL 57 -8.080 3.323 -0.636 437 HA VAL 57 HA VAL 57 -9.524 1.407 0.921 438 HB VAL 57 HB VAL 57 -8.467 4.149 1.629 439 HG11 VAL 57 1HG1 VAL 57 -8.784 3.486 3.970 440 HG12 VAL 57 2HG1 VAL 57 -9.580 2.004 3.433 441 HG13 VAL 57 3HG1 VAL 57 -10.317 3.570 3.101 442 HG21 VAL 57 3HG2 VAL 57 -6.697 2.622 1.107 443 HG22 VAL 57 1HG2 VAL 57 -7.425 1.366 2.106 444 HG23 VAL 57 2HG2 VAL 57 -6.767 2.817 2.859 445 H ALA 58 HN ALA 58 -10.159 4.755 -0.112 446 HA ALA 58 HA ALA 58 -12.615 5.063 1.211 447 HB1 ALA 58 1HB ALA 58 -11.330 6.934 0.288 448 HB2 ALA 58 2HB ALA 58 -13.001 6.942 -0.278 449 HB3 ALA 58 3HB ALA 58 -11.712 6.383 -1.345 450 H GLN 59 HN GLN 59 -11.881 3.798 -2.013 451 HA GLN 59 HA GLN 59 -14.530 3.573 -2.930 452 HB2 GLN 59 2HB GLN 59 -12.432 3.313 -4.307 453 HB3 GLN 59 1HB GLN 59 -12.239 1.714 -3.604 454 HG2 GLN 59 2HG GLN 59 -13.234 1.472 -5.752 455 HG3 GLN 59 1HG GLN 59 -14.458 1.099 -4.539 456 HE21 GLN 59 1HE2 GLN 59 -16.128 1.518 -5.966 457 HE22 GLN 59 2HE2 GLN 59 -16.553 3.122 -6.457 458 H ALA 60 HN ALA 60 -12.475 1.389 -1.072 459 HA ALA 60 HA ALA 60 -14.347 -0.762 -0.984 460 HB1 ALA 60 1HB ALA 60 -11.994 -0.183 0.806 461 HB2 ALA 60 2HB ALA 60 -11.959 -1.118 -0.689 462 HB3 ALA 60 3HB ALA 60 -12.865 -1.713 0.702 463 H LEU 61 HN LEU 61 -13.786 2.066 0.989 464 HA LEU 61 HA LEU 61 -15.221 1.290 3.290 465 HB2 LEU 61 2HB LEU 61 -14.685 4.010 2.097 466 HB3 LEU 61 1HB LEU 61 -15.452 3.777 3.656 467 HG LEU 61 HG LEU 61 -12.651 2.911 2.924 468 HD11 LEU 61 1HD1 LEU 61 -13.649 5.121 4.714 469 HD12 LEU 61 2HD1 LEU 61 -12.887 5.329 3.138 470 HD13 LEU 61 3HD1 LEU 61 -11.962 4.660 4.482 471 HD21 LEU 61 3HD2 LEU 61 -12.433 2.372 5.300 472 HD22 LEU 61 1HD2 LEU 61 -13.686 1.397 4.536 473 HD23 LEU 61 2HD2 LEU 61 -14.132 2.770 5.550 474 H GLU 62 HN GLU 62 -16.226 3.083 0.388 475 HA GLU 62 HA GLU 62 -18.961 3.218 1.265 476 HB2 GLU 62 2HB GLU 62 -17.711 3.850 -1.414 477 HB3 GLU 62 1HB GLU 62 -19.385 4.182 -0.980 478 HG2 GLU 62 2HG GLU 62 -18.602 5.625 0.848 479 HG3 GLU 62 1HG GLU 62 -16.942 5.329 0.336 480 H ALA 63 HN ALA 63 -17.068 0.852 -0.154 481 HA ALA 63 HA ALA 63 -19.145 -0.549 -1.547 482 HB1 ALA 63 1HB ALA 63 -16.777 -0.911 -2.071 483 HB2 ALA 63 2HB ALA 63 -17.579 -2.415 -1.616 484 HB3 ALA 63 3HB ALA 63 -16.530 -1.591 -0.463 485 H GLY 64 HN GLY 64 -18.285 -0.121 1.724 486 HA2 GLY 64 2HA GLY 64 -19.853 -0.607 3.439 487 HA3 GLY 64 1HA GLY 64 -20.451 -1.950 2.475 488 H LYS 65 HN LYS 65 -17.058 -1.639 2.645 489 HA LYS 65 HA LYS 65 -16.976 -3.923 4.487 490 HB2 LYS 65 2HB LYS 65 -15.245 -3.130 2.162 491 HB3 LYS 65 1HB LYS 65 -14.648 -4.229 3.396 492 HG2 LYS 65 2HG LYS 65 -15.507 -5.432 1.470 493 HG3 LYS 65 1HG LYS 65 -16.458 -5.781 2.912 494 HD2 LYS 65 2HD LYS 65 -18.140 -4.158 2.160 495 HD3 LYS 65 1HD LYS 65 -17.193 -3.874 0.704 496 HE2 LYS 65 2HE LYS 65 -17.523 -6.147 -0.018 497 HE3 LYS 65 1HE LYS 65 -18.297 -6.559 1.511 498 HZ1 LYS 65 3HZ LYS 65 -20.083 -5.009 0.972 499 HZ2 LYS 65 1HZ LYS 65 -19.938 -6.221 -0.206 500 HZ3 LYS 65 2HZ LYS 65 -19.349 -4.662 -0.518 501 H ASN 66 HN ASN 66 -14.515 -4.052 5.311 502 HA ASN 66 HA ASN 66 -14.072 -1.536 6.759 503 HB2 ASN 66 2HB ASN 66 -14.352 -3.804 7.963 504 HB3 ASN 66 1HB ASN 66 -12.742 -4.175 7.376 505 HD21 ASN 66 1HD2 ASN 66 -13.669 -3.915 10.098 506 HD22 ASN 66 2HD2 ASN 66 -12.715 -2.663 10.825 507 H ALA 67 HN ALA 67 -12.232 -0.405 6.511 508 HA ALA 67 HA ALA 67 -9.961 -1.479 5.093 509 HB1 ALA 67 1HB ALA 67 -11.481 -0.966 3.241 510 HB2 ALA 67 2HB ALA 67 -10.064 0.084 3.227 511 HB3 ALA 67 3HB ALA 67 -11.610 0.698 3.811 512 H ALA 68 HN ALA 68 -8.123 -0.182 5.269 513 HA ALA 68 HA ALA 68 -8.314 2.447 6.450 514 HB1 ALA 68 1HB ALA 68 -6.984 0.239 8.029 515 HB2 ALA 68 2HB ALA 68 -8.547 0.960 8.412 516 HB3 ALA 68 3HB ALA 68 -7.087 1.943 8.475 517 H TYR 69 HN TYR 69 -6.503 3.661 6.072 518 HA TYR 69 HA TYR 69 -4.212 2.247 4.908 519 HB2 TYR 69 2HB TYR 69 -3.664 4.309 3.677 520 HB3 TYR 69 1HB TYR 69 -5.227 3.663 3.214 521 HD1 TYR 69 1HD TYR 69 -7.290 4.876 3.779 522 HD2 TYR 69 2HD TYR 69 -3.466 6.430 4.827 523 HE1 TYR 69 1HE TYR 69 -8.299 7.082 4.188 524 HE2 TYR 69 2HE TYR 69 -4.471 8.632 5.245 525 HH TYR 69 HH TYR 69 -7.833 9.115 5.470 526 H ILE 70 HN ILE 70 -2.242 2.658 5.681 527 HA ILE 70 HA ILE 70 -2.061 4.499 7.970 528 HB ILE 70 HB ILE 70 -0.817 1.745 7.769 529 HG12 ILE 70 2HG1 ILE 70 -2.946 2.831 9.630 530 HG13 ILE 70 1HG1 ILE 70 -3.249 1.758 8.267 531 HG21 ILE 70 1HG2 ILE 70 0.670 3.296 8.903 532 HG22 ILE 70 2HG2 ILE 70 -0.039 2.181 10.071 533 HG23 ILE 70 3HG2 ILE 70 -0.648 3.832 9.944 534 HD11 ILE 70 3HD1 ILE 70 -1.905 0.024 9.348 535 HD12 ILE 70 1HD1 ILE 70 -3.258 0.540 10.355 536 HD13 ILE 70 2HD1 ILE 70 -1.626 1.104 10.713 537 H ASP 71 HN ASP 71 -0.598 6.009 7.668 538 HA ASP 71 HA ASP 71 1.565 5.677 5.762 539 HB2 ASP 71 2HB ASP 71 0.865 8.017 7.558 540 HB3 ASP 71 1HB ASP 71 2.093 8.029 6.296 541 H ALA 72 HN ALA 72 3.245 4.521 6.497 542 HA ALA 72 HA ALA 72 3.673 3.905 9.192 543 HB1 ALA 72 1HB ALA 72 4.447 2.500 7.363 544 HB2 ALA 72 2HB ALA 72 5.749 2.879 8.492 545 HB3 ALA 72 3HB ALA 72 5.654 3.715 6.940 546 H ALA 73 HN ALA 73 4.626 6.719 7.467 547 HA ALA 73 HA ALA 73 6.599 7.352 9.554 548 HB1 ALA 73 1HB ALA 73 6.192 8.684 6.882 549 HB2 ALA 73 2HB ALA 73 7.412 7.464 7.246 550 HB3 ALA 73 3HB ALA 73 7.475 9.034 8.042 551 H SER 74 HN SER 74 3.554 7.586 9.561 552 HA SER 74 HA SER 74 3.545 10.226 10.805 553 HB2 SER 74 2HB SER 74 2.749 10.632 8.528 554 HB3 SER 74 1HB SER 74 1.530 9.372 8.710 555 HG SER 74 HG SER 74 1.688 11.729 10.295 556 H MET 75 HN MET 75 2.033 7.099 10.299 557 HA MET 75 HA MET 75 0.618 7.394 12.861 558 HB2 MET 75 2HB MET 75 -0.507 6.244 10.297 559 HB3 MET 75 1HB MET 75 -1.290 6.110 11.863 560 HG2 MET 75 2HG MET 75 -1.411 8.574 11.972 561 HG3 MET 75 1HG MET 75 -0.715 8.654 10.355 562 HE1 MET 75 3HE MET 75 -3.523 6.930 8.208 563 HE2 MET 75 1HE MET 75 -2.205 6.072 9.005 564 HE3 MET 75 2HE MET 75 -1.898 7.614 8.209 565 HA PRO 76 HA PRO 76 2.433 3.402 13.568 566 HB2 PRO 76 2HB PRO 76 1.306 2.819 15.912 567 HB3 PRO 76 1HB PRO 76 2.430 4.175 15.756 568 HG2 PRO 76 2HG PRO 76 -0.557 4.194 15.893 569 HG3 PRO 76 1HG PRO 76 0.605 5.305 16.638 570 HD2 PRO 76 2HD PRO 76 -0.785 5.779 14.279 571 HD3 PRO 76 1HD PRO 76 0.700 6.612 14.776 572 H LEU 77 HN LEU 77 1.649 1.146 14.359 573 HA LEU 77 HA LEU 77 -0.686 0.441 12.743 574 HB2 LEU 77 2HB LEU 77 1.433 -0.701 12.229 575 HB3 LEU 77 1HB LEU 77 1.506 -1.310 13.870 576 HG LEU 77 HG LEU 77 -0.581 -2.594 13.450 577 HD11 LEU 77 1HD1 LEU 77 -0.190 -1.666 10.610 578 HD12 LEU 77 2HD1 LEU 77 -1.515 -1.205 11.680 579 HD13 LEU 77 3HD1 LEU 77 -1.349 -2.880 11.151 580 HD21 LEU 77 3HD2 LEU 77 1.629 -3.622 13.196 581 HD22 LEU 77 1HD2 LEU 77 1.642 -3.151 11.498 582 HD23 LEU 77 2HD2 LEU 77 0.445 -4.308 12.083 583 H THR 78 HN THR 78 -2.383 -0.749 13.569 584 HA THR 78 HA THR 78 -2.436 -1.126 16.478 585 HB THR 78 HB THR 78 -4.913 -0.582 16.315 586 HG1 THR 78 1HG THR 78 -5.595 0.531 14.486 587 HG21 THR 78 3HG2 THR 78 -4.572 1.849 16.367 588 HG22 THR 78 1HG2 THR 78 -2.970 1.643 15.659 589 HG23 THR 78 2HG2 THR 78 -3.311 1.009 17.269 590 H ASP 79 HN ASP 79 -3.839 -2.819 17.209 591 HA ASP 79 HA ASP 79 -3.868 -5.121 15.530 592 HB2 ASP 79 2HB ASP 79 -4.944 -6.252 17.383 593 HB3 ASP 79 1HB ASP 79 -3.643 -5.246 18.000 594 H ALA 80 HN ALA 80 -5.990 -2.494 15.982 595 HA ALA 80 HA ALA 80 -8.461 -3.618 15.282 596 HB1 ALA 80 1HB ALA 80 -8.227 -1.337 16.136 597 HB2 ALA 80 2HB ALA 80 -9.122 -1.373 14.618 598 HB3 ALA 80 3HB ALA 80 -7.436 -0.856 14.636 599 H ALA 81 HN ALA 81 -5.656 -2.879 13.388 600 HA ALA 81 HA ALA 81 -6.823 -2.795 10.819 601 HB1 ALA 81 1HB ALA 81 -4.550 -3.228 9.994 602 HB2 ALA 81 2HB ALA 81 -4.038 -3.628 11.635 603 HB3 ALA 81 3HB ALA 81 -4.561 -1.988 11.251 604 H PHE 82 HN PHE 82 -6.407 -5.353 13.013 605 HA PHE 82 HA PHE 82 -6.149 -7.501 11.153 606 HB2 PHE 82 2HB PHE 82 -5.947 -7.238 13.887 607 HB3 PHE 82 1HB PHE 82 -7.468 -8.103 13.708 608 HD1 PHE 82 2HD PHE 82 -7.465 -10.272 12.408 609 HD2 PHE 82 1HD PHE 82 -3.913 -8.312 13.672 610 HE1 PHE 82 2HE PHE 82 -6.209 -12.372 12.115 611 HE2 PHE 82 1HE PHE 82 -2.651 -10.396 13.393 612 HZ PHE 82 HZ PHE 82 -3.796 -12.435 12.609 613 H GLU 83 HN GLU 83 -8.749 -5.571 12.334 614 HA GLU 83 HA GLU 83 -10.823 -7.465 11.682 615 HB2 GLU 83 2HB GLU 83 -11.049 -4.538 12.365 616 HB3 GLU 83 1HB GLU 83 -12.355 -5.710 12.341 617 HG2 GLU 83 2HG GLU 83 -11.241 -6.944 14.153 618 HG3 GLU 83 1HG GLU 83 -10.007 -5.685 14.205 619 H ALA 84 HN ALA 84 -9.165 -4.839 10.198 620 HA ALA 84 HA ALA 84 -11.091 -4.209 8.216 621 HB1 ALA 84 1HB ALA 84 -9.404 -2.597 8.878 622 HB2 ALA 84 2HB ALA 84 -9.252 -2.959 7.159 623 HB3 ALA 84 3HB ALA 84 -8.123 -3.670 8.314 624 H GLU 85 HN GLU 85 -11.310 -4.956 6.186 625 HA GLU 85 HA GLU 85 -9.891 -7.415 5.530 626 HB2 GLU 85 2HB GLU 85 -12.499 -6.756 5.239 627 HB3 GLU 85 1HB GLU 85 -11.898 -6.330 3.641 628 HG2 GLU 85 2HG GLU 85 -12.710 -8.585 3.608 629 HG3 GLU 85 1HG GLU 85 -10.956 -8.599 3.430 630 H TYR 86 HN TYR 86 -10.034 -4.077 4.610 631 HA TYR 86 HA TYR 86 -8.132 -4.584 2.414 632 HB2 TYR 86 2HB TYR 86 -9.984 -2.240 2.882 633 HB3 TYR 86 1HB TYR 86 -8.748 -2.279 1.635 634 HD1 TYR 86 1HD TYR 86 -11.771 -4.136 2.797 635 HD2 TYR 86 2HD TYR 86 -9.285 -3.054 -0.482 636 HE1 TYR 86 1HE TYR 86 -13.394 -5.133 1.242 637 HE2 TYR 86 2HE TYR 86 -10.900 -4.051 -2.045 638 HH TYR 86 HH TYR 86 -14.044 -4.905 -1.145 639 H LEU 87 HN LEU 87 -6.120 -4.382 3.212 640 HA LEU 87 HA LEU 87 -5.590 -2.146 5.051 641 HB2 LEU 87 2HB LEU 87 -4.208 -4.787 4.679 642 HB3 LEU 87 1HB LEU 87 -3.408 -3.444 5.470 643 HG LEU 87 HG LEU 87 -4.267 -4.806 7.191 644 HD11 LEU 87 1HD1 LEU 87 -5.898 -3.373 8.305 645 HD12 LEU 87 2HD1 LEU 87 -6.178 -2.515 6.791 646 HD13 LEU 87 3HD1 LEU 87 -4.599 -2.436 7.571 647 HD21 LEU 87 3HD2 LEU 87 -5.813 -6.142 5.880 648 HD22 LEU 87 1HD2 LEU 87 -6.918 -4.772 5.757 649 HD23 LEU 87 2HD2 LEU 87 -6.603 -5.513 7.327 650 H ALA 88 HN ALA 88 -4.616 -0.454 4.240 651 HA ALA 88 HA ALA 88 -2.712 -0.855 2.024 652 HB1 ALA 88 1HB ALA 88 -4.465 1.551 2.513 653 HB2 ALA 88 2HB ALA 88 -4.725 0.320 1.274 654 HB3 ALA 88 3HB ALA 88 -3.301 1.356 1.204 655 H VAL 89 HN VAL 89 -0.693 -0.546 2.724 656 HA VAL 89 HA VAL 89 -0.230 1.540 4.757 657 HB VAL 89 HB VAL 89 1.169 -1.143 4.656 658 HG11 VAL 89 1HG1 VAL 89 2.634 0.665 5.416 659 HG12 VAL 89 2HG1 VAL 89 2.246 -0.446 6.728 660 HG13 VAL 89 3HG1 VAL 89 1.442 1.120 6.634 661 HG21 VAL 89 3HG2 VAL 89 -0.830 -0.055 6.635 662 HG22 VAL 89 1HG2 VAL 89 0.054 -1.572 6.803 663 HG23 VAL 89 2HG2 VAL 89 -1.100 -1.366 5.487 664 H ASP 90 HN ASP 90 1.221 3.001 4.177 665 HA ASP 90 HA ASP 90 2.940 2.417 1.853 666 HB2 ASP 90 2HB ASP 90 1.271 4.405 1.860 667 HB3 ASP 90 1HB ASP 90 2.391 5.163 2.974 668 H GLN 91 HN GLN 91 5.098 3.346 1.888 669 HA GLN 91 HA GLN 91 7.131 3.880 2.766 670 HB2 GLN 91 2HB GLN 91 5.817 4.836 5.286 671 HB3 GLN 91 1HB GLN 91 7.211 5.500 4.443 672 HG2 GLN 91 2HG GLN 91 5.810 6.403 2.722 673 HG3 GLN 91 1HG GLN 91 4.394 5.599 3.397 674 HE21 GLN 91 1HE2 GLN 91 6.488 8.305 3.570 675 HE22 GLN 91 2HE2 GLN 91 5.627 9.152 4.808 676 H VAL 92 HN VAL 92 6.172 1.217 3.214 677 HA VAL 92 HA VAL 92 6.570 0.451 5.923 678 HB VAL 92 HB VAL 92 5.278 -0.997 4.510 679 HG11 VAL 92 1HG1 VAL 92 6.253 -0.501 2.354 680 HG12 VAL 92 2HG1 VAL 92 6.262 -2.244 2.630 681 HG13 VAL 92 3HG1 VAL 92 7.749 -1.312 2.813 682 HG21 VAL 92 3HG2 VAL 92 6.535 -2.083 6.293 683 HG22 VAL 92 1HG2 VAL 92 7.896 -2.323 5.199 684 HG23 VAL 92 2HG2 VAL 92 6.369 -3.152 4.900 685 H GLU 93 HN GLU 93 8.330 0.394 6.990 686 HA GLU 93 HA GLU 93 10.746 -0.771 6.423 687 HB2 GLU 93 2HB GLU 93 12.260 1.072 5.946 688 HB3 GLU 93 1HB GLU 93 11.034 0.998 4.688 689 HG2 GLU 93 2HG GLU 93 9.945 2.908 5.474 690 HG3 GLU 93 1HG GLU 93 10.757 2.834 7.037 691 H LYS 94 HN LYS 94 8.964 1.780 7.920 692 HA LYS 94 HA LYS 94 10.752 2.266 10.080 693 HB2 LYS 94 2HB LYS 94 7.838 2.992 9.843 694 HB3 LYS 94 1HB LYS 94 9.010 3.711 10.935 695 HG2 LYS 94 2HG LYS 94 9.044 3.884 7.932 696 HG3 LYS 94 1HG LYS 94 8.577 5.168 9.050 697 HD2 LYS 94 2HD LYS 94 11.292 3.867 9.073 698 HD3 LYS 94 1HD LYS 94 10.925 5.305 8.133 699 HE2 LYS 94 2HE LYS 94 10.216 6.429 10.234 700 HE3 LYS 94 1HE LYS 94 10.750 5.005 11.124 701 HZ1 LYS 94 3HZ LYS 94 12.402 6.816 11.063 702 HZ2 LYS 94 1HZ LYS 94 12.504 6.642 9.378 703 HZ3 LYS 94 2HZ LYS 94 12.982 5.370 10.394 704 H LEU 95 HN LEU 95 8.615 -0.245 9.462 705 HA LEU 95 HA LEU 95 7.434 -0.637 11.994 706 HB2 LEU 95 2HB LEU 95 8.121 -2.715 9.910 707 HB3 LEU 95 1HB LEU 95 6.966 -2.900 11.212 708 HG LEU 95 HG LEU 95 6.707 -1.035 8.852 709 HD11 LEU 95 1HD1 LEU 95 4.839 -2.460 8.232 710 HD12 LEU 95 2HD1 LEU 95 5.143 -3.491 9.631 711 HD13 LEU 95 3HD1 LEU 95 6.330 -3.396 8.329 712 HD21 LEU 95 3HD2 LEU 95 4.495 -0.510 9.740 713 HD22 LEU 95 1HD2 LEU 95 5.763 -0.036 10.871 714 HD23 LEU 95 2HD2 LEU 95 4.822 -1.500 11.162 715 H GLY 96 HN GLY 96 8.167 -1.547 13.816 716 HA2 GLY 96 2HA GLY 96 11.022 -2.195 13.892 717 HA3 GLY 96 1HA GLY 96 10.008 -1.803 15.270 718 H ASN 97 HN ASN 97 8.651 -3.433 16.150 719 HA ASN 97 HA ASN 97 9.389 -6.158 15.341 720 HB2 ASN 97 2HB ASN 97 9.628 -6.786 17.736 721 HB3 ASN 97 1HB ASN 97 10.838 -5.630 17.199 722 HD21 ASN 97 1HD2 ASN 97 9.808 -6.269 19.879 723 HD22 ASN 97 2HD2 ASN 97 9.268 -4.767 20.542 724 H GLU 98 HN GLU 98 7.267 -4.320 17.525 725 HA GLU 98 HA GLU 98 5.332 -6.326 17.854 726 HB2 GLU 98 2HB GLU 98 4.941 -3.326 17.972 727 HB3 GLU 98 1HB GLU 98 3.900 -4.540 18.704 728 HG2 GLU 98 2HG GLU 98 5.581 -5.150 20.272 729 HG3 GLU 98 1HG GLU 98 6.795 -4.187 19.432 730 H GLU 99 HN GLU 99 5.587 -3.641 15.588 731 HA GLU 99 HA GLU 99 3.117 -4.001 14.294 732 HB2 GLU 99 2HB GLU 99 5.598 -2.917 12.971 733 HB3 GLU 99 1HB GLU 99 3.925 -2.510 12.624 734 HG2 GLU 99 2HG GLU 99 4.540 -0.665 13.793 735 HG3 GLU 99 1HG GLU 99 3.963 -1.673 15.120 736 H GLN 100 HN GLN 100 6.318 -5.371 13.662 737 HA GLN 100 HA GLN 100 5.601 -6.540 11.173 738 HB2 GLN 100 2HB GLN 100 7.889 -7.136 13.050 739 HB3 GLN 100 1HB GLN 100 7.700 -7.882 11.469 740 HG2 GLN 100 2HG GLN 100 7.702 -5.549 10.505 741 HG3 GLN 100 1HG GLN 100 8.198 -4.986 12.099 742 HE21 GLN 100 1HE2 GLN 100 10.186 -4.232 11.328 743 HE22 GLN 100 2HE2 GLN 100 11.464 -5.312 10.882 744 H ALA 101 HN ALA 101 5.551 -7.665 14.505 745 HA ALA 101 HA ALA 101 4.949 -10.371 13.952 746 HB1 ALA 101 1HB ALA 101 5.722 -9.594 16.149 747 HB2 ALA 101 2HB ALA 101 4.217 -10.503 16.266 748 HB3 ALA 101 3HB ALA 101 4.192 -8.743 16.378 749 H LEU 102 HN LEU 102 2.944 -7.519 14.472 750 HA LEU 102 HA LEU 102 0.427 -8.795 14.317 751 HB2 LEU 102 2HB LEU 102 1.107 -6.398 15.088 752 HB3 LEU 102 1HB LEU 102 0.945 -5.983 13.396 753 HG LEU 102 HG LEU 102 -1.041 -5.421 14.760 754 HD11 LEU 102 1HD1 LEU 102 -1.307 -5.758 12.374 755 HD12 LEU 102 2HD1 LEU 102 -2.721 -6.349 13.247 756 HD13 LEU 102 3HD1 LEU 102 -1.526 -7.489 12.628 757 HD21 LEU 102 3HD2 LEU 102 -2.522 -7.216 15.512 758 HD22 LEU 102 1HD2 LEU 102 -0.963 -7.267 16.334 759 HD23 LEU 102 2HD2 LEU 102 -1.313 -8.408 15.035 760 H LEU 103 HN LEU 103 2.389 -7.086 11.906 761 HA LEU 103 HA LEU 103 0.755 -7.377 9.677 762 HB2 LEU 103 2HB LEU 103 3.246 -6.343 10.205 763 HB3 LEU 103 1HB LEU 103 3.613 -7.674 9.128 764 HG LEU 103 HG LEU 103 3.396 -5.645 7.859 765 HD11 LEU 103 1HD1 LEU 103 1.686 -6.290 6.257 766 HD12 LEU 103 2HD1 LEU 103 0.980 -7.392 7.438 767 HD13 LEU 103 3HD1 LEU 103 2.598 -7.694 6.804 768 HD21 LEU 103 3HD2 LEU 103 0.638 -5.425 9.048 769 HD22 LEU 103 1HD2 LEU 103 1.287 -4.396 7.771 770 HD23 LEU 103 2HD2 LEU 103 2.008 -4.368 9.380 771 H PHE 104 HN PHE 104 3.375 -9.515 10.789 772 HA PHE 104 HA PHE 104 3.224 -11.492 8.846 773 HB2 PHE 104 2HB PHE 104 4.968 -11.411 10.580 774 HB3 PHE 104 1HB PHE 104 3.780 -11.835 11.802 775 HD1 PHE 104 1HD PHE 104 5.513 -13.089 8.784 776 HD2 PHE 104 2HD PHE 104 3.234 -14.067 12.239 777 HE1 PHE 104 1HE PHE 104 5.981 -15.472 8.407 778 HE2 PHE 104 2HE PHE 104 3.695 -16.456 11.868 779 HZ PHE 104 HZ PHE 104 5.068 -17.159 9.950 780 H SER 105 HN SER 105 1.369 -11.168 11.831 781 HA SER 105 HA SER 105 -0.089 -13.541 11.636 782 HB2 SER 105 2HB SER 105 -0.832 -10.909 12.918 783 HB3 SER 105 1HB SER 105 -1.583 -12.464 13.250 784 HG SER 105 HG SER 105 1.022 -11.581 13.869 785 H ILE 106 HN ILE 106 -0.635 -10.337 10.283 786 HA ILE 106 HA ILE 106 -3.238 -10.751 9.271 787 HB ILE 106 HB ILE 106 -1.034 -8.973 8.198 788 HG12 ILE 106 2HG1 ILE 106 -3.372 -8.342 10.014 789 HG13 ILE 106 1HG1 ILE 106 -1.696 -8.493 10.530 790 HG21 ILE 106 1HG2 ILE 106 -2.722 -9.382 6.495 791 HG22 ILE 106 2HG2 ILE 106 -2.824 -7.722 7.085 792 HG23 ILE 106 3HG2 ILE 106 -3.993 -8.926 7.629 793 HD11 ILE 106 3HD1 ILE 106 -2.324 -6.168 10.321 794 HD12 ILE 106 1HD1 ILE 106 -2.793 -6.424 8.640 795 HD13 ILE 106 2HD1 ILE 106 -1.102 -6.581 9.119 796 H PHE 107 HN PHE 107 -0.028 -11.328 7.864 797 HA PHE 107 HA PHE 107 -0.884 -12.207 5.344 798 HB2 PHE 107 2HB PHE 107 1.588 -12.691 6.969 799 HB3 PHE 107 1HB PHE 107 1.341 -13.552 5.458 800 HD1 PHE 107 2HD PHE 107 0.576 -11.952 3.464 801 HD2 PHE 107 1HD PHE 107 2.814 -10.752 6.878 802 HE1 PHE 107 2HE PHE 107 1.449 -10.026 2.209 803 HE2 PHE 107 1HE PHE 107 3.690 -8.823 5.628 804 HZ PHE 107 HZ PHE 107 3.008 -8.461 3.291 805 H ASN 108 HN ASN 108 -0.385 -13.958 8.376 806 HA ASN 108 HA ASN 108 -0.854 -16.547 7.344 807 HB2 ASN 108 2HB ASN 108 0.210 -16.114 9.538 808 HB3 ASN 108 1HB ASN 108 -1.332 -15.537 10.160 809 HD21 ASN 108 1HD2 ASN 108 -2.851 -16.986 10.810 810 HD22 ASN 108 2HD2 ASN 108 -2.606 -18.709 10.806 811 H ARG 109 HN ARG 109 -2.982 -14.003 8.380 812 HA ARG 109 HA ARG 109 -5.360 -15.595 8.409 813 HB2 ARG 109 2HB ARG 109 -5.463 -13.640 9.714 814 HB3 ARG 109 1HB ARG 109 -4.817 -12.636 8.423 815 HG2 ARG 109 2HG ARG 109 -6.900 -12.933 7.162 816 HG3 ARG 109 1HG ARG 109 -7.547 -13.911 8.480 817 HD2 ARG 109 2HD ARG 109 -7.628 -12.079 9.944 818 HD3 ARG 109 1HD ARG 109 -6.565 -11.108 8.926 819 HE ARG 109 HE ARG 109 -8.500 -11.176 7.283 820 HH11 ARG 109 1HH1 ARG 109 -8.968 -11.342 10.755 821 HH12 ARG 109 2HH1 ARG 109 -10.512 -10.559 10.708 822 HH21 ARG 109 1HH2 ARG 109 -10.533 -10.152 7.211 823 HH22 ARG 109 2HH2 ARG 109 -11.409 -9.898 8.698 824 H PHE 110 HN PHE 110 -4.131 -13.131 6.142 825 HA PHE 110 HA PHE 110 -6.239 -13.395 4.303 826 HB2 PHE 110 2HB PHE 110 -3.444 -12.300 4.029 827 HB3 PHE 110 1HB PHE 110 -4.600 -12.270 2.705 828 HD1 PHE 110 1HD PHE 110 -6.483 -11.912 5.592 829 HD2 PHE 110 2HD PHE 110 -3.759 -9.753 3.137 830 HE1 PHE 110 1HE PHE 110 -7.403 -9.795 6.436 831 HE2 PHE 110 2HE PHE 110 -4.679 -7.632 3.977 832 HZ PHE 110 HZ PHE 110 -6.502 -7.652 5.631 833 H ARG 111 HN ARG 111 -2.953 -14.745 4.227 834 HA ARG 111 HA ARG 111 -3.312 -15.990 1.687 835 HB2 ARG 111 2HB ARG 111 -1.204 -16.404 3.810 836 HB3 ARG 111 1HB ARG 111 -1.133 -17.066 2.182 837 HG2 ARG 111 2HG ARG 111 -1.385 -14.125 2.705 838 HG3 ARG 111 1HG ARG 111 0.173 -14.942 2.608 839 HD2 ARG 111 2HD ARG 111 -0.205 -15.586 0.353 840 HD3 ARG 111 1HD ARG 111 -1.902 -15.122 0.438 841 HE ARG 111 HE ARG 111 -1.219 -13.102 -0.325 842 HH11 ARG 111 1HH1 ARG 111 1.356 -14.331 1.713 843 HH12 ARG 111 2HH1 ARG 111 2.364 -12.934 1.504 844 HH21 ARG 111 1HH2 ARG 111 0.105 -11.276 -0.608 845 HH22 ARG 111 2HH2 ARG 111 1.645 -11.194 0.188 846 H ASN 112 HN ASN 112 -4.187 -16.869 4.845 847 HA ASN 112 HA ASN 112 -3.921 -19.658 4.803 848 HB2 ASN 112 2HB ASN 112 -4.668 -17.959 6.696 849 HB3 ASN 112 1HB ASN 112 -6.280 -18.404 6.146 850 HD21 ASN 112 1HD2 ASN 112 -3.403 -19.431 7.731 851 HD22 ASN 112 2HD2 ASN 112 -4.006 -20.937 8.323 852 H SER 113 HN SER 113 -6.853 -17.734 4.224 853 HA SER 113 HA SER 113 -8.046 -20.028 2.864 854 HB2 SER 113 2HB SER 113 -9.323 -18.919 4.677 855 HB3 SER 113 1HB SER 113 -9.322 -17.424 3.741 856 HG SER 113 HG SER 113 -10.359 -19.874 2.745 857 H GLY 114 HN GLY 114 -6.797 -16.833 2.252 858 HA2 GLY 114 2HA GLY 114 -6.167 -16.179 0.031 859 HA3 GLY 114 1HA GLY 114 -7.496 -17.151 -0.591 860 H LYS 115 HN LYS 115 -8.063 -15.191 2.180 861 HA LYS 115 HA LYS 115 -9.711 -13.388 0.560 862 HB2 LYS 115 2HB LYS 115 -10.786 -14.870 2.325 863 HB3 LYS 115 1HB LYS 115 -9.928 -13.930 3.529 864 HG2 LYS 115 2HG LYS 115 -11.121 -11.924 2.812 865 HG3 LYS 115 1HG LYS 115 -11.961 -12.865 1.579 866 HD2 LYS 115 2HD LYS 115 -13.425 -12.612 3.458 867 HD3 LYS 115 1HD LYS 115 -12.881 -14.290 3.408 868 HE2 LYS 115 2HE LYS 115 -11.224 -13.827 5.127 869 HE3 LYS 115 1HE LYS 115 -11.709 -12.132 5.162 870 HZ1 LYS 115 3HZ LYS 115 -12.759 -13.241 6.967 871 HZ2 LYS 115 1HZ LYS 115 -13.338 -14.481 5.966 872 HZ3 LYS 115 2HZ LYS 115 -13.963 -12.914 5.819 873 H GLY 116 HN GLY 116 -9.942 -11.196 1.714 874 HA2 GLY 116 2HA GLY 116 -9.016 -9.413 2.936 875 HA3 GLY 116 1HA GLY 116 -7.573 -10.381 3.201 876 H PHE 117 HN PHE 117 -7.897 -7.619 2.269 877 HA PHE 117 HA PHE 117 -6.527 -7.853 -0.327 878 HB2 PHE 117 2HB PHE 117 -8.422 -5.705 0.649 879 HB3 PHE 117 1HB PHE 117 -7.431 -5.550 -0.794 880 HD1 PHE 117 1HD PHE 117 -10.041 -7.733 0.728 881 HD2 PHE 117 2HD PHE 117 -8.254 -6.241 -2.835 882 HE1 PHE 117 1HE PHE 117 -11.815 -8.796 -0.599 883 HE2 PHE 117 2HE PHE 117 -10.029 -7.305 -4.173 884 HZ PHE 117 HZ PHE 117 -11.811 -8.584 -3.052 885 H LEU 118 HN LEU 118 -4.644 -6.734 -0.561 886 HA LEU 118 HA LEU 118 -3.771 -5.010 1.644 887 HB2 LEU 118 2HB LEU 118 -2.959 -7.367 2.002 888 HB3 LEU 118 1HB LEU 118 -2.070 -7.206 0.503 889 HG LEU 118 HG LEU 118 -0.781 -5.336 1.491 890 HD11 LEU 118 1HD1 LEU 118 -2.173 -6.135 4.042 891 HD12 LEU 118 2HD1 LEU 118 -2.431 -4.630 3.159 892 HD13 LEU 118 3HD1 LEU 118 -0.862 -4.965 3.891 893 HD21 LEU 118 3HD2 LEU 118 -0.707 -7.952 2.986 894 HD22 LEU 118 1HD2 LEU 118 0.581 -6.746 2.974 895 HD23 LEU 118 2HD2 LEU 118 0.137 -7.575 1.483 896 H LEU 119 HN LEU 119 -2.479 -3.394 1.052 897 HA LEU 119 HA LEU 119 -1.296 -3.322 -1.609 898 HB2 LEU 119 2HB LEU 119 -3.510 -2.293 -1.874 899 HB3 LEU 119 1HB LEU 119 -3.161 -1.186 -0.561 900 HG LEU 119 HG LEU 119 -1.404 -0.126 -1.891 901 HD11 LEU 119 1HD1 LEU 119 -0.719 -2.100 -3.181 902 HD12 LEU 119 2HD1 LEU 119 -1.061 -0.717 -4.220 903 HD13 LEU 119 3HD1 LEU 119 -2.233 -2.025 -4.081 904 HD21 LEU 119 3HD2 LEU 119 -3.689 0.723 -2.052 905 HD22 LEU 119 1HD2 LEU 119 -4.009 -0.382 -3.388 906 HD23 LEU 119 2HD2 LEU 119 -2.827 0.912 -3.579 907 H LEU 120 HN LEU 120 0.764 -2.860 -1.276 908 HA LEU 120 HA LEU 120 1.455 -1.024 0.926 909 HB2 LEU 120 2HB LEU 120 3.057 -3.392 -0.037 910 HB3 LEU 120 1HB LEU 120 3.512 -2.302 1.255 911 HG LEU 120 HG LEU 120 1.137 -4.168 1.299 912 HD11 LEU 120 1HD1 LEU 120 2.416 -5.429 2.943 913 HD12 LEU 120 2HD1 LEU 120 3.779 -4.329 2.742 914 HD13 LEU 120 3HD1 LEU 120 3.268 -5.354 1.402 915 HD21 LEU 120 3HD2 LEU 120 0.949 -3.543 3.645 916 HD22 LEU 120 1HD2 LEU 120 0.775 -2.130 2.605 917 HD23 LEU 120 2HD2 LEU 120 2.288 -2.410 3.465 918 H GLY 121 HN GLY 121 3.139 0.440 0.562 919 HA2 GLY 121 2HA GLY 121 4.152 0.542 -2.201 920 HA3 GLY 121 1HA GLY 121 3.390 1.955 -1.494 921 H SER 122 HN SER 122 5.864 2.181 -2.490 922 HA SER 122 HA SER 122 7.781 3.278 -1.989 923 HB2 SER 122 2HB SER 122 6.932 2.947 0.893 924 HB3 SER 122 1HB SER 122 8.319 3.893 0.356 925 HG SER 122 HG SER 122 5.562 4.393 0.037 926 H GLU 123 HN GLU 123 9.896 2.940 -0.618 927 HA GLU 123 HA GLU 123 11.725 1.680 -0.237 928 HB2 GLU 123 2HB GLU 123 9.550 0.010 0.808 929 HB3 GLU 123 1HB GLU 123 11.019 -0.868 0.397 930 HG2 GLU 123 2HG GLU 123 10.800 1.483 2.259 931 HG3 GLU 123 1HG GLU 123 11.050 -0.201 2.717 932 H TYR 124 HN TYR 124 12.289 -0.992 -0.699 933 HA TYR 124 HA TYR 124 12.120 -1.113 -3.633 934 HB2 TYR 124 2HB TYR 124 14.195 -2.175 -1.709 935 HB3 TYR 124 1HB TYR 124 14.153 -2.611 -3.414 936 HD1 TYR 124 2HD TYR 124 14.683 -0.952 -5.130 937 HD2 TYR 124 1HD TYR 124 14.935 0.002 -0.995 938 HE1 TYR 124 2HE TYR 124 16.003 1.043 -5.681 939 HE2 TYR 124 1HE TYR 124 16.258 2.006 -1.532 940 HH TYR 124 HH TYR 124 17.720 2.816 -3.386 941 H THR 125 HN THR 125 12.970 -3.765 -3.925 942 HA THR 125 HA THR 125 10.490 -5.096 -3.680 943 HB THR 125 HB THR 125 11.773 -7.089 -4.499 944 HG1 THR 125 1HG THR 125 14.003 -6.317 -5.264 945 HG21 THR 125 3HG2 THR 125 10.755 -5.526 -6.075 946 HG22 THR 125 1HG2 THR 125 12.287 -6.136 -6.701 947 HG23 THR 125 2HG2 THR 125 12.198 -4.513 -6.017 948 HA PRO 126 HA PRO 126 10.611 -7.052 0.280 949 HB2 PRO 126 2HB PRO 126 9.843 -9.572 -1.088 950 HB3 PRO 126 1HB PRO 126 9.031 -8.707 0.218 951 HG2 PRO 126 2HG PRO 126 8.048 -8.657 -2.256 952 HG3 PRO 126 1HG PRO 126 7.999 -7.215 -1.226 953 HD2 PRO 126 2HD PRO 126 9.844 -7.864 -3.489 954 HD3 PRO 126 1HD PRO 126 9.097 -6.314 -3.051 955 H GLN 127 HN GLN 127 12.292 -8.407 -2.403 956 HA GLN 127 HA GLN 127 13.664 -10.491 -1.072 957 HB2 GLN 127 2HB GLN 127 14.002 -9.073 -3.669 958 HB3 GLN 127 1HB GLN 127 15.266 -10.149 -3.095 959 HG2 GLN 127 2HG GLN 127 13.675 -11.228 -4.620 960 HG3 GLN 127 1HG GLN 127 13.767 -12.007 -3.055 961 HE21 GLN 127 1HE2 GLN 127 12.001 -12.060 -1.756 962 HE22 GLN 127 2HE2 GLN 127 10.432 -11.531 -2.264 963 H GLN 128 HN GLN 128 14.160 -7.071 -1.287 964 HA GLN 128 HA GLN 128 16.861 -7.375 -0.151 965 HB2 GLN 128 2HB GLN 128 15.680 -5.063 -1.696 966 HB3 GLN 128 1HB GLN 128 17.287 -5.081 -0.983 967 HG2 GLN 128 2HG GLN 128 17.798 -7.076 -2.413 968 HG3 GLN 128 1HG GLN 128 16.258 -6.800 -3.224 969 HE21 GLN 128 1HE2 GLN 128 19.437 -5.557 -2.623 970 HE22 GLN 128 2HE2 GLN 128 19.474 -4.433 -3.939 971 H LEU 129 HN LEU 129 13.810 -6.821 0.839 972 HA LEU 129 HA LEU 129 14.181 -4.536 2.511 973 HB2 LEU 129 2HB LEU 129 12.095 -6.698 2.426 974 HB3 LEU 129 1HB LEU 129 12.078 -5.443 3.643 975 HG LEU 129 HG LEU 129 11.900 -4.965 0.666 976 HD11 LEU 129 1HD1 LEU 129 9.578 -4.383 1.100 977 HD12 LEU 129 2HD1 LEU 129 9.781 -4.781 2.806 978 HD13 LEU 129 3HD1 LEU 129 9.894 -6.049 1.587 979 HD21 LEU 129 3HD2 LEU 129 12.979 -3.140 1.916 980 HD22 LEU 129 1HD2 LEU 129 11.583 -3.064 2.990 981 HD23 LEU 129 2HD2 LEU 129 11.404 -2.665 1.281 982 H VAL 130 HN VAL 130 14.940 -4.391 4.529 983 HA VAL 130 HA VAL 130 15.918 -6.820 5.813 984 HB VAL 130 HB VAL 130 16.354 -3.944 6.630 985 HG11 VAL 130 1HG1 VAL 130 17.725 -6.485 7.516 986 HG12 VAL 130 2HG1 VAL 130 16.608 -5.518 8.479 987 HG13 VAL 130 3HG1 VAL 130 18.172 -4.853 8.007 988 HG21 VAL 130 3HG2 VAL 130 17.342 -4.366 4.440 989 HG22 VAL 130 1HG2 VAL 130 18.148 -5.807 5.063 990 HG23 VAL 130 2HG2 VAL 130 18.606 -4.213 5.661 991 H ILE 131 HN ILE 131 14.107 -7.745 6.614 992 HA ILE 131 HA ILE 131 12.863 -6.464 8.929 993 HB ILE 131 HB ILE 131 10.614 -7.304 8.185 994 HG12 ILE 131 2HG1 ILE 131 11.988 -7.534 5.496 995 HG13 ILE 131 1HG1 ILE 131 11.411 -8.882 6.472 996 HG21 ILE 131 1HG2 ILE 131 11.851 -5.167 6.450 997 HG22 ILE 131 2HG2 ILE 131 11.179 -4.932 8.063 998 HG23 ILE 131 3HG2 ILE 131 10.126 -5.403 6.730 999 HD11 ILE 131 3HD1 ILE 131 9.890 -8.366 4.647 1000 HD12 ILE 131 1HD1 ILE 131 9.693 -6.724 5.260 1001 HD13 ILE 131 2HD1 ILE 131 9.124 -8.097 6.211 1002 H ARG 132 HN ARG 132 11.175 -8.317 9.793 1003 HA ARG 132 HA ARG 132 12.581 -10.592 10.552 1004 HB2 ARG 132 2HB ARG 132 10.509 -9.983 11.638 1005 HB3 ARG 132 1HB ARG 132 9.610 -10.228 10.154 1006 HG2 ARG 132 2HG ARG 132 9.170 -12.111 11.466 1007 HG3 ARG 132 1HG ARG 132 10.362 -12.645 10.279 1008 HD2 ARG 132 2HD ARG 132 11.321 -13.512 12.144 1009 HD3 ARG 132 1HD ARG 132 12.034 -11.901 12.202 1010 HE ARG 132 HE ARG 132 10.428 -11.310 13.890 1011 HH11 ARG 132 1HH1 ARG 132 10.597 -14.714 13.065 1012 HH12 ARG 132 2HH1 ARG 132 9.880 -15.247 14.564 1013 HH21 ARG 132 1HH2 ARG 132 9.486 -11.996 15.862 1014 HH22 ARG 132 2HH2 ARG 132 9.259 -13.693 16.166 1015 H GLU 133 HN GLU 133 13.253 -12.311 9.467 1016 HA GLU 133 HA GLU 133 12.831 -12.468 6.664 1017 HB2 GLU 133 2HB GLU 133 14.142 -14.450 8.527 1018 HB3 GLU 133 1HB GLU 133 14.219 -14.508 6.769 1019 HG2 GLU 133 2HG GLU 133 15.227 -12.198 6.861 1020 HG3 GLU 133 1HG GLU 133 15.379 -12.432 8.600 1021 H ASP 134 HN ASP 134 11.217 -13.841 9.363 1022 HA ASP 134 HA ASP 134 9.930 -15.992 8.002 1023 HB2 ASP 134 2HB ASP 134 8.937 -14.408 10.393 1024 HB3 ASP 134 1HB ASP 134 8.334 -15.976 9.868 1025 H LEU 135 HN LEU 135 9.319 -12.589 8.427 1026 HA LEU 135 HA LEU 135 6.738 -12.650 7.137 1027 HB2 LEU 135 2HB LEU 135 7.507 -11.065 9.000 1028 HB3 LEU 135 1HB LEU 135 8.418 -10.227 7.764 1029 HG LEU 135 HG LEU 135 5.439 -10.606 7.533 1030 HD11 LEU 135 1HD1 LEU 135 5.878 -9.502 9.663 1031 HD12 LEU 135 2HD1 LEU 135 5.179 -8.377 8.498 1032 HD13 LEU 135 3HD1 LEU 135 6.906 -8.323 8.850 1033 HD21 LEU 135 3HD2 LEU 135 7.354 -8.584 6.371 1034 HD22 LEU 135 1HD2 LEU 135 5.609 -8.612 6.121 1035 HD23 LEU 135 2HD2 LEU 135 6.611 -9.928 5.506 1036 H ARG 136 HN ARG 136 10.066 -11.888 6.335 1037 HA ARG 136 HA ARG 136 9.755 -10.469 3.969 1038 HB2 ARG 136 2HB ARG 136 11.899 -11.118 5.326 1039 HB3 ARG 136 1HB ARG 136 11.942 -12.502 4.243 1040 HG2 ARG 136 2HG ARG 136 11.769 -10.752 2.357 1041 HG3 ARG 136 1HG ARG 136 12.255 -9.596 3.597 1042 HD2 ARG 136 2HD ARG 136 14.291 -10.195 2.697 1043 HD3 ARG 136 1HD ARG 136 14.162 -11.316 4.052 1044 HE ARG 136 HE ARG 136 13.116 -12.341 1.574 1045 HH11 ARG 136 1HH1 ARG 136 15.987 -12.033 3.564 1046 HH12 ARG 136 2HH1 ARG 136 16.801 -13.364 2.802 1047 HH21 ARG 136 1HH2 ARG 136 14.215 -14.043 0.541 1048 HH22 ARG 136 2HH2 ARG 136 15.825 -14.462 1.049 1049 H THR 137 HN THR 137 9.717 -13.956 4.510 1050 HA THR 137 HA THR 137 9.667 -14.662 1.758 1051 HB THR 137 HB THR 137 8.722 -16.872 2.754 1052 HG1 THR 137 1HG THR 137 9.863 -16.177 5.163 1053 HG21 THR 137 3HG2 THR 137 11.445 -15.863 3.587 1054 HG22 THR 137 1HG2 THR 137 11.046 -16.545 2.009 1055 HG23 THR 137 2HG2 THR 137 10.955 -17.554 3.454 1056 H ARG 138 HN ARG 138 7.207 -13.979 4.165 1057 HA ARG 138 HA ARG 138 4.976 -14.869 2.649 1058 HB2 ARG 138 2HB ARG 138 5.053 -12.766 4.822 1059 HB3 ARG 138 1HB ARG 138 3.641 -13.667 4.286 1060 HG2 ARG 138 2HG ARG 138 6.066 -14.960 5.501 1061 HG3 ARG 138 1HG ARG 138 4.669 -14.436 6.436 1062 HD2 ARG 138 2HD ARG 138 3.239 -15.969 5.314 1063 HD3 ARG 138 1HD ARG 138 4.473 -16.326 4.106 1064 HE ARG 138 HE ARG 138 5.747 -17.442 5.871 1065 HH11 ARG 138 1HH1 ARG 138 2.353 -16.817 6.523 1066 HH12 ARG 138 2HH1 ARG 138 2.209 -18.120 7.662 1067 HH21 ARG 138 1HH2 ARG 138 5.530 -19.168 7.353 1068 HH22 ARG 138 2HH2 ARG 138 3.996 -19.447 8.122 1069 H MET 139 HN MET 139 6.984 -12.133 2.479 1070 HA MET 139 HA MET 139 5.126 -10.328 1.252 1071 HB2 MET 139 2HB MET 139 8.127 -10.336 1.521 1072 HB3 MET 139 1HB MET 139 7.244 -9.047 0.720 1073 HG2 MET 139 2HG MET 139 6.768 -9.880 3.563 1074 HG3 MET 139 1HG MET 139 7.872 -8.595 3.081 1075 HE1 MET 139 3HE MET 139 5.444 -6.005 1.438 1076 HE2 MET 139 1HE MET 139 6.370 -7.280 0.645 1077 HE3 MET 139 2HE MET 139 7.105 -6.329 1.935 1078 H ALA 140 HN ALA 140 6.992 -12.971 0.167 1079 HA ALA 140 HA ALA 140 7.341 -11.966 -2.531 1080 HB1 ALA 140 1HB ALA 140 9.089 -13.323 -1.479 1081 HB2 ALA 140 2HB ALA 140 8.490 -14.064 -2.963 1082 HB3 ALA 140 3HB ALA 140 7.974 -14.689 -1.397 1083 H TYR 141 HN TYR 141 4.724 -13.146 -0.985 1084 HA TYR 141 HA TYR 141 3.841 -14.974 -3.074 1085 HB2 TYR 141 2HB TYR 141 2.658 -14.169 -0.422 1086 HB3 TYR 141 1HB TYR 141 1.810 -15.187 -1.572 1087 HD1 TYR 141 2HD TYR 141 2.590 -17.475 -2.017 1088 HD2 TYR 141 1HD TYR 141 4.487 -15.024 0.898 1089 HE1 TYR 141 2HE TYR 141 3.657 -19.466 -1.045 1090 HE2 TYR 141 1HE TYR 141 5.555 -17.010 1.881 1091 HH TYR 141 HH TYR 141 5.665 -20.005 0.326 1092 H CYS 142 HN CYS 142 3.775 -11.671 -2.769 1093 HA CYS 142 HA CYS 142 1.038 -11.460 -3.800 1094 HB2 CYS 142 2HB CYS 142 1.161 -9.067 -3.165 1095 HB3 CYS 142 1HB CYS 142 1.367 -10.146 -1.791 1096 HG CYS 142 HG CYS 142 3.869 -8.435 -3.381 1097 H LEU 143 HN LEU 143 0.827 -9.432 -5.240 1098 HA LEU 143 HA LEU 143 2.574 -9.918 -7.506 1099 HB2 LEU 143 2HB LEU 143 0.099 -8.223 -7.196 1100 HB3 LEU 143 1HB LEU 143 1.008 -8.342 -8.684 1101 HG LEU 143 HG LEU 143 0.539 -10.849 -8.546 1102 HD11 LEU 143 1HD1 LEU 143 -1.465 -11.503 -7.329 1103 HD12 LEU 143 2HD1 LEU 143 -1.566 -9.889 -6.626 1104 HD13 LEU 143 3HD1 LEU 143 -0.203 -10.940 -6.234 1105 HD21 LEU 143 3HD2 LEU 143 -1.749 -8.949 -9.001 1106 HD22 LEU 143 1HD2 LEU 143 -1.629 -10.595 -9.623 1107 HD23 LEU 143 2HD2 LEU 143 -0.498 -9.359 -10.174 1108 H VAL 144 HN VAL 144 3.613 -8.205 -8.660 1109 HA VAL 144 HA VAL 144 4.219 -5.844 -7.016 1110 HB VAL 144 HB VAL 144 6.261 -7.445 -8.580 1111 HG11 VAL 144 1HG1 VAL 144 7.897 -5.929 -7.539 1112 HG12 VAL 144 2HG1 VAL 144 6.571 -5.011 -6.824 1113 HG13 VAL 144 3HG1 VAL 144 6.760 -5.070 -8.576 1114 HG21 VAL 144 3HG2 VAL 144 5.868 -7.171 -5.601 1115 HG22 VAL 144 1HG2 VAL 144 7.235 -7.967 -6.383 1116 HG23 VAL 144 2HG2 VAL 144 5.610 -8.627 -6.563 1117 H TYR 145 HN TYR 145 3.673 -4.093 -8.087 1118 HA TYR 145 HA TYR 145 3.767 -4.109 -11.025 1119 HB2 TYR 145 2HB TYR 145 2.248 -2.419 -9.046 1120 HB3 TYR 145 1HB TYR 145 2.471 -1.894 -10.709 1121 HD1 TYR 145 2HD TYR 145 1.317 -4.928 -8.839 1122 HD2 TYR 145 1HD TYR 145 0.809 -2.381 -12.205 1123 HE1 TYR 145 2HE TYR 145 -0.669 -6.214 -9.507 1124 HE2 TYR 145 1HE TYR 145 -1.177 -3.660 -12.880 1125 HH TYR 145 HH TYR 145 -2.119 -5.940 -12.534 1126 H GLU 146 HN GLU 146 5.459 -3.176 -11.938 1127 HA GLU 146 HA GLU 146 7.289 -1.581 -10.414 1128 HB2 GLU 146 2HB GLU 146 8.006 -3.164 -12.207 1129 HB3 GLU 146 1HB GLU 146 7.244 -2.111 -13.392 1130 HG2 GLU 146 2HG GLU 146 8.777 -0.322 -12.829 1131 HG3 GLU 146 1HG GLU 146 9.511 -1.321 -11.573 1132 H VAL 147 HN VAL 147 6.949 0.491 -9.991 1133 HA VAL 147 HA VAL 147 5.031 2.022 -11.457 1134 HB VAL 147 HB VAL 147 5.367 2.345 -9.030 1135 HG11 VAL 147 1HG1 VAL 147 7.287 3.642 -8.216 1136 HG12 VAL 147 2HG1 VAL 147 8.012 3.556 -9.821 1137 HG13 VAL 147 3HG1 VAL 147 7.769 2.082 -8.881 1138 HG21 VAL 147 3HG2 VAL 147 5.895 4.802 -10.698 1139 HG22 VAL 147 1HG2 VAL 147 5.284 4.794 -9.042 1140 HG23 VAL 147 2HG2 VAL 147 4.318 4.098 -10.342 1141 H LYS 148 HN LYS 148 5.330 3.389 -13.067 1142 HA LYS 148 HA LYS 148 6.273 4.469 -14.807 1143 HB2 LYS 148 2HB LYS 148 7.211 5.885 -13.002 1144 HB3 LYS 148 1HB LYS 148 8.635 4.855 -12.953 1145 HG2 LYS 148 2HG LYS 148 9.018 6.913 -14.221 1146 HG3 LYS 148 1HG LYS 148 9.197 5.471 -15.224 1147 HD2 LYS 148 2HD LYS 148 6.857 5.804 -16.006 1148 HD3 LYS 148 1HD LYS 148 6.823 7.325 -15.114 1149 HE2 LYS 148 2HE LYS 148 8.610 8.209 -16.459 1150 HE3 LYS 148 1HE LYS 148 8.805 6.660 -17.279 1151 HZ1 LYS 148 3HZ LYS 148 6.447 8.457 -17.427 1152 HZ2 LYS 148 1HZ LYS 148 6.515 6.907 -18.113 1153 HZ3 LYS 148 2HZ LYS 148 7.556 8.124 -18.667 1154 HA PRO 149 HA PRO 149 8.644 0.792 -16.097 1155 HB2 PRO 149 2HB PRO 149 6.926 0.680 -18.410 1156 HB3 PRO 149 1HB PRO 149 7.021 -0.453 -17.060 1157 HG2 PRO 149 2HG PRO 149 4.858 1.160 -17.567 1158 HG3 PRO 149 1HG PRO 149 5.266 0.516 -15.967 1159 HD2 PRO 149 2HD PRO 149 5.785 3.235 -17.106 1160 HD3 PRO 149 1HD PRO 149 5.278 2.775 -15.465 Start of MODEL 9 1 H1 MET 1 H1 MET 1 13.861 -17.070 17.116 2 H2 MET 1 H2 MET 1 13.688 -16.584 18.730 3 H3 MET 1 H3 MET 1 14.802 -17.795 18.331 4 HA MET 1 HA MET 1 15.886 -15.678 18.770 5 HB2 MET 1 2HB MET 1 15.974 -16.612 15.892 6 HB3 MET 1 1HB MET 1 17.151 -15.529 16.618 7 HG2 MET 1 2HG MET 1 17.748 -17.289 18.225 8 HG3 MET 1 1HG MET 1 16.605 -18.371 17.431 9 HE1 MET 1 2HE MET 1 20.449 -16.723 15.478 10 HE2 MET 1 3HE MET 1 19.978 -16.423 17.153 11 HE3 MET 1 1HE MET 1 19.051 -15.709 15.835 12 H GLY 2 HN GLY 2 15.615 -13.560 18.838 13 HA2 GLY 2 2HA GLY 2 14.644 -12.105 16.539 14 HA3 GLY 2 1HA GLY 2 13.532 -12.106 17.904 15 H HIS 3 HN HIS 3 17.075 -11.855 17.633 16 HA HIS 3 HA HIS 3 17.027 -9.819 19.694 17 HB2 HIS 3 2HB HIS 3 19.463 -9.957 19.693 18 HB3 HIS 3 1HB HIS 3 18.758 -11.560 19.815 19 HD1 HIS 3 1HD HIS 3 21.290 -9.709 18.033 20 HD2 HIS 3 2HD HIS 3 18.820 -12.951 17.174 21 HE1 HIS 3 1HE HIS 3 22.350 -10.877 16.076 22 HE2 HIS 3 2HE HIS 3 20.913 -12.901 15.649 23 H HIS 4 HN HIS 4 16.533 -7.861 19.140 24 HA HIS 4 HA HIS 4 17.977 -6.570 16.946 25 HB2 HIS 4 2HB HIS 4 14.971 -6.527 17.327 26 HB3 HIS 4 1HB HIS 4 15.836 -5.397 16.295 27 HD1 HIS 4 1HD HIS 4 14.250 -8.680 16.271 28 HD2 HIS 4 2HD HIS 4 17.174 -6.713 14.065 29 HE1 HIS 4 1HE HIS 4 14.461 -9.967 14.126 30 HE2 HIS 4 2HE HIS 4 16.071 -8.629 12.725 31 H HIS 5 HN HIS 5 17.385 -4.069 17.098 32 HA HIS 5 HA HIS 5 16.823 -3.373 19.886 33 HB2 HIS 5 2HB HIS 5 18.549 -1.695 19.996 34 HB3 HIS 5 1HB HIS 5 19.281 -3.230 19.561 35 HD1 HIS 5 1HD HIS 5 19.404 0.219 18.744 36 HD2 HIS 5 2HD HIS 5 19.697 -3.307 16.554 37 HE1 HIS 5 1HE HIS 5 20.538 0.848 16.587 38 HE2 HIS 5 2HE HIS 5 20.840 -1.321 15.345 39 H HIS 6 HN HIS 6 14.796 -2.807 19.455 40 HA HIS 6 HA HIS 6 14.385 -0.239 18.208 41 HB2 HIS 6 2HB HIS 6 13.487 -2.765 16.921 42 HB3 HIS 6 1HB HIS 6 12.311 -1.457 16.987 43 HD1 HIS 6 1HD HIS 6 14.765 -2.769 14.793 44 HD2 HIS 6 2HD HIS 6 13.654 1.077 15.947 45 HE1 HIS 6 1HE HIS 6 15.630 -1.234 12.993 46 HE2 HIS 6 2HE HIS 6 15.015 1.091 13.743 47 H HIS 7 HN HIS 7 12.681 0.819 19.081 48 HA HIS 7 HA HIS 7 11.139 -0.655 21.120 49 HB2 HIS 7 2HB HIS 7 11.802 2.304 21.004 50 HB3 HIS 7 1HB HIS 7 10.857 1.519 22.262 51 HD1 HIS 7 1HD HIS 7 12.129 0.434 24.168 52 HD2 HIS 7 2HD HIS 7 14.593 1.663 21.043 53 HE1 HIS 7 1HE HIS 7 14.488 0.183 25.013 54 HE2 HIS 7 2HE HIS 7 15.946 1.108 23.180 55 H HIS 8 HN HIS 8 8.878 -0.080 21.335 56 HA HIS 8 HA HIS 8 7.723 0.552 18.740 57 HB2 HIS 8 2HB HIS 8 6.937 -1.382 20.175 58 HB3 HIS 8 1HB HIS 8 6.270 -0.194 21.285 59 HD1 HIS 8 1HD HIS 8 3.882 -1.144 20.835 60 HD2 HIS 8 2HD HIS 8 5.769 0.466 17.493 61 HE1 HIS 8 1HE HIS 8 2.085 -0.902 19.087 62 HE2 HIS 8 2HE HIS 8 3.291 -0.115 17.025 63 H SER 9 HN SER 9 8.728 2.774 19.141 64 HA SER 9 HA SER 9 7.280 4.463 20.994 65 HB2 SER 9 2HB SER 9 9.484 5.142 19.036 66 HB3 SER 9 1HB SER 9 8.863 6.203 20.304 67 HG SER 9 HG SER 9 9.450 4.067 21.590 68 H HIS 10 HN HIS 10 5.343 3.757 19.597 69 HA HIS 10 HA HIS 10 4.617 6.122 18.062 70 HB2 HIS 10 2HB HIS 10 4.662 3.337 16.967 71 HB3 HIS 10 1HB HIS 10 3.311 4.370 16.523 72 HD1 HIS 10 1HD HIS 10 7.019 3.977 16.042 73 HD2 HIS 10 2HD HIS 10 3.904 6.387 14.707 74 HE1 HIS 10 1HE HIS 10 7.967 5.325 14.143 75 HE2 HIS 10 2HE HIS 10 6.136 6.937 13.518 76 H MET 11 HN MET 11 3.362 6.693 19.857 77 HA MET 11 HA MET 11 1.035 4.972 20.341 78 HB2 MET 11 2HB MET 11 2.724 4.349 22.012 79 HB3 MET 11 1HB MET 11 2.841 6.028 22.526 80 HG2 MET 11 2HG MET 11 0.508 5.967 23.244 81 HG3 MET 11 1HG MET 11 0.399 4.282 22.737 82 HE1 MET 11 3HE MET 11 0.339 3.980 26.630 83 HE2 MET 11 1HE MET 11 -0.478 3.577 25.120 84 HE3 MET 11 2HE MET 11 -0.397 5.255 25.658 85 H ASP 12 HN ASP 12 2.495 7.981 21.629 86 HA ASP 12 HA ASP 12 -0.162 9.030 22.063 87 HB2 ASP 12 2HB ASP 12 2.581 9.988 22.794 88 HB3 ASP 12 1HB ASP 12 1.193 11.065 22.919 89 H TYR 13 HN TYR 13 -1.022 9.410 20.107 90 HA TYR 13 HA TYR 13 -0.009 11.841 18.804 91 HB2 TYR 13 2HB TYR 13 -1.291 9.470 17.415 92 HB3 TYR 13 1HB TYR 13 -0.862 10.993 16.641 93 HD1 TYR 13 1HD TYR 13 1.580 11.657 16.563 94 HD2 TYR 13 2HD TYR 13 0.294 7.751 17.651 95 HE1 TYR 13 1HE TYR 13 3.837 10.793 16.117 96 HE2 TYR 13 2HE TYR 13 2.547 6.880 17.207 97 HH TYR 13 HH TYR 13 5.239 8.864 16.847 98 HA PRO 14 HA PRO 14 -3.916 13.528 19.997 99 HB2 PRO 14 2HB PRO 14 -3.681 15.024 17.432 100 HB3 PRO 14 1HB PRO 14 -3.966 15.630 19.069 101 HG2 PRO 14 2HG PRO 14 -1.579 15.895 17.917 102 HG3 PRO 14 1HG PRO 14 -1.722 15.512 19.642 103 HD2 PRO 14 2HD PRO 14 -1.007 13.728 17.358 104 HD3 PRO 14 1HD PRO 14 -0.392 13.732 19.023 105 H SER 15 HN SER 15 -5.387 11.916 19.776 106 HA SER 15 HA SER 15 -6.317 11.238 17.079 107 HB2 SER 15 2HB SER 15 -6.778 9.756 19.681 108 HB3 SER 15 1HB SER 15 -7.201 9.190 18.064 109 HG SER 15 HG SER 15 -4.545 9.923 18.587 110 H PHE 16 HN PHE 16 -7.726 12.866 16.658 111 HA PHE 16 HA PHE 16 -10.236 12.718 18.138 112 HB2 PHE 16 2HB PHE 16 -10.509 15.180 18.019 113 HB3 PHE 16 1HB PHE 16 -9.163 14.700 19.041 114 HD1 PHE 16 2HD PHE 16 -6.820 14.933 18.147 115 HD2 PHE 16 1HD PHE 16 -10.210 16.600 16.180 116 HE1 PHE 16 2HE PHE 16 -5.343 16.450 16.892 117 HE2 PHE 16 1HE PHE 16 -8.739 18.119 14.929 118 HZ PHE 16 HZ PHE 16 -6.304 18.046 15.281 119 H ASP 17 HN ASP 17 -11.836 12.284 16.788 120 HA ASP 17 HA ASP 17 -11.339 12.633 13.932 121 HB2 ASP 17 2HB ASP 17 -13.230 11.127 13.574 122 HB3 ASP 17 1HB ASP 17 -12.062 10.414 14.676 123 H LYS 18 HN LYS 18 -13.015 14.141 16.450 124 HA LYS 18 HA LYS 18 -14.369 15.954 16.552 125 HB2 LYS 18 2HB LYS 18 -13.934 16.087 13.555 126 HB3 LYS 18 1HB LYS 18 -14.723 17.337 14.512 127 HG2 LYS 18 2HG LYS 18 -12.723 17.849 15.670 128 HG3 LYS 18 1HG LYS 18 -11.920 16.399 15.066 129 HD2 LYS 18 2HD LYS 18 -11.091 18.335 13.882 130 HD3 LYS 18 1HD LYS 18 -12.033 17.334 12.777 131 HE2 LYS 18 2HE LYS 18 -13.933 18.829 13.009 132 HE3 LYS 18 1HE LYS 18 -13.051 19.799 14.189 133 HZ1 LYS 18 3HZ LYS 18 -12.177 19.405 11.372 134 HZ2 LYS 18 1HZ LYS 18 -11.495 20.454 12.515 135 HZ3 LYS 18 2HZ LYS 18 -13.056 20.748 11.921 136 H PHE 19 HN PHE 19 -15.327 14.472 13.440 137 HA PHE 19 HA PHE 19 -17.356 12.935 14.611 138 HB2 PHE 19 2HB PHE 19 -18.516 15.168 14.679 139 HB3 PHE 19 1HB PHE 19 -18.433 15.205 12.919 140 HD1 PHE 19 2HD PHE 19 -19.667 13.143 15.745 141 HD2 PHE 19 1HD PHE 19 -20.116 14.223 11.655 142 HE1 PHE 19 2HE PHE 19 -21.734 11.821 15.630 143 HE2 PHE 19 1HE PHE 19 -22.186 12.895 11.532 144 HZ PHE 19 HZ PHE 19 -22.995 11.693 13.522 145 H LEU 20 HN LEU 20 -16.350 13.167 10.654 146 HA LEU 20 HA LEU 20 -17.936 15.282 11.840 147 HB2 LEU 20 2HB LEU 20 -16.276 16.900 11.579 148 HB3 LEU 20 1HB LEU 20 -15.459 15.574 12.359 149 HG LEU 20 HG LEU 20 -15.320 15.995 9.380 150 HD11 LEU 20 1HD1 LEU 20 -14.556 18.040 10.426 151 HD12 LEU 20 2HD1 LEU 20 -13.191 17.144 9.762 152 HD13 LEU 20 3HD1 LEU 20 -13.501 17.121 11.499 153 HD21 LEU 20 3HD2 LEU 20 -14.636 13.801 10.220 154 HD22 LEU 20 1HD2 LEU 20 -13.508 14.576 11.333 155 HD23 LEU 20 2HD2 LEU 20 -13.256 14.704 9.591 156 H GLY 21 HN GLY 21 -18.114 13.289 9.610 157 HA2 GLY 21 2HA GLY 21 -17.260 14.304 7.156 158 HA3 GLY 21 1HA GLY 21 -18.496 13.083 7.368 159 H THR 22 HN THR 22 -17.824 16.401 6.746 160 HA THR 22 HA THR 22 -20.453 16.649 5.528 161 HB THR 22 HB THR 22 -19.480 18.810 7.423 162 HG1 THR 22 1HG THR 22 -20.645 16.486 8.020 163 HG21 THR 22 3HG2 THR 22 -22.140 18.390 6.046 164 HG22 THR 22 1HG2 THR 22 -20.930 19.592 5.601 165 HG23 THR 22 2HG2 THR 22 -21.749 19.701 7.159 166 H GLU 23 HN GLU 23 -17.298 16.714 5.215 167 HA GLU 23 HA GLU 23 -17.320 18.850 3.189 168 HB2 GLU 23 2HB GLU 23 -15.954 19.370 5.272 169 HB3 GLU 23 1HB GLU 23 -14.903 18.041 4.810 170 HG2 GLU 23 2HG GLU 23 -14.312 19.168 2.762 171 HG3 GLU 23 1HG GLU 23 -15.453 20.467 3.115 172 H ASN 24 HN ASN 24 -17.544 17.674 1.373 173 HA ASN 24 HA ASN 24 -16.400 15.005 1.249 174 HB2 ASN 24 2HB ASN 24 -18.202 16.490 -0.671 175 HB3 ASN 24 1HB ASN 24 -17.690 14.816 -0.866 176 HD21 ASN 24 1HD2 ASN 24 -18.603 13.227 0.407 177 HD22 ASN 24 2HD2 ASN 24 -19.985 13.515 1.419 178 H ALA 25 HN ALA 25 -15.230 17.987 0.550 179 HA ALA 25 HA ALA 25 -14.246 17.930 -2.026 180 HB1 ALA 25 1HB ALA 25 -14.126 19.876 -0.537 181 HB2 ALA 25 2HB ALA 25 -12.574 19.526 -1.296 182 HB3 ALA 25 3HB ALA 25 -12.851 19.080 0.387 183 H GLU 26 HN GLU 26 -12.669 16.656 0.894 184 HA GLU 26 HA GLU 26 -10.320 15.792 -0.398 185 HB2 GLU 26 2HB GLU 26 -11.601 14.814 2.153 186 HB3 GLU 26 1HB GLU 26 -9.981 14.384 1.625 187 HG2 GLU 26 2HG GLU 26 -9.392 16.797 1.677 188 HG3 GLU 26 1HG GLU 26 -10.981 17.119 2.370 189 H LEU 27 HN LEU 27 -13.413 14.261 0.149 190 HA LEU 27 HA LEU 27 -12.566 11.629 -0.509 191 HB2 LEU 27 2HB LEU 27 -15.227 12.948 -0.110 192 HB3 LEU 27 1HB LEU 27 -15.128 11.320 -0.729 193 HG LEU 27 HG LEU 27 -15.537 11.198 1.620 194 HD11 LEU 27 1HD1 LEU 27 -12.640 10.570 1.078 195 HD12 LEU 27 2HD1 LEU 27 -14.013 9.530 0.699 196 HD13 LEU 27 3HD1 LEU 27 -13.627 9.901 2.380 197 HD21 LEU 27 3HD2 LEU 27 -14.767 13.404 2.275 198 HD22 LEU 27 1HD2 LEU 27 -13.095 12.928 1.974 199 HD23 LEU 27 2HD2 LEU 27 -14.011 12.163 3.274 200 H VAL 28 HN VAL 28 -14.045 14.277 -2.286 201 HA VAL 28 HA VAL 28 -14.561 12.811 -4.668 202 HB VAL 28 HB VAL 28 -14.159 15.793 -4.320 203 HG11 VAL 28 1HG1 VAL 28 -13.920 15.091 -6.648 204 HG12 VAL 28 2HG1 VAL 28 -15.411 16.003 -6.416 205 HG13 VAL 28 3HG1 VAL 28 -15.463 14.247 -6.559 206 HG21 VAL 28 3HG2 VAL 28 -16.608 15.904 -4.271 207 HG22 VAL 28 1HG2 VAL 28 -15.973 14.950 -2.931 208 HG23 VAL 28 2HG2 VAL 28 -16.684 14.143 -4.329 209 H TYR 29 HN TYR 29 -11.808 14.553 -3.398 210 HA TYR 29 HA TYR 29 -10.272 14.557 -5.792 211 HB2 TYR 29 2HB TYR 29 -9.772 16.140 -4.027 212 HB3 TYR 29 1HB TYR 29 -9.449 14.833 -2.895 213 HD1 TYR 29 1HD TYR 29 -8.270 16.038 -6.236 214 HD2 TYR 29 2HD TYR 29 -7.242 14.292 -2.495 215 HE1 TYR 29 1HE TYR 29 -5.897 16.078 -6.874 216 HE2 TYR 29 2HE TYR 29 -4.867 14.324 -3.128 217 HH TYR 29 HH TYR 29 -3.719 16.042 -5.870 218 H VAL 30 HN VAL 30 -10.848 12.203 -3.317 219 HA VAL 30 HA VAL 30 -8.591 10.573 -3.682 220 HB VAL 30 HB VAL 30 -11.405 9.808 -2.874 221 HG11 VAL 30 1HG1 VAL 30 -10.436 7.752 -1.999 222 HG12 VAL 30 2HG1 VAL 30 -8.859 8.216 -2.633 223 HG13 VAL 30 3HG1 VAL 30 -10.189 7.875 -3.741 224 HG21 VAL 30 3HG2 VAL 30 -10.488 9.795 -0.604 225 HG22 VAL 30 1HG2 VAL 30 -10.331 11.383 -1.352 226 HG23 VAL 30 2HG2 VAL 30 -8.927 10.322 -1.231 227 H LEU 31 HN LEU 31 -11.853 10.204 -5.049 228 HA LEU 31 HA LEU 31 -12.650 9.009 -6.801 229 HB2 LEU 31 2HB LEU 31 -11.522 9.667 -8.997 230 HB3 LEU 31 1HB LEU 31 -12.248 10.920 -8.020 231 HG LEU 31 HG LEU 31 -9.778 11.211 -7.130 232 HD11 LEU 31 1HD1 LEU 31 -8.130 10.839 -8.888 233 HD12 LEU 31 2HD1 LEU 31 -9.353 10.029 -9.868 234 HD13 LEU 31 3HD1 LEU 31 -8.839 9.323 -8.334 235 HD21 LEU 31 3HD2 LEU 31 -10.687 12.202 -9.828 236 HD22 LEU 31 1HD2 LEU 31 -9.432 12.927 -8.820 237 HD23 LEU 31 2HD2 LEU 31 -11.108 12.911 -8.271 238 H ARG 32 HN ARG 32 -11.310 8.025 -9.146 239 HA ARG 32 HA ARG 32 -10.216 6.222 -9.977 240 HB2 ARG 32 2HB ARG 32 -8.616 6.639 -7.475 241 HB3 ARG 32 1HB ARG 32 -8.308 5.261 -8.519 242 HG2 ARG 32 2HG ARG 32 -8.212 8.135 -9.396 243 HG3 ARG 32 1HG ARG 32 -6.811 7.160 -8.949 244 HD2 ARG 32 2HD ARG 32 -7.453 5.552 -10.741 245 HD3 ARG 32 1HD ARG 32 -8.714 6.681 -11.234 246 HE ARG 32 HE ARG 32 -6.735 8.302 -11.490 247 HH11 ARG 32 1HH1 ARG 32 -6.602 4.856 -12.067 248 HH12 ARG 32 2HH1 ARG 32 -5.345 4.965 -13.259 249 HH21 ARG 32 1HH2 ARG 32 -5.079 8.462 -13.055 250 HH22 ARG 32 2HH2 ARG 32 -4.471 7.026 -13.826 251 H HIS 33 HN HIS 33 -9.395 3.865 -9.186 252 HA HIS 33 HA HIS 33 -11.343 2.709 -7.337 253 HB2 HIS 33 2HB HIS 33 -10.904 1.642 -10.141 254 HB3 HIS 33 1HB HIS 33 -11.949 0.935 -8.916 255 HD1 HIS 33 1HD HIS 33 -13.960 2.673 -8.119 256 HD2 HIS 33 2HD HIS 33 -12.200 3.303 -11.838 257 HE1 HIS 33 1HE HIS 33 -15.565 4.135 -9.395 258 HE2 HIS 33 2HE HIS 33 -14.397 4.653 -11.567 259 H LYS 34 HN LYS 34 -10.776 0.255 -7.085 260 HA LYS 34 HA LYS 34 -7.925 0.192 -6.510 261 HB2 LYS 34 2HB LYS 34 -8.369 -1.579 -5.015 262 HB3 LYS 34 1HB LYS 34 -9.707 -0.459 -4.817 263 HG2 LYS 34 2HG LYS 34 -11.205 -1.871 -5.925 264 HG3 LYS 34 1HG LYS 34 -9.906 -2.838 -6.632 265 HD2 LYS 34 2HD LYS 34 -9.286 -3.556 -4.326 266 HD3 LYS 34 1HD LYS 34 -10.721 -2.720 -3.730 267 HE2 LYS 34 2HE LYS 34 -10.770 -4.912 -5.797 268 HE3 LYS 34 1HE LYS 34 -11.004 -5.180 -4.071 269 HZ1 LYS 34 3HZ LYS 34 -12.728 -3.581 -5.887 270 HZ2 LYS 34 1HZ LYS 34 -12.910 -3.628 -4.203 271 HZ3 LYS 34 2HZ LYS 34 -13.123 -5.036 -5.109 272 H HIS 35 HN HIS 35 -6.983 -2.174 -6.676 273 HA HIS 35 HA HIS 35 -7.881 -3.620 -9.016 274 HB2 HIS 35 2HB HIS 35 -6.392 -1.859 -9.947 275 HB3 HIS 35 1HB HIS 35 -5.089 -2.449 -8.921 276 HD1 HIS 35 1HD HIS 35 -6.894 -3.139 -12.089 277 HD2 HIS 35 2HD HIS 35 -3.982 -4.947 -9.727 278 HE1 HIS 35 1HE HIS 35 -5.897 -4.963 -13.511 279 HE2 HIS 35 2HE HIS 35 -4.212 -6.117 -12.026 280 H GLY 36 HN GLY 36 -7.943 -5.637 -8.265 281 HA2 GLY 36 2HA GLY 36 -7.041 -7.683 -7.656 282 HA3 GLY 36 1HA GLY 36 -5.487 -6.894 -7.445 283 H GLN 37 HN GLN 37 -5.490 -8.490 -5.618 284 HA GLN 37 HA GLN 37 -6.880 -7.407 -3.258 285 HB2 GLN 37 2HB GLN 37 -5.760 -10.170 -3.753 286 HB3 GLN 37 1HB GLN 37 -6.370 -9.615 -2.206 287 HG2 GLN 37 2HG GLN 37 -8.569 -9.202 -3.312 288 HG3 GLN 37 1HG GLN 37 -7.917 -9.982 -4.750 289 HE21 GLN 37 1HE2 GLN 37 -7.167 -10.977 -1.468 290 HE22 GLN 37 2HE2 GLN 37 -7.982 -12.495 -1.549 291 H PHE 38 HN PHE 38 -3.825 -9.019 -4.144 292 HA PHE 38 HA PHE 38 -2.567 -7.723 -1.823 293 HB2 PHE 38 2HB PHE 38 -1.594 -10.107 -3.416 294 HB3 PHE 38 1HB PHE 38 -0.869 -9.472 -1.945 295 HD1 PHE 38 1HD PHE 38 -2.061 -9.704 0.210 296 HD2 PHE 38 2HD PHE 38 -3.452 -11.556 -3.357 297 HE1 PHE 38 1HE PHE 38 -3.467 -11.214 1.548 298 HE2 PHE 38 2HE PHE 38 -4.861 -13.071 -2.027 299 HZ PHE 38 HZ PHE 38 -4.870 -12.900 0.429 300 H ILE 39 HN ILE 39 -1.989 -5.743 -2.694 301 HA ILE 39 HA ILE 39 -0.118 -5.860 -4.978 302 HB ILE 39 HB ILE 39 -1.947 -3.563 -4.246 303 HG12 ILE 39 2HG1 ILE 39 -3.182 -5.491 -5.183 304 HG13 ILE 39 1HG1 ILE 39 -3.193 -4.109 -6.274 305 HG21 ILE 39 1HG2 ILE 39 -1.215 -2.588 -6.370 306 HG22 ILE 39 2HG2 ILE 39 -0.103 -3.936 -6.604 307 HG23 ILE 39 3HG2 ILE 39 0.134 -2.818 -5.260 308 HD11 ILE 39 3HD1 ILE 39 -2.869 -6.195 -7.472 309 HD12 ILE 39 1HD1 ILE 39 -1.429 -6.535 -6.515 310 HD13 ILE 39 2HD1 ILE 39 -1.449 -5.157 -7.618 311 H TYR 40 HN TYR 40 1.888 -5.279 -4.515 312 HA TYR 40 HA TYR 40 2.330 -3.398 -2.297 313 HB2 TYR 40 2HB TYR 40 3.519 -5.523 -2.029 314 HB3 TYR 40 1HB TYR 40 4.257 -5.329 -3.615 315 HD1 TYR 40 2HD TYR 40 4.157 -3.990 -0.175 316 HD2 TYR 40 1HD TYR 40 6.194 -3.979 -3.909 317 HE1 TYR 40 2HE TYR 40 6.035 -2.783 0.860 318 HE2 TYR 40 1HE TYR 40 8.071 -2.771 -2.888 319 HH TYR 40 HH TYR 40 8.691 -1.538 -1.069 320 H VAL 41 HN VAL 41 2.936 -1.384 -2.808 321 HA VAL 41 HA VAL 41 3.654 -0.897 -5.613 322 HB VAL 41 HB VAL 41 2.890 1.437 -5.241 323 HG11 VAL 41 1HG1 VAL 41 0.834 -0.717 -4.759 324 HG12 VAL 41 2HG1 VAL 41 1.458 -0.194 -6.322 325 HG13 VAL 41 3HG1 VAL 41 0.503 0.915 -5.342 326 HG21 VAL 41 3HG2 VAL 41 1.818 0.354 -2.636 327 HG22 VAL 41 1HG2 VAL 41 1.490 1.951 -3.311 328 HG23 VAL 41 2HG2 VAL 41 3.127 1.523 -2.814 329 H TRP 42 HN TRP 42 5.468 0.079 -6.145 330 HA TRP 42 HA TRP 42 6.994 1.543 -4.137 331 HB2 TRP 42 2HB TRP 42 9.022 0.335 -4.484 332 HB3 TRP 42 1HB TRP 42 7.788 -0.887 -4.205 333 HD1 TRP 42 1HD TRP 42 6.660 -1.743 -6.794 334 HE1 TRP 42 1HE TRP 42 8.055 -2.535 -8.816 335 HE3 TRP 42 3HE TRP 42 11.150 0.375 -5.567 336 HZ2 TRP 42 2HZ TRP 42 10.699 -2.294 -9.755 337 HZ3 TRP 42 3HZ TRP 42 13.062 0.041 -7.081 338 HH2 TRP 42 2HH TRP 42 12.839 -1.266 -9.129 339 H GLY 43 HN GLY 43 9.014 2.520 -5.383 340 HA2 GLY 43 2HA GLY 43 8.054 3.359 -8.054 341 HA3 GLY 43 1HA GLY 43 8.760 4.495 -6.910 342 H GLU 44 HN GLU 44 10.787 4.956 -7.218 343 HA GLU 44 HA GLU 44 12.675 2.840 -7.850 344 HB2 GLU 44 2HB GLU 44 12.539 5.409 -9.452 345 HB3 GLU 44 1HB GLU 44 13.847 4.238 -9.533 346 HG2 GLU 44 2HG GLU 44 12.148 2.546 -10.270 347 HG3 GLU 44 1HG GLU 44 10.996 3.872 -10.401 348 H GLU 45 HN GLU 45 12.591 6.367 -7.663 349 HA GLU 45 HA GLU 45 14.081 6.262 -5.158 350 HB2 GLU 45 2HB GLU 45 15.234 8.441 -6.191 351 HB3 GLU 45 1HB GLU 45 15.918 6.835 -6.381 352 HG2 GLU 45 2HG GLU 45 15.987 8.040 -8.468 353 HG3 GLU 45 1HG GLU 45 14.899 6.663 -8.595 354 H GLY 46 HN GLY 46 14.006 8.429 -4.041 355 HA2 GLY 46 2HA GLY 46 12.866 10.391 -3.472 356 HA3 GLY 46 1HA GLY 46 11.739 10.097 -4.788 357 H ALA 47 HN ALA 47 9.893 8.879 -4.420 358 HA ALA 47 HA ALA 47 9.426 7.595 -1.891 359 HB1 ALA 47 1HB ALA 47 9.058 9.931 -1.272 360 HB2 ALA 47 2HB ALA 47 7.543 9.028 -1.236 361 HB3 ALA 47 3HB ALA 47 7.896 10.107 -2.587 362 H GLY 48 HN GLY 48 6.735 7.425 -1.910 363 HA2 GLY 48 2HA GLY 48 6.254 5.924 -4.380 364 HA3 GLY 48 1HA GLY 48 5.392 5.713 -2.864 365 H LYS 49 HN LYS 49 3.313 6.124 -3.294 366 HA LYS 49 HA LYS 49 2.485 8.744 -4.084 367 HB2 LYS 49 2HB LYS 49 3.134 7.590 -6.272 368 HB3 LYS 49 1HB LYS 49 1.759 6.530 -6.008 369 HG2 LYS 49 2HG LYS 49 0.222 8.287 -6.264 370 HG3 LYS 49 1HG LYS 49 1.479 9.516 -6.091 371 HD2 LYS 49 2HD LYS 49 2.508 8.704 -8.192 372 HD3 LYS 49 1HD LYS 49 1.165 7.577 -8.380 373 HE2 LYS 49 2HE LYS 49 -0.400 9.371 -8.597 374 HE3 LYS 49 1HE LYS 49 0.825 10.562 -8.163 375 HZ1 LYS 49 3HZ LYS 49 0.344 10.433 -10.574 376 HZ2 LYS 49 1HZ LYS 49 0.958 8.854 -10.592 377 HZ3 LYS 49 2HZ LYS 49 1.977 10.155 -10.199 378 H SER 50 HN SER 50 1.350 8.659 -2.177 379 HA SER 50 HA SER 50 -0.099 6.395 -1.309 380 HB2 SER 50 2HB SER 50 -0.353 9.217 -0.278 381 HB3 SER 50 1HB SER 50 -0.661 7.717 0.601 382 HG SER 50 HG SER 50 1.574 7.223 0.400 383 H HIS 51 HN HIS 51 -0.992 8.804 -3.532 384 HA HIS 51 HA HIS 51 -3.680 9.238 -2.838 385 HB2 HIS 51 2HB HIS 51 -2.504 10.654 -4.462 386 HB3 HIS 51 1HB HIS 51 -2.430 9.306 -5.592 387 HD1 HIS 51 1HD HIS 51 -4.327 9.091 -7.188 388 HD2 HIS 51 2HD HIS 51 -5.268 11.541 -3.954 389 HE1 HIS 51 1HE HIS 51 -6.585 10.073 -7.711 390 HE2 HIS 51 2HE HIS 51 -7.197 11.439 -5.685 391 H LEU 52 HN LEU 52 -2.167 6.654 -4.699 392 HA LEU 52 HA LEU 52 -4.662 5.619 -5.641 393 HB2 LEU 52 2HB LEU 52 -3.392 3.749 -6.500 394 HB3 LEU 52 1HB LEU 52 -2.607 5.261 -6.899 395 HG LEU 52 HG LEU 52 -1.232 4.663 -4.680 396 HD11 LEU 52 1HD1 LEU 52 -1.986 1.986 -5.848 397 HD12 LEU 52 2HD1 LEU 52 -2.442 2.588 -4.254 398 HD13 LEU 52 3HD1 LEU 52 -0.747 2.269 -4.626 399 HD21 LEU 52 3HD2 LEU 52 0.492 3.744 -6.157 400 HD22 LEU 52 1HD2 LEU 52 -0.286 5.162 -6.862 401 HD23 LEU 52 2HD2 LEU 52 -0.711 3.547 -7.432 402 H LEU 53 HN LEU 53 -2.708 5.168 -2.802 403 HA LEU 53 HA LEU 53 -3.957 2.809 -1.843 404 HB2 LEU 53 2HB LEU 53 -2.493 5.056 -0.479 405 HB3 LEU 53 1HB LEU 53 -3.242 3.772 0.446 406 HG LEU 53 HG LEU 53 -1.804 2.147 -0.876 407 HD11 LEU 53 1HD1 LEU 53 0.208 3.022 -1.914 408 HD12 LEU 53 2HD1 LEU 53 -0.328 4.670 -1.599 409 HD13 LEU 53 3HD1 LEU 53 -1.229 3.653 -2.721 410 HD21 LEU 53 3HD2 LEU 53 0.153 2.548 0.524 411 HD22 LEU 53 1HD2 LEU 53 -1.342 2.761 1.434 412 HD23 LEU 53 2HD2 LEU 53 -0.435 4.170 0.887 413 H GLN 54 HN GLN 54 -4.640 6.232 -1.535 414 HA GLN 54 HA GLN 54 -6.774 6.091 0.278 415 HB2 GLN 54 2HB GLN 54 -6.341 8.080 -1.962 416 HB3 GLN 54 1HB GLN 54 -7.376 8.315 -0.558 417 HG2 GLN 54 2HG GLN 54 -5.492 8.328 0.913 418 HG3 GLN 54 1HG GLN 54 -4.407 7.863 -0.396 419 HE21 GLN 54 1HE2 GLN 54 -4.292 10.160 1.367 420 HE22 GLN 54 2HE2 GLN 54 -4.322 11.556 0.349 421 H ALA 55 HN ALA 55 -6.710 6.016 -3.262 422 HA ALA 55 HA ALA 55 -9.490 5.870 -3.687 423 HB1 ALA 55 1HB ALA 55 -8.906 5.082 -5.927 424 HB2 ALA 55 2HB ALA 55 -7.245 4.810 -5.399 425 HB3 ALA 55 3HB ALA 55 -7.899 6.446 -5.443 426 H TRP 56 HN TRP 56 -7.029 3.413 -3.288 427 HA TRP 56 HA TRP 56 -8.536 1.117 -3.799 428 HB2 TRP 56 2HB TRP 56 -6.047 1.315 -3.613 429 HB3 TRP 56 1HB TRP 56 -6.229 1.467 -1.874 430 HD1 TRP 56 1HD TRP 56 -6.674 -1.130 -4.690 431 HE1 TRP 56 1HE TRP 56 -6.453 -3.475 -3.646 432 HE3 TRP 56 3HE TRP 56 -6.400 0.207 0.235 433 HZ2 TRP 56 2HZ TRP 56 -6.177 -4.593 -1.073 434 HZ3 TRP 56 3HZ TRP 56 -6.149 -1.560 1.923 435 HH2 TRP 56 2HH TRP 56 -6.040 -3.908 1.282 436 H VAL 57 HN VAL 57 -8.051 2.978 -0.843 437 HA VAL 57 HA VAL 57 -9.544 1.217 0.837 438 HB VAL 57 HB VAL 57 -8.704 4.095 1.214 439 HG11 VAL 57 1HG1 VAL 57 -9.942 2.208 3.218 440 HG12 VAL 57 2HG1 VAL 57 -10.683 3.668 2.563 441 HG13 VAL 57 3HG1 VAL 57 -9.255 3.790 3.590 442 HG21 VAL 57 3HG2 VAL 57 -7.622 1.508 2.319 443 HG22 VAL 57 1HG2 VAL 57 -7.064 3.120 2.765 444 HG23 VAL 57 2HG2 VAL 57 -6.851 2.539 1.114 445 H ALA 58 HN ALA 58 -10.290 4.275 -0.825 446 HA ALA 58 HA ALA 58 -12.889 4.607 0.212 447 HB1 ALA 58 1HB ALA 58 -11.637 6.397 -0.898 448 HB2 ALA 58 2HB ALA 58 -13.234 6.178 -1.612 449 HB3 ALA 58 3HB ALA 58 -11.806 5.556 -2.439 450 H GLN 59 HN GLN 59 -11.711 2.928 -2.674 451 HA GLN 59 HA GLN 59 -14.168 2.245 -3.809 452 HB2 GLN 59 2HB GLN 59 -11.997 1.862 -4.919 453 HB3 GLN 59 1HB GLN 59 -11.628 0.600 -3.751 454 HG2 GLN 59 2HG GLN 59 -12.352 -0.455 -5.747 455 HG3 GLN 59 1HG GLN 59 -13.638 -0.637 -4.555 456 HE21 GLN 59 1HE2 GLN 59 -15.267 -0.906 -6.057 457 HE22 GLN 59 2HE2 GLN 59 -15.806 0.374 -7.098 458 H ALA 60 HN ALA 60 -12.240 0.580 -1.352 459 HA ALA 60 HA ALA 60 -13.944 -1.634 -0.987 460 HB1 ALA 60 1HB ALA 60 -12.067 -0.337 0.979 461 HB2 ALA 60 2HB ALA 60 -11.638 -1.577 -0.200 462 HB3 ALA 60 3HB ALA 60 -12.752 -1.957 1.113 463 H LEU 61 HN LEU 61 -13.805 1.524 0.563 464 HA LEU 61 HA LEU 61 -15.666 1.101 2.599 465 HB2 LEU 61 2HB LEU 61 -14.987 3.617 1.078 466 HB3 LEU 61 1HB LEU 61 -15.960 3.587 2.533 467 HG LEU 61 HG LEU 61 -13.068 2.751 2.327 468 HD11 LEU 61 1HD1 LEU 61 -12.634 4.725 3.683 469 HD12 LEU 61 2HD1 LEU 61 -14.349 5.139 3.646 470 HD13 LEU 61 3HD1 LEU 61 -13.403 5.165 2.158 471 HD21 LEU 61 3HD2 LEU 61 -13.155 2.549 4.755 472 HD22 LEU 61 1HD2 LEU 61 -14.279 1.429 3.986 473 HD23 LEU 61 2HD2 LEU 61 -14.881 2.911 4.733 474 H GLU 62 HN GLU 62 -16.151 2.194 -0.745 475 HA GLU 62 HA GLU 62 -18.983 2.472 -0.423 476 HB2 GLU 62 2HB GLU 62 -17.241 2.382 -2.872 477 HB3 GLU 62 1HB GLU 62 -18.985 2.601 -2.935 478 HG2 GLU 62 2HG GLU 62 -18.653 4.591 -1.416 479 HG3 GLU 62 1HG GLU 62 -16.928 4.422 -1.748 480 H ALA 63 HN ALA 63 -16.829 -0.077 -1.330 481 HA ALA 63 HA ALA 63 -18.751 -1.807 -2.509 482 HB1 ALA 63 1HB ALA 63 -17.066 -3.546 -2.263 483 HB2 ALA 63 2HB ALA 63 -16.129 -2.504 -1.192 484 HB3 ALA 63 3HB ALA 63 -16.344 -2.063 -2.888 485 H GLY 64 HN GLY 64 -18.254 -0.817 0.670 486 HA2 GLY 64 2HA GLY 64 -19.648 -1.319 2.475 487 HA3 GLY 64 1HA GLY 64 -20.248 -2.716 1.593 488 H LYS 65 HN LYS 65 -16.834 -2.206 1.875 489 HA LYS 65 HA LYS 65 -16.718 -4.357 3.873 490 HB2 LYS 65 2HB LYS 65 -14.794 -3.911 1.578 491 HB3 LYS 65 1HB LYS 65 -14.691 -5.184 2.783 492 HG2 LYS 65 2HG LYS 65 -16.859 -4.851 0.722 493 HG3 LYS 65 1HG LYS 65 -15.581 -6.067 0.717 494 HD2 LYS 65 2HD LYS 65 -16.481 -7.147 2.630 495 HD3 LYS 65 1HD LYS 65 -17.588 -5.808 2.946 496 HE2 LYS 65 2HE LYS 65 -18.676 -6.317 0.741 497 HE3 LYS 65 1HE LYS 65 -17.681 -7.771 0.662 498 HZ1 LYS 65 3HZ LYS 65 -20.011 -8.015 1.592 499 HZ2 LYS 65 1HZ LYS 65 -19.445 -7.206 2.971 500 HZ3 LYS 65 2HZ LYS 65 -18.760 -8.688 2.513 501 H ASN 66 HN ASN 66 -14.705 -4.324 5.136 502 HA ASN 66 HA ASN 66 -14.308 -1.607 6.049 503 HB2 ASN 66 2HB ASN 66 -14.690 -3.693 7.530 504 HB3 ASN 66 1HB ASN 66 -12.992 -4.028 7.251 505 HD21 ASN 66 1HD2 ASN 66 -12.702 -3.787 9.529 506 HD22 ASN 66 2HD2 ASN 66 -12.585 -2.207 10.236 507 H ALA 67 HN ALA 67 -12.519 -0.428 5.882 508 HA ALA 67 HA ALA 67 -10.073 -1.650 4.842 509 HB1 ALA 67 1HB ALA 67 -11.358 0.807 3.654 510 HB2 ALA 67 2HB ALA 67 -11.316 -0.789 2.906 511 HB3 ALA 67 3HB ALA 67 -9.816 0.099 3.172 512 H ALA 68 HN ALA 68 -8.194 -0.611 5.463 513 HA ALA 68 HA ALA 68 -8.525 1.685 7.280 514 HB1 ALA 68 1HB ALA 68 -8.160 -0.356 8.580 515 HB2 ALA 68 2HB ALA 68 -6.803 0.759 8.736 516 HB3 ALA 68 3HB ALA 68 -6.667 -0.656 7.690 517 H TYR 69 HN TYR 69 -7.415 3.388 6.651 518 HA TYR 69 HA TYR 69 -5.077 3.020 4.906 519 HB2 TYR 69 2HB TYR 69 -6.855 4.439 3.976 520 HB3 TYR 69 1HB TYR 69 -6.802 5.465 5.404 521 HD1 TYR 69 1HD TYR 69 -4.722 4.301 2.538 522 HD2 TYR 69 2HD TYR 69 -5.390 7.324 5.460 523 HE1 TYR 69 1HE TYR 69 -3.039 5.725 1.447 524 HE2 TYR 69 2HE TYR 69 -3.710 8.751 4.375 525 HH TYR 69 HH TYR 69 -1.717 8.449 2.909 526 H ILE 70 HN ILE 70 -3.233 2.949 6.071 527 HA ILE 70 HA ILE 70 -3.011 4.777 8.375 528 HB ILE 70 HB ILE 70 -1.794 2.023 8.126 529 HG12 ILE 70 2HG1 ILE 70 -4.027 3.012 9.918 530 HG13 ILE 70 1HG1 ILE 70 -4.240 1.987 8.499 531 HG21 ILE 70 1HG2 ILE 70 -1.743 3.975 10.422 532 HG22 ILE 70 2HG2 ILE 70 -0.378 3.553 9.388 533 HG23 ILE 70 3HG2 ILE 70 -1.093 2.336 10.446 534 HD11 ILE 70 3HD1 ILE 70 -4.326 0.722 10.592 535 HD12 ILE 70 1HD1 ILE 70 -2.686 1.248 10.975 536 HD13 ILE 70 2HD1 ILE 70 -2.980 0.214 9.576 537 H ASP 71 HN ASP 71 -1.455 6.227 8.221 538 HA ASP 71 HA ASP 71 0.771 5.847 6.360 539 HB2 ASP 71 2HB ASP 71 0.224 8.232 8.146 540 HB3 ASP 71 1HB ASP 71 1.309 8.165 6.763 541 H ALA 72 HN ALA 72 2.279 4.507 7.284 542 HA ALA 72 HA ALA 72 2.430 4.049 10.043 543 HB1 ALA 72 1HB ALA 72 4.385 2.705 9.578 544 HB2 ALA 72 2HB ALA 72 4.544 3.447 7.985 545 HB3 ALA 72 3HB ALA 72 3.148 2.431 8.350 546 H ALA 73 HN ALA 73 3.923 6.530 8.161 547 HA ALA 73 HA ALA 73 5.995 7.017 10.127 548 HB1 ALA 73 1HB ALA 73 6.725 8.806 8.645 549 HB2 ALA 73 2HB ALA 73 5.302 8.558 7.636 550 HB3 ALA 73 3HB ALA 73 6.520 7.290 7.767 551 H SER 74 HN SER 74 2.783 7.755 9.971 552 HA SER 74 HA SER 74 3.206 10.069 11.735 553 HB2 SER 74 2HB SER 74 2.444 10.772 9.445 554 HB3 SER 74 1HB SER 74 0.954 9.875 9.728 555 HG SER 74 HG SER 74 0.276 11.386 11.057 556 H MET 75 HN MET 75 1.511 7.160 11.006 557 HA MET 75 HA MET 75 0.099 7.350 13.574 558 HB2 MET 75 2HB MET 75 -1.019 6.395 10.932 559 HB3 MET 75 1HB MET 75 -1.792 6.071 12.473 560 HG2 MET 75 2HG MET 75 -1.910 8.530 12.846 561 HG3 MET 75 1HG MET 75 -1.307 8.754 11.209 562 HE1 MET 75 3HE MET 75 -2.666 8.067 9.016 563 HE2 MET 75 1HE MET 75 -4.198 7.196 9.064 564 HE3 MET 75 2HE MET 75 -2.721 6.413 9.626 565 HA PRO 76 HA PRO 76 2.028 3.428 14.118 566 HB2 PRO 76 2HB PRO 76 0.761 2.606 16.348 567 HB3 PRO 76 1HB PRO 76 1.932 3.924 16.350 568 HG2 PRO 76 2HG PRO 76 -1.033 4.020 16.485 569 HG3 PRO 76 1HG PRO 76 0.158 5.098 17.227 570 HD2 PRO 76 2HD PRO 76 -1.301 5.615 14.903 571 HD3 PRO 76 1HD PRO 76 0.153 6.481 15.430 572 H LEU 77 HN LEU 77 1.743 1.237 13.836 573 HA LEU 77 HA LEU 77 -0.770 0.361 12.712 574 HB2 LEU 77 2HB LEU 77 1.391 -0.392 11.783 575 HB3 LEU 77 1HB LEU 77 1.770 -1.173 13.306 576 HG LEU 77 HG LEU 77 -0.204 -2.663 12.975 577 HD11 LEU 77 1HD1 LEU 77 -0.269 -1.419 10.230 578 HD12 LEU 77 2HD1 LEU 77 -1.480 -1.198 11.492 579 HD13 LEU 77 3HD1 LEU 77 -1.232 -2.792 10.778 580 HD21 LEU 77 3HD2 LEU 77 0.857 -4.072 11.304 581 HD22 LEU 77 1HD2 LEU 77 2.061 -3.371 12.383 582 HD23 LEU 77 2HD2 LEU 77 1.842 -2.714 10.761 583 H THR 78 HN THR 78 -2.157 -1.166 13.653 584 HA THR 78 HA THR 78 -1.639 -1.893 16.442 585 HB THR 78 HB THR 78 -4.421 -1.096 15.951 586 HG1 THR 78 1HG THR 78 -2.337 0.662 15.397 587 HG21 THR 78 3HG2 THR 78 -2.405 -0.322 18.063 588 HG22 THR 78 1HG2 THR 78 -3.541 -1.665 18.165 589 HG23 THR 78 2HG2 THR 78 -4.139 -0.006 18.125 590 H ASP 79 HN ASP 79 -3.025 -3.630 17.188 591 HA ASP 79 HA ASP 79 -3.433 -5.686 15.302 592 HB2 ASP 79 2HB ASP 79 -4.245 -6.997 17.097 593 HB3 ASP 79 1HB ASP 79 -3.061 -5.918 17.823 594 H ALA 80 HN ALA 80 -5.348 -3.044 16.202 595 HA ALA 80 HA ALA 80 -7.951 -3.840 15.708 596 HB1 ALA 80 1HB ALA 80 -8.403 -1.503 15.175 597 HB2 ALA 80 2HB ALA 80 -6.675 -1.199 14.997 598 HB3 ALA 80 3HB ALA 80 -7.336 -1.630 16.575 599 H ALA 81 HN ALA 81 -5.318 -3.460 13.508 600 HA ALA 81 HA ALA 81 -6.618 -2.960 11.103 601 HB1 ALA 81 1HB ALA 81 -4.156 -4.635 11.542 602 HB2 ALA 81 2HB ALA 81 -4.194 -2.878 11.401 603 HB3 ALA 81 3HB ALA 81 -4.652 -3.881 10.026 604 H PHE 82 HN PHE 82 -6.572 -5.869 12.999 605 HA PHE 82 HA PHE 82 -7.076 -7.711 10.902 606 HB2 PHE 82 2HB PHE 82 -7.410 -7.831 13.880 607 HB3 PHE 82 1HB PHE 82 -7.974 -9.145 12.855 608 HD1 PHE 82 1HD PHE 82 -6.326 -10.320 11.381 609 HD2 PHE 82 2HD PHE 82 -5.139 -7.624 14.446 610 HE1 PHE 82 1HE PHE 82 -4.066 -11.285 11.345 611 HE2 PHE 82 2HE PHE 82 -2.873 -8.587 14.423 612 HZ PHE 82 HZ PHE 82 -2.336 -10.419 12.872 613 H GLU 83 HN GLU 83 -9.074 -5.359 12.317 614 HA GLU 83 HA GLU 83 -11.574 -6.703 11.921 615 HB2 GLU 83 2HB GLU 83 -10.943 -3.772 12.181 616 HB3 GLU 83 1HB GLU 83 -12.550 -4.469 12.236 617 HG2 GLU 83 2HG GLU 83 -11.895 -5.725 14.246 618 HG3 GLU 83 1HG GLU 83 -10.334 -4.907 14.208 619 H ALA 84 HN ALA 84 -9.356 -5.033 9.950 620 HA ALA 84 HA ALA 84 -11.366 -4.272 7.984 621 HB1 ALA 84 1HB ALA 84 -9.614 -2.987 6.923 622 HB2 ALA 84 2HB ALA 84 -8.412 -3.677 8.015 623 HB3 ALA 84 3HB ALA 84 -9.671 -2.617 8.648 624 H GLU 85 HN GLU 85 -11.562 -5.164 6.033 625 HA GLU 85 HA GLU 85 -10.131 -7.607 5.430 626 HB2 GLU 85 2HB GLU 85 -12.579 -7.189 4.927 627 HB3 GLU 85 1HB GLU 85 -12.060 -6.077 3.671 628 HG2 GLU 85 2HG GLU 85 -12.618 -8.208 2.705 629 HG3 GLU 85 1HG GLU 85 -10.889 -7.914 2.549 630 H TYR 86 HN TYR 86 -10.189 -4.273 4.454 631 HA TYR 86 HA TYR 86 -8.005 -4.727 2.530 632 HB2 TYR 86 2HB TYR 86 -9.904 -2.401 2.899 633 HB3 TYR 86 1HB TYR 86 -8.528 -2.365 1.808 634 HD1 TYR 86 2HD TYR 86 -11.469 -4.585 2.508 635 HD2 TYR 86 1HD TYR 86 -8.976 -2.753 -0.409 636 HE1 TYR 86 2HE TYR 86 -12.882 -5.522 0.724 637 HE2 TYR 86 1HE TYR 86 -10.381 -3.679 -2.201 638 HH TYR 86 HH TYR 86 -13.412 -5.265 -1.545 639 H LEU 87 HN LEU 87 -6.018 -4.394 3.338 640 HA LEU 87 HA LEU 87 -5.687 -2.290 5.380 641 HB2 LEU 87 2HB LEU 87 -4.143 -4.831 4.911 642 HB3 LEU 87 1HB LEU 87 -3.499 -3.517 5.873 643 HG LEU 87 HG LEU 87 -4.381 -5.085 7.396 644 HD11 LEU 87 1HD1 LEU 87 -4.892 -2.791 7.969 645 HD12 LEU 87 2HD1 LEU 87 -6.193 -3.859 8.495 646 HD13 LEU 87 3HD1 LEU 87 -6.394 -2.872 7.048 647 HD21 LEU 87 3HD2 LEU 87 -6.910 -5.085 5.760 648 HD22 LEU 87 1HD2 LEU 87 -6.692 -5.911 7.302 649 HD23 LEU 87 2HD2 LEU 87 -5.744 -6.403 5.899 650 H ALA 88 HN ALA 88 -4.804 -0.492 4.629 651 HA ALA 88 HA ALA 88 -2.723 -0.718 2.551 652 HB1 ALA 88 1HB ALA 88 -4.787 0.306 1.669 653 HB2 ALA 88 2HB ALA 88 -3.425 1.428 1.661 654 HB3 ALA 88 3HB ALA 88 -4.669 1.562 2.902 655 H VAL 89 HN VAL 89 -0.787 -0.164 3.289 656 HA VAL 89 HA VAL 89 -0.610 1.915 5.365 657 HB VAL 89 HB VAL 89 0.995 -0.649 5.344 658 HG11 VAL 89 1HG1 VAL 89 1.918 0.137 7.468 659 HG12 VAL 89 2HG1 VAL 89 1.027 1.649 7.297 660 HG13 VAL 89 3HG1 VAL 89 2.305 1.245 6.150 661 HG21 VAL 89 3HG2 VAL 89 -1.175 0.303 7.218 662 HG22 VAL 89 1HG2 VAL 89 -0.177 -1.131 7.469 663 HG23 VAL 89 2HG2 VAL 89 -1.278 -1.052 6.094 664 H ASP 90 HN ASP 90 0.675 3.513 4.805 665 HA ASP 90 HA ASP 90 2.594 3.104 2.609 666 HB2 ASP 90 2HB ASP 90 0.815 4.898 2.430 667 HB3 ASP 90 1HB ASP 90 1.611 5.726 3.762 668 H GLN 91 HN GLN 91 4.752 3.607 2.846 669 HA GLN 91 HA GLN 91 6.759 3.928 3.848 670 HB2 GLN 91 2HB GLN 91 5.036 5.513 5.736 671 HB3 GLN 91 1HB GLN 91 6.751 5.293 6.039 672 HG2 GLN 91 2HG GLN 91 7.379 6.660 4.343 673 HG3 GLN 91 1HG GLN 91 5.980 6.255 3.350 674 HE21 GLN 91 1HE2 GLN 91 3.983 6.811 5.259 675 HE22 GLN 91 2HE2 GLN 91 3.939 8.520 5.502 676 H VAL 92 HN VAL 92 6.154 1.516 4.062 677 HA VAL 92 HA VAL 92 5.493 0.475 6.629 678 HB VAL 92 HB VAL 92 6.788 -0.967 4.310 679 HG11 VAL 92 1HG1 VAL 92 5.772 -2.974 5.278 680 HG12 VAL 92 2HG1 VAL 92 5.174 -2.016 6.632 681 HG13 VAL 92 3HG1 VAL 92 6.910 -2.218 6.396 682 HG21 VAL 92 3HG2 VAL 92 4.518 -1.609 3.666 683 HG22 VAL 92 1HG2 VAL 92 4.738 0.139 3.606 684 HG23 VAL 92 2HG2 VAL 92 3.866 -0.594 4.952 685 H GLU 93 HN GLU 93 8.457 1.464 5.175 686 HA GLU 93 HA GLU 93 10.284 -0.159 6.580 687 HB2 GLU 93 2HB GLU 93 10.748 1.259 4.538 688 HB3 GLU 93 1HB GLU 93 10.749 2.663 5.591 689 HG2 GLU 93 2HG GLU 93 12.555 0.497 6.408 690 HG3 GLU 93 1HG GLU 93 12.949 1.267 4.874 691 H LYS 94 HN LYS 94 8.256 2.305 7.696 692 HA LYS 94 HA LYS 94 10.018 3.350 9.718 693 HB2 LYS 94 2HB LYS 94 7.064 3.793 9.376 694 HB3 LYS 94 1HB LYS 94 8.171 4.769 10.327 695 HG2 LYS 94 2HG LYS 94 8.057 4.499 7.336 696 HG3 LYS 94 1HG LYS 94 7.734 5.934 8.309 697 HD2 LYS 94 2HD LYS 94 10.404 4.549 8.156 698 HD3 LYS 94 1HD LYS 94 9.955 5.941 7.182 699 HE2 LYS 94 2HE LYS 94 9.559 7.213 9.271 700 HE3 LYS 94 1HE LYS 94 10.145 5.823 10.183 701 HZ1 LYS 94 3HZ LYS 94 11.691 7.412 8.211 702 HZ2 LYS 94 1HZ LYS 94 12.264 6.020 8.993 703 HZ3 LYS 94 2HZ LYS 94 11.903 7.411 9.893 704 H LEU 95 HN LEU 95 8.373 0.501 9.529 705 HA LEU 95 HA LEU 95 7.216 0.439 12.163 706 HB2 LEU 95 2HB LEU 95 7.772 -1.788 10.204 707 HB3 LEU 95 1HB LEU 95 6.854 -1.956 11.686 708 HG LEU 95 HG LEU 95 6.092 -0.294 9.286 709 HD11 LEU 95 1HD1 LEU 95 4.866 -2.782 10.467 710 HD12 LEU 95 2HD1 LEU 95 5.796 -2.691 8.971 711 HD13 LEU 95 3HD1 LEU 95 4.241 -1.870 9.092 712 HD21 LEU 95 3HD2 LEU 95 5.397 0.810 11.348 713 HD22 LEU 95 1HD2 LEU 95 4.628 -0.681 11.897 714 HD23 LEU 95 2HD2 LEU 95 4.007 0.161 10.478 715 H GLY 96 HN GLY 96 7.955 -0.639 13.980 716 HA2 GLY 96 2HA GLY 96 10.850 -0.751 14.146 717 HA3 GLY 96 1HA GLY 96 9.722 -0.836 15.488 718 H ASN 97 HN ASN 97 8.459 -2.934 15.655 719 HA ASN 97 HA ASN 97 9.759 -5.256 14.536 720 HB2 ASN 97 2HB ASN 97 11.344 -4.615 16.338 721 HB3 ASN 97 1HB ASN 97 10.042 -4.774 17.512 722 HD21 ASN 97 1HD2 ASN 97 9.468 -6.779 18.231 723 HD22 ASN 97 2HD2 ASN 97 10.267 -8.234 17.753 724 H GLU 98 HN GLU 98 7.734 -4.179 17.262 725 HA GLU 98 HA GLU 98 6.221 -6.550 17.472 726 HB2 GLU 98 2HB GLU 98 6.339 -4.783 19.217 727 HB3 GLU 98 1HB GLU 98 5.408 -3.720 18.176 728 HG2 GLU 98 2HG GLU 98 3.489 -5.133 18.325 729 HG3 GLU 98 1HG GLU 98 4.406 -6.368 19.184 730 H GLU 99 HN GLU 99 5.932 -3.658 15.569 731 HA GLU 99 HA GLU 99 3.363 -4.096 14.482 732 HB2 GLU 99 2HB GLU 99 5.639 -2.650 13.122 733 HB3 GLU 99 1HB GLU 99 3.916 -2.378 12.913 734 HG2 GLU 99 2HG GLU 99 4.360 -0.634 14.275 735 HG3 GLU 99 1HG GLU 99 4.075 -1.857 15.511 736 H GLN 100 HN GLN 100 6.573 -5.178 13.554 737 HA GLN 100 HA GLN 100 5.836 -6.229 11.024 738 HB2 GLN 100 2HB GLN 100 8.193 -6.599 12.832 739 HB3 GLN 100 1HB GLN 100 7.987 -7.656 11.443 740 HG2 GLN 100 2HG GLN 100 7.929 -5.688 9.976 741 HG3 GLN 100 1HG GLN 100 8.198 -4.656 11.382 742 HE21 GLN 100 1HE2 GLN 100 10.221 -4.507 12.256 743 HE22 GLN 100 2HE2 GLN 100 11.623 -5.210 11.532 744 H ALA 101 HN ALA 101 6.007 -7.608 14.272 745 HA ALA 101 HA ALA 101 5.376 -10.265 13.521 746 HB1 ALA 101 1HB ALA 101 4.816 -10.602 15.881 747 HB2 ALA 101 2HB ALA 101 4.859 -8.859 16.143 748 HB3 ALA 101 3HB ALA 101 6.333 -9.721 15.703 749 H LEU 102 HN LEU 102 3.462 -7.435 14.263 750 HA LEU 102 HA LEU 102 0.919 -8.678 14.308 751 HB2 LEU 102 2HB LEU 102 1.702 -6.289 15.040 752 HB3 LEU 102 1HB LEU 102 1.386 -5.859 13.374 753 HG LEU 102 HG LEU 102 -0.462 -5.302 14.943 754 HD11 LEU 102 1HD1 LEU 102 -0.911 -5.584 12.571 755 HD12 LEU 102 2HD1 LEU 102 -2.268 -6.139 13.550 756 HD13 LEU 102 3HD1 LEU 102 -1.171 -7.310 12.817 757 HD21 LEU 102 3HD2 LEU 102 -0.718 -8.296 15.161 758 HD22 LEU 102 1HD2 LEU 102 -1.889 -7.121 15.765 759 HD23 LEU 102 2HD2 LEU 102 -0.267 -7.182 16.452 760 H LEU 103 HN LEU 103 2.663 -6.898 11.776 761 HA LEU 103 HA LEU 103 0.865 -7.228 9.677 762 HB2 LEU 103 2HB LEU 103 3.264 -6.008 10.005 763 HB3 LEU 103 1HB LEU 103 3.743 -7.371 9.015 764 HG LEU 103 HG LEU 103 3.341 -5.467 7.612 765 HD11 LEU 103 1HD1 LEU 103 1.110 -7.466 7.346 766 HD12 LEU 103 2HD1 LEU 103 2.730 -7.601 6.662 767 HD13 LEU 103 3HD1 LEU 103 1.635 -6.342 6.090 768 HD21 LEU 103 3HD2 LEU 103 1.159 -4.381 7.471 769 HD22 LEU 103 1HD2 LEU 103 1.863 -4.217 9.080 770 HD23 LEU 103 2HD2 LEU 103 0.574 -5.387 8.794 771 H PHE 104 HN PHE 104 3.601 -9.260 10.640 772 HA PHE 104 HA PHE 104 3.492 -11.257 8.735 773 HB2 PHE 104 2HB PHE 104 5.235 -11.106 10.437 774 HB3 PHE 104 1HB PHE 104 4.073 -11.501 11.694 775 HD1 PHE 104 2HD PHE 104 5.573 -12.880 8.582 776 HD2 PHE 104 1HD PHE 104 3.810 -13.693 12.362 777 HE1 PHE 104 2HE PHE 104 6.100 -15.263 8.306 778 HE2 PHE 104 1HE PHE 104 4.345 -16.083 12.099 779 HZ PHE 104 HZ PHE 104 5.490 -16.870 10.067 780 H SER 105 HN SER 105 1.643 -11.024 11.739 781 HA SER 105 HA SER 105 0.218 -13.429 11.447 782 HB2 SER 105 2HB SER 105 -0.490 -10.907 12.959 783 HB3 SER 105 1HB SER 105 -1.220 -12.488 13.195 784 HG SER 105 HG SER 105 1.350 -11.587 13.863 785 H ILE 106 HN ILE 106 -0.368 -10.144 10.338 786 HA ILE 106 HA ILE 106 -3.010 -10.466 9.433 787 HB ILE 106 HB ILE 106 -0.840 -8.669 8.339 788 HG12 ILE 106 2HG1 ILE 106 -3.069 -8.135 10.317 789 HG13 ILE 106 1HG1 ILE 106 -1.360 -8.281 10.709 790 HG21 ILE 106 1HG2 ILE 106 -2.612 -8.971 6.701 791 HG22 ILE 106 2HG2 ILE 106 -2.656 -7.341 7.375 792 HG23 ILE 106 3HG2 ILE 106 -3.821 -8.550 7.912 793 HD11 ILE 106 3HD1 ILE 106 -2.573 -6.156 8.961 794 HD12 ILE 106 1HD1 ILE 106 -0.871 -6.299 9.398 795 HD13 ILE 106 2HD1 ILE 106 -2.073 -5.958 10.641 796 H PHE 107 HN PHE 107 0.099 -10.972 7.768 797 HA PHE 107 HA PHE 107 -0.904 -11.791 5.286 798 HB2 PHE 107 2HB PHE 107 1.638 -12.225 6.767 799 HB3 PHE 107 1HB PHE 107 1.306 -13.272 5.396 800 HD1 PHE 107 2HD PHE 107 0.685 -12.123 3.184 801 HD2 PHE 107 1HD PHE 107 2.589 -10.139 6.430 802 HE1 PHE 107 2HE PHE 107 1.510 -10.399 1.637 803 HE2 PHE 107 1HE PHE 107 3.419 -8.411 4.888 804 HZ PHE 107 HZ PHE 107 2.884 -8.541 2.488 805 H ASN 108 HN ASN 108 -0.198 -13.646 8.208 806 HA ASN 108 HA ASN 108 -0.843 -16.200 7.256 807 HB2 ASN 108 2HB ASN 108 0.208 -15.789 9.452 808 HB3 ASN 108 1HB ASN 108 -1.298 -15.085 10.035 809 HD21 ASN 108 1HD2 ASN 108 -1.575 -16.570 11.650 810 HD22 ASN 108 2HD2 ASN 108 -1.990 -18.227 11.355 811 H ARG 109 HN ARG 109 -2.902 -13.744 8.790 812 HA ARG 109 HA ARG 109 -5.289 -15.180 8.837 813 HB2 ARG 109 2HB ARG 109 -4.971 -13.073 10.030 814 HB3 ARG 109 1HB ARG 109 -4.851 -12.206 8.509 815 HG2 ARG 109 2HG ARG 109 -7.331 -13.756 9.056 816 HG3 ARG 109 1HG ARG 109 -7.076 -12.236 9.911 817 HD2 ARG 109 2HD ARG 109 -6.827 -11.064 7.794 818 HD3 ARG 109 1HD ARG 109 -7.005 -12.579 6.914 819 HE ARG 109 HE ARG 109 -9.260 -12.167 8.567 820 HH11 ARG 109 1HH1 ARG 109 -7.764 -10.916 5.658 821 HH12 ARG 109 2HH1 ARG 109 -9.268 -10.420 4.929 822 HH21 ARG 109 1HH2 ARG 109 -11.248 -11.481 7.620 823 HH22 ARG 109 2HH2 ARG 109 -11.227 -10.717 6.052 824 H PHE 110 HN PHE 110 -3.934 -13.140 6.266 825 HA PHE 110 HA PHE 110 -6.165 -13.188 4.562 826 HB2 PHE 110 2HB PHE 110 -3.223 -12.835 3.979 827 HB3 PHE 110 1HB PHE 110 -4.471 -12.676 2.749 828 HD1 PHE 110 2HD PHE 110 -6.072 -11.486 5.513 829 HD2 PHE 110 1HD PHE 110 -2.860 -10.448 2.924 830 HE1 PHE 110 2HE PHE 110 -6.373 -9.113 6.095 831 HE2 PHE 110 1HE PHE 110 -3.156 -8.078 3.501 832 HZ PHE 110 HZ PHE 110 -4.913 -7.408 5.086 833 H ARG 111 HN ARG 111 -3.201 -15.163 4.440 834 HA ARG 111 HA ARG 111 -4.217 -16.726 2.268 835 HB2 ARG 111 2HB ARG 111 -1.713 -16.659 3.861 836 HB3 ARG 111 1HB ARG 111 -2.092 -18.150 3.007 837 HG2 ARG 111 2HG ARG 111 -1.943 -15.433 1.713 838 HG3 ARG 111 1HG ARG 111 -0.636 -16.620 1.725 839 HD2 ARG 111 2HD ARG 111 -2.121 -18.226 0.592 840 HD3 ARG 111 1HD ARG 111 -3.382 -16.997 0.531 841 HE ARG 111 HE ARG 111 -2.147 -15.835 -1.101 842 HH11 ARG 111 1HH1 ARG 111 -0.590 -18.821 -0.097 843 HH12 ARG 111 2HH1 ARG 111 0.454 -18.878 -1.488 844 HH21 ARG 111 1HH2 ARG 111 -0.763 -15.922 -2.926 845 HH22 ARG 111 2HH2 ARG 111 0.374 -17.234 -3.070 846 H ASN 112 HN ASN 112 -4.475 -16.952 5.677 847 HA ASN 112 HA ASN 112 -4.774 -19.773 5.877 848 HB2 ASN 112 2HB ASN 112 -4.562 -17.750 7.699 849 HB3 ASN 112 1HB ASN 112 -6.277 -18.135 7.814 850 HD21 ASN 112 1HD2 ASN 112 -3.064 -19.173 8.423 851 HD22 ASN 112 2HD2 ASN 112 -3.459 -20.609 9.299 852 H SER 113 HN SER 113 -7.107 -17.102 5.698 853 HA SER 113 HA SER 113 -9.329 -18.934 5.530 854 HB2 SER 113 2HB SER 113 -9.266 -15.922 5.252 855 HB3 SER 113 1HB SER 113 -10.704 -16.916 5.482 856 HG SER 113 HG SER 113 -10.325 -16.524 7.518 857 H GLY 114 HN GLY 114 -7.386 -17.027 3.338 858 HA2 GLY 114 2HA GLY 114 -7.298 -17.443 0.988 859 HA3 GLY 114 1HA GLY 114 -8.925 -18.113 1.076 860 H LYS 115 HN LYS 115 -7.968 -15.187 2.638 861 HA LYS 115 HA LYS 115 -9.557 -13.577 0.784 862 HB2 LYS 115 2HB LYS 115 -9.895 -14.040 3.710 863 HB3 LYS 115 1HB LYS 115 -10.179 -12.428 3.102 864 HG2 LYS 115 2HG LYS 115 -11.878 -13.259 1.591 865 HG3 LYS 115 1HG LYS 115 -11.538 -14.908 2.107 866 HD2 LYS 115 2HD LYS 115 -12.240 -14.349 4.381 867 HD3 LYS 115 1HD LYS 115 -12.566 -12.691 3.872 868 HE2 LYS 115 2HE LYS 115 -13.938 -15.167 2.831 869 HE3 LYS 115 1HE LYS 115 -14.618 -14.017 3.981 870 HZ1 LYS 115 3HZ LYS 115 -15.423 -13.619 1.744 871 HZ2 LYS 115 1HZ LYS 115 -13.841 -13.407 1.177 872 HZ3 LYS 115 2HZ LYS 115 -14.499 -12.301 2.282 873 H GLY 116 HN GLY 116 -9.331 -11.189 2.122 874 HA2 GLY 116 2HA GLY 116 -7.774 -9.793 3.258 875 HA3 GLY 116 1HA GLY 116 -6.492 -10.894 2.791 876 H PHE 117 HN PHE 117 -7.545 -7.925 2.376 877 HA PHE 117 HA PHE 117 -6.347 -7.745 -0.307 878 HB2 PHE 117 2HB PHE 117 -8.363 -5.924 1.032 879 HB3 PHE 117 1HB PHE 117 -7.541 -5.544 -0.475 880 HD1 PHE 117 2HD PHE 117 -9.832 -8.005 1.096 881 HD2 PHE 117 1HD PHE 117 -8.389 -6.274 -2.510 882 HE1 PHE 117 2HE PHE 117 -11.602 -9.160 -0.162 883 HE2 PHE 117 1HE PHE 117 -10.159 -7.423 -3.772 884 HZ PHE 117 HZ PHE 117 -11.767 -8.870 -2.600 885 H LEU 118 HN LEU 118 -4.453 -6.685 -0.393 886 HA LEU 118 HA LEU 118 -3.681 -5.056 1.928 887 HB2 LEU 118 2HB LEU 118 -2.791 -7.415 2.064 888 HB3 LEU 118 1HB LEU 118 -1.869 -7.056 0.618 889 HG LEU 118 HG LEU 118 -0.714 -5.229 1.841 890 HD11 LEU 118 1HD1 LEU 118 -2.428 -4.788 3.518 891 HD12 LEU 118 2HD1 LEU 118 -0.873 -5.145 4.267 892 HD13 LEU 118 3HD1 LEU 118 -2.139 -6.372 4.237 893 HD21 LEU 118 3HD2 LEU 118 -0.516 -7.964 3.091 894 HD22 LEU 118 1HD2 LEU 118 0.709 -6.698 3.169 895 HD23 LEU 118 2HD2 LEU 118 0.299 -7.433 1.619 896 H LEU 119 HN LEU 119 -2.461 -3.346 1.499 897 HA LEU 119 HA LEU 119 -1.172 -3.044 -1.092 898 HB2 LEU 119 2HB LEU 119 -3.408 -2.067 -1.390 899 HB3 LEU 119 1HB LEU 119 -3.146 -1.030 -0.001 900 HG LEU 119 HG LEU 119 -1.323 0.111 -1.196 901 HD11 LEU 119 1HD1 LEU 119 -0.591 -1.717 -2.621 902 HD12 LEU 119 2HD1 LEU 119 -0.995 -0.297 -3.586 903 HD13 LEU 119 3HD1 LEU 119 -2.115 -1.656 -3.505 904 HD21 LEU 119 3HD2 LEU 119 -2.710 1.286 -2.810 905 HD22 LEU 119 1HD2 LEU 119 -3.606 0.970 -1.324 906 HD23 LEU 119 2HD2 LEU 119 -3.896 -0.018 -2.756 907 H LEU 120 HN LEU 120 0.840 -2.860 -0.365 908 HA LEU 120 HA LEU 120 1.339 -0.977 1.846 909 HB2 LEU 120 2HB LEU 120 2.937 -3.414 1.055 910 HB3 LEU 120 1HB LEU 120 3.366 -2.297 2.336 911 HG LEU 120 HG LEU 120 0.927 -4.082 2.290 912 HD11 LEU 120 1HD1 LEU 120 2.033 -5.260 4.109 913 HD12 LEU 120 2HD1 LEU 120 3.435 -4.201 3.957 914 HD13 LEU 120 3HD1 LEU 120 3.013 -5.298 2.642 915 HD21 LEU 120 3HD2 LEU 120 1.932 -2.181 4.409 916 HD22 LEU 120 1HD2 LEU 120 0.599 -3.322 4.600 917 HD23 LEU 120 2HD2 LEU 120 0.464 -1.995 3.448 918 H GLY 121 HN GLY 121 2.957 0.505 1.645 919 HA2 GLY 121 2HA GLY 121 4.516 0.471 -0.859 920 HA3 GLY 121 1HA GLY 121 3.706 1.943 -0.329 921 H SER 122 HN SER 122 6.644 0.826 -0.575 922 HA SER 122 HA SER 122 7.576 2.331 1.723 923 HB2 SER 122 2HB SER 122 7.295 -0.085 2.471 924 HB3 SER 122 1HB SER 122 8.574 -0.498 1.332 925 HG SER 122 HG SER 122 9.823 1.185 2.497 926 H GLU 123 HN GLU 123 7.610 2.790 -1.022 927 HA GLU 123 HA GLU 123 8.798 3.393 -2.797 928 HB2 GLU 123 2HB GLU 123 10.895 4.579 -2.455 929 HB3 GLU 123 1HB GLU 123 9.655 5.062 -1.319 930 HG2 GLU 123 2HG GLU 123 11.546 2.998 -0.391 931 HG3 GLU 123 1HG GLU 123 12.199 4.614 -0.649 932 H TYR 124 HN TYR 124 10.928 1.227 -0.916 933 HA TYR 124 HA TYR 124 12.215 0.372 -3.390 934 HB2 TYR 124 2HB TYR 124 12.646 -0.674 -0.585 935 HB3 TYR 124 1HB TYR 124 13.689 -0.928 -1.977 936 HD1 TYR 124 1HD TYR 124 14.688 1.254 -3.047 937 HD2 TYR 124 2HD TYR 124 13.133 1.023 0.902 938 HE1 TYR 124 1HE TYR 124 15.989 3.246 -2.424 939 HE2 TYR 124 2HE TYR 124 14.424 3.017 1.535 940 HH TYR 124 HH TYR 124 16.487 4.185 0.777 941 H THR 125 HN THR 125 12.603 -2.194 -3.349 942 HA THR 125 HA THR 125 9.961 -3.389 -3.450 943 HB THR 125 HB THR 125 11.444 -5.394 -4.275 944 HG1 THR 125 1HG THR 125 13.314 -4.175 -5.431 945 HG21 THR 125 3HG2 THR 125 11.352 -4.517 -6.552 946 HG22 THR 125 1HG2 THR 125 11.094 -2.888 -5.925 947 HG23 THR 125 2HG2 THR 125 9.872 -4.136 -5.670 948 HA PRO 126 HA PRO 126 10.057 -5.756 0.271 949 HB2 PRO 126 2HB PRO 126 9.584 -8.241 -1.271 950 HB3 PRO 126 1HB PRO 126 8.612 -7.507 0.008 951 HG2 PRO 126 2HG PRO 126 7.818 -7.421 -2.537 952 HG3 PRO 126 1HG PRO 126 7.557 -6.047 -1.447 953 HD2 PRO 126 2HD PRO 126 9.624 -6.411 -3.578 954 HD3 PRO 126 1HD PRO 126 8.696 -4.960 -3.142 955 H GLN 127 HN GLN 127 11.944 -6.968 -2.416 956 HA GLN 127 HA GLN 127 13.616 -8.559 -0.629 957 HB2 GLN 127 2HB GLN 127 13.595 -8.286 -3.638 958 HB3 GLN 127 1HB GLN 127 14.741 -9.278 -2.747 959 HG2 GLN 127 2HG GLN 127 12.941 -10.656 -1.898 960 HG3 GLN 127 1HG GLN 127 11.750 -9.631 -2.692 961 HE21 GLN 127 1HE2 GLN 127 14.808 -10.536 -4.146 962 HE22 GLN 127 2HE2 GLN 127 14.126 -11.532 -5.389 963 H GLN 128 HN GLN 128 13.437 -5.434 -1.390 964 HA GLN 128 HA GLN 128 16.353 -5.036 -1.372 965 HB2 GLN 128 2HB GLN 128 15.102 -3.851 -3.151 966 HB3 GLN 128 1HB GLN 128 14.133 -3.049 -1.923 967 HG2 GLN 128 2HG GLN 128 15.795 -1.524 -2.703 968 HG3 GLN 128 1HG GLN 128 16.202 -1.995 -1.053 969 HE21 GLN 128 1HE2 GLN 128 17.079 -2.184 -4.390 970 HE22 GLN 128 2HE2 GLN 128 18.656 -2.875 -4.161 971 H LEU 129 HN LEU 129 13.390 -4.590 0.375 972 HA LEU 129 HA LEU 129 14.340 -2.774 2.339 973 HB2 LEU 129 2HB LEU 129 12.054 -4.740 2.395 974 HB3 LEU 129 1HB LEU 129 12.342 -3.524 3.621 975 HG LEU 129 HG LEU 129 11.723 -2.959 0.723 976 HD11 LEU 129 1HD1 LEU 129 9.571 -2.176 1.580 977 HD12 LEU 129 2HD1 LEU 129 10.025 -2.706 3.200 978 HD13 LEU 129 3HD1 LEU 129 9.817 -3.890 1.909 979 HD21 LEU 129 3HD2 LEU 129 13.119 -1.226 1.707 980 HD22 LEU 129 1HD2 LEU 129 12.028 -1.107 3.087 981 HD23 LEU 129 2HD2 LEU 129 11.473 -0.636 1.479 982 H VAL 130 HN VAL 130 15.052 -3.133 4.431 983 HA VAL 130 HA VAL 130 16.025 -5.857 4.957 984 HB VAL 130 HB VAL 130 16.913 -3.294 6.301 985 HG11 VAL 130 1HG1 VAL 130 17.253 -5.269 7.680 986 HG12 VAL 130 2HG1 VAL 130 18.801 -4.667 7.087 987 HG13 VAL 130 3HG1 VAL 130 18.063 -6.086 6.343 988 HG21 VAL 130 3HG2 VAL 130 18.245 -4.869 4.102 989 HG22 VAL 130 1HG2 VAL 130 18.945 -3.493 4.952 990 HG23 VAL 130 2HG2 VAL 130 17.516 -3.271 3.942 991 H ILE 131 HN ILE 131 13.917 -6.500 5.607 992 HA ILE 131 HA ILE 131 13.180 -5.579 8.305 993 HB ILE 131 HB ILE 131 10.904 -6.466 7.823 994 HG12 ILE 131 2HG1 ILE 131 11.954 -6.722 4.992 995 HG13 ILE 131 1HG1 ILE 131 11.537 -8.061 6.052 996 HG21 ILE 131 1HG2 ILE 131 10.206 -4.610 6.366 997 HG22 ILE 131 2HG2 ILE 131 11.894 -4.335 5.932 998 HG23 ILE 131 3HG2 ILE 131 11.361 -4.095 7.595 999 HD11 ILE 131 3HD1 ILE 131 9.627 -5.991 5.004 1000 HD12 ILE 131 1HD1 ILE 131 9.213 -7.343 6.059 1001 HD13 ILE 131 2HD1 ILE 131 9.793 -7.647 4.419 1002 H ARG 132 HN ARG 132 11.735 -7.570 9.310 1003 HA ARG 132 HA ARG 132 13.608 -9.674 9.709 1004 HB2 ARG 132 2HB ARG 132 11.776 -8.918 11.319 1005 HB3 ARG 132 1HB ARG 132 10.664 -9.855 10.341 1006 HG2 ARG 132 2HG ARG 132 11.921 -11.874 10.816 1007 HG3 ARG 132 1HG ARG 132 13.101 -10.940 11.740 1008 HD2 ARG 132 2HD ARG 132 11.178 -10.215 13.213 1009 HD3 ARG 132 1HD ARG 132 10.199 -11.427 12.390 1010 HE ARG 132 HE ARG 132 12.693 -12.241 13.718 1011 HH11 ARG 132 1HH1 ARG 132 9.202 -12.351 13.502 1012 HH12 ARG 132 2HH1 ARG 132 9.037 -13.676 14.614 1013 HH21 ARG 132 1HH2 ARG 132 12.491 -13.968 15.201 1014 HH22 ARG 132 2HH2 ARG 132 10.911 -14.593 15.587 1015 H GLU 133 HN GLU 133 13.809 -11.587 8.732 1016 HA GLU 133 HA GLU 133 12.880 -11.779 6.088 1017 HB2 GLU 133 2HB GLU 133 14.995 -12.778 7.149 1018 HB3 GLU 133 1HB GLU 133 13.964 -14.109 7.653 1019 HG2 GLU 133 2HG GLU 133 13.618 -14.840 5.489 1020 HG3 GLU 133 1HG GLU 133 14.026 -13.274 4.787 1021 H ASP 134 HN ASP 134 11.491 -12.836 9.053 1022 HA ASP 134 HA ASP 134 9.764 -14.857 8.108 1023 HB2 ASP 134 2HB ASP 134 9.419 -12.886 10.377 1024 HB3 ASP 134 1HB ASP 134 8.342 -14.247 10.085 1025 H LEU 135 HN LEU 135 9.432 -11.349 8.279 1026 HA LEU 135 HA LEU 135 6.773 -11.383 7.159 1027 HB2 LEU 135 2HB LEU 135 7.518 -9.632 8.750 1028 HB3 LEU 135 1HB LEU 135 8.687 -9.078 7.569 1029 HG LEU 135 HG LEU 135 6.836 -8.489 6.038 1030 HD11 LEU 135 1HD1 LEU 135 5.068 -9.195 8.372 1031 HD12 LEU 135 2HD1 LEU 135 5.195 -10.104 6.869 1032 HD13 LEU 135 3HD1 LEU 135 4.553 -8.461 6.855 1033 HD21 LEU 135 3HD2 LEU 135 6.045 -6.541 7.305 1034 HD22 LEU 135 1HD2 LEU 135 7.780 -6.792 7.506 1035 HD23 LEU 135 2HD2 LEU 135 6.666 -7.261 8.790 1036 H ARG 136 HN ARG 136 10.050 -10.983 6.093 1037 HA ARG 136 HA ARG 136 9.648 -9.881 3.557 1038 HB2 ARG 136 2HB ARG 136 11.828 -10.034 4.670 1039 HB3 ARG 136 1HB ARG 136 11.804 -11.783 4.496 1040 HG2 ARG 136 2HG ARG 136 11.762 -11.460 2.023 1041 HG3 ARG 136 1HG ARG 136 11.996 -9.731 2.305 1042 HD2 ARG 136 2HD ARG 136 14.072 -10.202 3.502 1043 HD3 ARG 136 1HD ARG 136 13.841 -11.929 3.240 1044 HE ARG 136 HE ARG 136 14.585 -9.929 1.225 1045 HH11 ARG 136 1HH1 ARG 136 13.921 -13.260 2.066 1046 HH12 ARG 136 2HH1 ARG 136 14.715 -13.923 0.674 1047 HH21 ARG 136 1HH2 ARG 136 15.645 -10.795 -0.628 1048 HH22 ARG 136 2HH2 ARG 136 15.689 -12.518 -0.865 1049 H THR 137 HN THR 137 9.717 -13.287 4.590 1050 HA THR 137 HA THR 137 9.490 -14.347 1.975 1051 HB THR 137 HB THR 137 10.338 -15.669 3.882 1052 HG1 THR 137 1HG THR 137 8.199 -17.256 3.228 1053 HG21 THR 137 3HG2 THR 137 7.459 -15.716 4.793 1054 HG22 THR 137 1HG2 THR 137 8.803 -14.933 5.624 1055 HG23 THR 137 2HG2 THR 137 8.768 -16.690 5.469 1056 H ARG 138 HN ARG 138 7.149 -13.177 4.305 1057 HA ARG 138 HA ARG 138 4.846 -14.236 3.014 1058 HB2 ARG 138 2HB ARG 138 5.202 -11.938 4.935 1059 HB3 ARG 138 1HB ARG 138 3.643 -12.571 4.424 1060 HG2 ARG 138 2HG ARG 138 5.738 -14.239 5.781 1061 HG3 ARG 138 1HG ARG 138 4.465 -13.384 6.639 1062 HD2 ARG 138 2HD ARG 138 2.840 -14.614 5.100 1063 HD3 ARG 138 1HD ARG 138 4.211 -15.634 4.667 1064 HE ARG 138 HE ARG 138 3.279 -15.363 7.450 1065 HH11 ARG 138 1HH1 ARG 138 4.327 -17.322 4.746 1066 HH12 ARG 138 2HH1 ARG 138 4.128 -18.828 5.591 1067 HH21 ARG 138 1HH2 ARG 138 3.005 -17.350 8.574 1068 HH22 ARG 138 2HH2 ARG 138 3.377 -18.840 7.757 1069 H MET 139 HN MET 139 6.808 -11.394 2.578 1070 HA MET 139 HA MET 139 4.977 -9.738 1.240 1071 HB2 MET 139 2HB MET 139 7.975 -9.914 1.230 1072 HB3 MET 139 1HB MET 139 7.134 -8.749 0.224 1073 HG2 MET 139 2HG MET 139 6.386 -8.813 3.074 1074 HG3 MET 139 1HG MET 139 7.999 -8.218 2.692 1075 HE1 MET 139 3HE MET 139 4.129 -6.311 1.010 1076 HE2 MET 139 1HE MET 139 4.149 -7.757 2.019 1077 HE3 MET 139 2HE MET 139 4.785 -7.821 0.376 1078 H ALA 140 HN ALA 140 6.599 -12.574 0.198 1079 HA ALA 140 HA ALA 140 6.586 -11.988 -2.606 1080 HB1 ALA 140 1HB ALA 140 8.197 -13.542 -1.616 1081 HB2 ALA 140 2HB ALA 140 7.256 -14.301 -2.899 1082 HB3 ALA 140 3HB ALA 140 6.879 -14.640 -1.209 1083 H TYR 141 HN TYR 141 4.112 -12.651 -0.497 1084 HA TYR 141 HA TYR 141 2.509 -14.210 -2.346 1085 HB2 TYR 141 2HB TYR 141 1.911 -13.014 0.365 1086 HB3 TYR 141 1HB TYR 141 0.723 -13.886 -0.590 1087 HD1 TYR 141 1HD TYR 141 2.302 -16.149 -1.616 1088 HD2 TYR 141 2HD TYR 141 2.301 -14.330 2.226 1089 HE1 TYR 141 1HE TYR 141 3.025 -18.276 -0.617 1090 HE2 TYR 141 2HE TYR 141 3.028 -16.450 3.238 1091 HH TYR 141 HH TYR 141 2.923 -18.886 2.705 1092 H CYS 142 HN CYS 142 3.436 -11.110 -2.352 1093 HA CYS 142 HA CYS 142 0.826 -10.114 -3.250 1094 HB2 CYS 142 2HB CYS 142 3.099 -8.555 -1.997 1095 HB3 CYS 142 1HB CYS 142 1.583 -7.870 -2.573 1096 HG CYS 142 HG CYS 142 0.725 -10.209 -0.527 1097 H LEU 143 HN LEU 143 0.787 -8.787 -5.048 1098 HA LEU 143 HA LEU 143 2.853 -9.272 -7.003 1099 HB2 LEU 143 2HB LEU 143 0.281 -7.702 -7.109 1100 HB3 LEU 143 1HB LEU 143 1.382 -7.811 -8.461 1101 HG LEU 143 HG LEU 143 1.053 -10.316 -8.337 1102 HD11 LEU 143 1HD1 LEU 143 0.103 -10.435 -6.087 1103 HD12 LEU 143 2HD1 LEU 143 -0.975 -11.139 -7.293 1104 HD13 LEU 143 3HD1 LEU 143 -1.307 -9.532 -6.645 1105 HD21 LEU 143 3HD2 LEU 143 -1.277 -8.549 -9.017 1106 HD22 LEU 143 1HD2 LEU 143 -1.078 -10.217 -9.554 1107 HD23 LEU 143 2HD2 LEU 143 0.064 -8.979 -10.079 1108 H VAL 144 HN VAL 144 3.945 -7.518 -8.154 1109 HA VAL 144 HA VAL 144 4.505 -5.286 -6.330 1110 HB VAL 144 HB VAL 144 6.402 -6.617 -8.276 1111 HG11 VAL 144 1HG1 VAL 144 6.847 -4.232 -8.001 1112 HG12 VAL 144 2HG1 VAL 144 8.118 -5.208 -7.261 1113 HG13 VAL 144 3HG1 VAL 144 6.894 -4.439 -6.250 1114 HG21 VAL 144 3HG2 VAL 144 6.328 -6.710 -5.261 1115 HG22 VAL 144 1HG2 VAL 144 7.563 -7.433 -6.290 1116 HG23 VAL 144 2HG2 VAL 144 5.905 -8.032 -6.349 1117 H TYR 145 HN TYR 145 3.771 -3.447 -7.065 1118 HA TYR 145 HA TYR 145 3.772 -2.958 -9.970 1119 HB2 TYR 145 2HB TYR 145 1.798 -2.258 -7.839 1120 HB3 TYR 145 1HB TYR 145 1.976 -1.176 -9.215 1121 HD1 TYR 145 2HD TYR 145 1.180 -4.683 -8.276 1122 HD2 TYR 145 1HD TYR 145 0.988 -1.676 -11.279 1123 HE1 TYR 145 2HE TYR 145 -0.298 -6.118 -9.617 1124 HE2 TYR 145 1HE TYR 145 -0.487 -3.105 -12.628 1125 HH TYR 145 HH TYR 145 -1.048 -5.420 -12.899 1126 H GLU 146 HN GLU 146 4.982 -1.367 -10.678 1127 HA GLU 146 HA GLU 146 6.259 0.404 -8.739 1128 HB2 GLU 146 2HB GLU 146 7.733 0.952 -10.761 1129 HB3 GLU 146 1HB GLU 146 7.884 -0.655 -10.062 1130 HG2 GLU 146 2HG GLU 146 6.393 -1.527 -11.820 1131 HG3 GLU 146 1HG GLU 146 6.342 0.081 -12.541 1132 H VAL 147 HN VAL 147 5.437 2.314 -8.444 1133 HA VAL 147 HA VAL 147 4.272 3.777 -10.713 1134 HB VAL 147 HB VAL 147 2.416 2.887 -9.389 1135 HG11 VAL 147 1HG1 VAL 147 3.505 2.597 -7.257 1136 HG12 VAL 147 2HG1 VAL 147 2.066 3.596 -7.054 1137 HG13 VAL 147 3HG1 VAL 147 3.667 4.342 -7.061 1138 HG21 VAL 147 3HG2 VAL 147 2.774 5.863 -9.026 1139 HG22 VAL 147 1HG2 VAL 147 1.243 4.995 -8.906 1140 HG23 VAL 147 2HG2 VAL 147 2.109 5.052 -10.441 1141 H LYS 148 HN LYS 148 4.696 5.954 -10.741 1142 HA LYS 148 HA LYS 148 6.414 6.960 -8.568 1143 HB2 LYS 148 2HB LYS 148 6.704 7.669 -11.492 1144 HB3 LYS 148 1HB LYS 148 7.779 8.124 -10.177 1145 HG2 LYS 148 2HG LYS 148 8.249 5.676 -9.851 1146 HG3 LYS 148 1HG LYS 148 7.366 5.388 -11.351 1147 HD2 LYS 148 2HD LYS 148 9.681 5.477 -11.896 1148 HD3 LYS 148 1HD LYS 148 8.956 6.979 -12.474 1149 HE2 LYS 148 2HE LYS 148 9.797 8.174 -10.554 1150 HE3 LYS 148 1HE LYS 148 10.401 6.681 -9.841 1151 HZ1 LYS 148 3HZ LYS 148 11.389 8.022 -12.302 1152 HZ2 LYS 148 1HZ LYS 148 11.880 6.469 -11.812 1153 HZ3 LYS 148 2HZ LYS 148 12.220 7.814 -10.833 1154 HA PRO 149 HA PRO 149 3.704 10.382 -8.012 1155 HB2 PRO 149 2HB PRO 149 6.127 12.107 -8.183 1156 HB3 PRO 149 1HB PRO 149 4.889 12.024 -6.923 1157 HG2 PRO 149 2HG PRO 149 7.291 10.944 -6.537 1158 HG3 PRO 149 1HG PRO 149 5.828 10.138 -5.948 1159 HD2 PRO 149 2HD PRO 149 7.521 9.495 -8.318 1160 HD3 PRO 149 1HD PRO 149 6.672 8.402 -7.206 Start of MODEL 10 1 H1 MET 1 H1 MET 1 28.369 19.292 54.034 2 H2 MET 1 H2 MET 1 27.944 20.607 55.014 3 H3 MET 1 H3 MET 1 29.123 20.791 53.813 4 HA MET 1 HA MET 1 26.262 20.195 53.345 5 HB2 MET 1 2HB MET 1 27.877 22.715 52.896 6 HB3 MET 1 1HB MET 1 26.229 22.473 52.336 7 HG2 MET 1 2HG MET 1 25.494 22.227 54.665 8 HG3 MET 1 1HG MET 1 27.147 22.515 55.201 9 HE1 MET 1 2HE MET 1 25.154 24.212 52.264 10 HE2 MET 1 3HE MET 1 24.515 25.648 53.070 11 HE3 MET 1 1HE MET 1 23.949 24.045 53.540 12 H GLY 2 HN GLY 2 25.753 19.553 51.316 13 HA2 GLY 2 2HA GLY 2 27.253 20.071 49.004 14 HA3 GLY 2 1HA GLY 2 27.789 18.529 49.654 15 H HIS 3 HN HIS 3 24.575 20.051 49.415 16 HA HIS 3 HA HIS 3 23.634 17.623 48.048 17 HB2 HIS 3 2HB HIS 3 22.059 19.839 49.391 18 HB3 HIS 3 1HB HIS 3 21.340 18.474 48.546 19 HD1 HIS 3 1HD HIS 3 20.459 18.699 51.328 20 HD2 HIS 3 2HD HIS 3 24.004 16.761 50.333 21 HE1 HIS 3 1HE HIS 3 20.971 17.181 53.263 22 HE2 HIS 3 2HE HIS 3 23.217 16.173 52.727 23 H HIS 4 HN HIS 4 24.241 17.967 45.962 24 HA HIS 4 HA HIS 4 23.377 20.505 44.724 25 HB2 HIS 4 2HB HIS 4 25.904 20.148 45.154 26 HB3 HIS 4 1HB HIS 4 25.820 18.982 43.839 27 HD1 HIS 4 1HD HIS 4 25.490 19.925 41.432 28 HD2 HIS 4 2HD HIS 4 25.709 22.824 44.413 29 HE1 HIS 4 1HE HIS 4 25.808 22.118 40.234 30 HE2 HIS 4 2HE HIS 4 26.059 23.844 42.062 31 H HIS 5 HN HIS 5 21.619 19.875 43.623 32 HA HIS 5 HA HIS 5 22.072 18.062 41.388 33 HB2 HIS 5 2HB HIS 5 21.080 16.614 43.105 34 HB3 HIS 5 1HB HIS 5 19.746 17.744 43.305 35 HD1 HIS 5 1HD HIS 5 21.057 15.086 40.998 36 HD2 HIS 5 2HD HIS 5 17.765 17.613 41.324 37 HE1 HIS 5 1HE HIS 5 19.390 14.256 39.314 38 HE2 HIS 5 2HE HIS 5 17.326 15.650 39.697 39 H HIS 6 HN HIS 6 21.445 19.042 39.613 40 HA HIS 6 HA HIS 6 19.451 21.203 39.835 41 HB2 HIS 6 2HB HIS 6 21.815 21.746 39.028 42 HB3 HIS 6 1HB HIS 6 21.428 20.823 37.581 43 HD1 HIS 6 1HD HIS 6 20.665 22.230 35.715 44 HD2 HIS 6 2HD HIS 6 19.728 23.909 39.404 45 HE1 HIS 6 1HE HIS 6 19.578 24.446 35.199 46 HE2 HIS 6 2HE HIS 6 18.890 25.377 37.444 47 H HIS 7 HN HIS 7 17.531 20.286 39.414 48 HA HIS 7 HA HIS 7 17.310 17.924 37.816 49 HB2 HIS 7 2HB HIS 7 14.921 18.009 38.336 50 HB3 HIS 7 1HB HIS 7 15.892 18.243 39.782 51 HD1 HIS 7 1HD HIS 7 15.570 20.365 41.076 52 HD2 HIS 7 2HD HIS 7 13.561 20.393 37.435 53 HE1 HIS 7 1HE HIS 7 14.080 22.388 41.139 54 HE2 HIS 7 2HE HIS 7 12.982 22.472 38.874 55 H HIS 8 HN HIS 8 15.811 17.624 36.076 56 HA HIS 8 HA HIS 8 15.401 20.016 34.393 57 HB2 HIS 8 2HB HIS 8 16.036 17.181 33.526 58 HB3 HIS 8 1HB HIS 8 15.540 18.463 32.431 59 HD1 HIS 8 1HD HIS 8 18.475 16.992 34.035 60 HD2 HIS 8 2HD HIS 8 17.488 20.615 32.242 61 HE1 HIS 8 1HE HIS 8 20.662 18.087 33.469 62 HE2 HIS 8 2HE HIS 8 20.052 20.311 32.455 63 H SER 9 HN SER 9 13.418 20.107 33.285 64 HA SER 9 HA SER 9 11.547 17.935 33.429 65 HB2 SER 9 2HB SER 9 9.807 19.358 34.641 66 HB3 SER 9 1HB SER 9 11.107 18.704 35.636 67 HG SER 9 HG SER 9 11.373 21.253 34.480 68 H HIS 10 HN HIS 10 11.172 18.026 31.277 69 HA HIS 10 HA HIS 10 9.758 20.426 30.346 70 HB2 HIS 10 2HB HIS 10 10.872 20.458 28.236 71 HB3 HIS 10 1HB HIS 10 12.132 20.381 29.459 72 HD1 HIS 10 1HD HIS 10 13.543 18.189 29.565 73 HD2 HIS 10 2HD HIS 10 10.697 18.272 26.533 74 HE1 HIS 10 1HE HIS 10 14.134 16.293 28.024 75 HE2 HIS 10 2HE HIS 10 12.484 16.451 26.126 76 H MET 11 HN MET 11 7.848 19.989 29.482 77 HA MET 11 HA MET 11 7.347 17.706 27.857 78 HB2 MET 11 2HB MET 11 5.606 16.674 29.268 79 HB3 MET 11 1HB MET 11 7.205 16.554 29.992 80 HG2 MET 11 2HG MET 11 6.677 18.379 31.501 81 HG3 MET 11 1HG MET 11 5.100 18.578 30.740 82 HE1 MET 11 3HE MET 11 4.025 15.683 30.277 83 HE2 MET 11 1HE MET 11 3.083 16.968 31.036 84 HE3 MET 11 2HE MET 11 3.192 15.383 31.802 85 H ASP 12 HN ASP 12 5.426 17.857 26.729 86 HA ASP 12 HA ASP 12 3.330 19.650 27.251 87 HB2 ASP 12 2HB ASP 12 3.745 21.451 25.712 88 HB3 ASP 12 1HB ASP 12 5.135 21.347 26.786 89 H TYR 13 HN TYR 13 1.679 19.357 25.805 90 HA TYR 13 HA TYR 13 2.199 17.997 23.294 91 HB2 TYR 13 2HB TYR 13 0.143 16.453 23.972 92 HB3 TYR 13 1HB TYR 13 1.798 16.010 24.374 93 HD1 TYR 13 1HD TYR 13 2.590 16.109 26.663 94 HD2 TYR 13 2HD TYR 13 -1.422 17.147 25.705 95 HE1 TYR 13 1HE TYR 13 1.995 15.964 29.039 96 HE2 TYR 13 2HE TYR 13 -2.029 17.010 28.085 97 HH TYR 13 HH TYR 13 -1.229 15.957 30.149 98 HA PRO 14 HA PRO 14 -0.962 21.265 22.884 99 HB2 PRO 14 2HB PRO 14 0.224 21.810 20.303 100 HB3 PRO 14 1HB PRO 14 0.185 22.836 21.737 101 HG2 PRO 14 2HG PRO 14 2.466 21.695 20.738 102 HG3 PRO 14 1HG PRO 14 2.249 22.157 22.435 103 HD2 PRO 14 2HD PRO 14 2.048 19.461 21.162 104 HD3 PRO 14 1HD PRO 14 2.722 19.918 22.741 105 H SER 15 HN SER 15 -2.814 20.152 22.464 106 HA SER 15 HA SER 15 -3.051 18.944 19.788 107 HB2 SER 15 2HB SER 15 -4.620 18.239 22.282 108 HB3 SER 15 1HB SER 15 -4.734 17.439 20.713 109 HG SER 15 HG SER 15 -2.411 17.561 22.355 110 H PHE 16 HN PHE 16 -3.729 20.781 18.727 111 HA PHE 16 HA PHE 16 -6.372 21.785 19.504 112 HB2 PHE 16 2HB PHE 16 -4.677 23.359 20.375 113 HB3 PHE 16 1HB PHE 16 -4.026 23.544 18.751 114 HD1 PHE 16 1HD PHE 16 -7.204 23.930 20.654 115 HD2 PHE 16 2HD PHE 16 -4.771 25.271 17.431 116 HE1 PHE 16 1HE PHE 16 -8.771 25.782 20.246 117 HE2 PHE 16 2HE PHE 16 -6.331 27.125 17.018 118 HZ PHE 16 HZ PHE 16 -8.333 27.381 18.425 119 H ASP 17 HN ASP 17 -7.715 21.643 17.893 120 HA ASP 17 HA ASP 17 -7.152 22.501 15.237 121 HB2 ASP 17 2HB ASP 17 -6.073 20.208 15.294 122 HB3 ASP 17 1HB ASP 17 -7.669 19.533 15.594 123 H LYS 18 HN LYS 18 -9.050 23.588 14.952 124 HA LYS 18 HA LYS 18 -11.369 22.680 16.426 125 HB2 LYS 18 2HB LYS 18 -12.430 24.783 15.744 126 HB3 LYS 18 1HB LYS 18 -10.878 25.042 16.520 127 HG2 LYS 18 2HG LYS 18 -9.843 25.603 14.468 128 HG3 LYS 18 1HG LYS 18 -11.232 25.033 13.535 129 HD2 LYS 18 2HD LYS 18 -12.612 26.805 14.450 130 HD3 LYS 18 1HD LYS 18 -11.285 27.342 15.479 131 HE2 LYS 18 2HE LYS 18 -11.108 27.277 12.475 132 HE3 LYS 18 1HE LYS 18 -11.688 28.680 13.371 133 HZ1 LYS 18 3HZ LYS 18 -8.995 27.442 13.568 134 HZ2 LYS 18 1HZ LYS 18 -9.547 28.701 14.563 135 HZ3 LYS 18 2HZ LYS 18 -9.379 28.951 12.895 136 H PHE 19 HN PHE 19 -13.570 22.993 15.271 137 HA PHE 19 HA PHE 19 -13.919 22.150 12.629 138 HB2 PHE 19 2HB PHE 19 -12.670 20.148 13.583 139 HB3 PHE 19 1HB PHE 19 -14.020 19.904 14.666 140 HD1 PHE 19 1HD PHE 19 -16.382 20.057 13.106 141 HD2 PHE 19 2HD PHE 19 -12.562 18.562 11.969 142 HE1 PHE 19 1HE PHE 19 -17.451 18.598 11.438 143 HE2 PHE 19 2HE PHE 19 -13.624 17.109 10.296 144 HZ PHE 19 HZ PHE 19 -16.072 17.124 10.028 145 H LEU 20 HN LEU 20 -16.830 23.385 14.335 146 HA LEU 20 HA LEU 20 -16.635 24.412 12.252 147 HB2 LEU 20 2HB LEU 20 -14.430 25.170 14.113 148 HB3 LEU 20 1HB LEU 20 -14.776 26.052 12.646 149 HG LEU 20 HG LEU 20 -16.593 25.710 15.020 150 HD11 LEU 20 1HD1 LEU 20 -16.462 28.149 15.117 151 HD12 LEU 20 2HD1 LEU 20 -15.343 28.142 13.755 152 HD13 LEU 20 3HD1 LEU 20 -14.871 27.405 15.287 153 HD21 LEU 20 3HD2 LEU 20 -17.178 26.998 12.356 154 HD22 LEU 20 1HD2 LEU 20 -18.212 27.081 13.782 155 HD23 LEU 20 2HD2 LEU 20 -17.921 25.530 12.992 156 H GLY 21 HN GLY 21 -16.255 23.028 10.554 157 HA2 GLY 21 2HA GLY 21 -14.550 23.503 8.682 158 HA3 GLY 21 1HA GLY 21 -13.434 22.700 9.776 159 H THR 22 HN THR 22 -15.983 22.296 7.485 160 HA THR 22 HA THR 22 -15.609 19.409 7.620 161 HB THR 22 HB THR 22 -17.487 19.623 9.042 162 HG1 THR 22 1HG THR 22 -19.238 18.895 7.346 163 HG21 THR 22 3HG2 THR 22 -19.536 20.824 8.423 164 HG22 THR 22 1HG2 THR 22 -18.758 21.382 6.941 165 HG23 THR 22 2HG2 THR 22 -18.150 21.909 8.511 166 H GLU 23 HN GLU 23 -15.208 18.691 5.713 167 HA GLU 23 HA GLU 23 -16.866 19.427 3.467 168 HB2 GLU 23 2HB GLU 23 -15.003 21.078 3.394 169 HB3 GLU 23 1HB GLU 23 -13.865 19.741 3.280 170 HG2 GLU 23 2HG GLU 23 -14.690 19.101 1.158 171 HG3 GLU 23 1HG GLU 23 -16.081 20.173 1.299 172 H ASN 24 HN ASN 24 -17.470 17.562 2.660 173 HA ASN 24 HA ASN 24 -15.952 15.169 3.375 174 HB2 ASN 24 2HB ASN 24 -18.729 15.563 2.242 175 HB3 ASN 24 1HB ASN 24 -18.007 13.980 2.494 176 HD21 ASN 24 1HD2 ASN 24 -17.542 16.704 4.660 177 HD22 ASN 24 2HD2 ASN 24 -18.441 16.047 5.980 178 H ALA 25 HN ALA 25 -15.887 17.290 0.946 179 HA ALA 25 HA ALA 25 -15.947 15.664 -1.377 180 HB1 ALA 25 1HB ALA 25 -14.633 18.341 -0.929 181 HB2 ALA 25 2HB ALA 25 -16.279 18.067 -1.503 182 HB3 ALA 25 3HB ALA 25 -14.905 17.581 -2.496 183 H GLU 26 HN GLU 26 -13.572 16.194 1.058 184 HA GLU 26 HA GLU 26 -11.185 15.820 -0.279 185 HB2 GLU 26 2HB GLU 26 -11.922 14.728 2.442 186 HB3 GLU 26 1HB GLU 26 -10.286 14.912 1.829 187 HG2 GLU 26 2HG GLU 26 -10.680 17.358 1.677 188 HG3 GLU 26 1HG GLU 26 -12.246 17.109 2.448 189 H LEU 27 HN LEU 27 -13.372 13.369 0.996 190 HA LEU 27 HA LEU 27 -11.786 11.139 0.410 191 HB2 LEU 27 2HB LEU 27 -13.634 11.161 2.030 192 HB3 LEU 27 1HB LEU 27 -14.779 11.380 0.719 193 HG LEU 27 HG LEU 27 -13.995 9.191 -0.197 194 HD11 LEU 27 1HD1 LEU 27 -11.863 9.045 0.948 195 HD12 LEU 27 2HD1 LEU 27 -12.871 7.658 1.356 196 HD13 LEU 27 3HD1 LEU 27 -12.686 8.981 2.507 197 HD21 LEU 27 3HD2 LEU 27 -15.313 7.857 1.406 198 HD22 LEU 27 1HD2 LEU 27 -16.103 9.376 0.981 199 HD23 LEU 27 2HD2 LEU 27 -15.276 9.215 2.530 200 H VAL 28 HN VAL 28 -14.184 12.909 -1.451 201 HA VAL 28 HA VAL 28 -14.472 10.963 -3.521 202 HB VAL 28 HB VAL 28 -15.087 13.921 -3.644 203 HG11 VAL 28 1HG1 VAL 28 -16.178 11.608 -5.244 204 HG12 VAL 28 2HG1 VAL 28 -15.050 12.832 -5.827 205 HG13 VAL 28 3HG1 VAL 28 -16.691 13.291 -5.373 206 HG21 VAL 28 3HG2 VAL 28 -16.820 11.627 -2.739 207 HG22 VAL 28 1HG2 VAL 28 -17.383 13.275 -3.023 208 HG23 VAL 28 2HG2 VAL 28 -16.214 12.950 -1.743 209 H TYR 29 HN TYR 29 -12.438 13.750 -2.982 210 HA TYR 29 HA TYR 29 -11.319 13.809 -5.610 211 HB2 TYR 29 2HB TYR 29 -11.403 15.760 -4.030 212 HB3 TYR 29 1HB TYR 29 -10.185 14.958 -3.049 213 HD1 TYR 29 2HD TYR 29 -10.800 16.359 -6.432 214 HD2 TYR 29 1HD TYR 29 -7.913 15.243 -3.518 215 HE1 TYR 29 2HE TYR 29 -9.040 17.418 -7.781 216 HE2 TYR 29 1HE TYR 29 -6.147 16.305 -4.855 217 HH TYR 29 HH TYR 29 -5.717 16.946 -7.171 218 H VAL 30 HN VAL 30 -10.774 11.965 -2.782 219 HA VAL 30 HA VAL 30 -8.025 11.356 -3.257 220 HB VAL 30 HB VAL 30 -10.063 10.215 -1.357 221 HG11 VAL 30 1HG1 VAL 30 -7.152 9.453 -1.606 222 HG12 VAL 30 2HG1 VAL 30 -8.529 8.412 -1.966 223 HG13 VAL 30 3HG1 VAL 30 -8.241 8.952 -0.312 224 HG21 VAL 30 3HG2 VAL 30 -7.568 11.860 -0.936 225 HG22 VAL 30 1HG2 VAL 30 -8.653 11.283 0.329 226 HG23 VAL 30 2HG2 VAL 30 -9.227 12.456 -0.857 227 H LEU 31 HN LEU 31 -11.060 9.490 -3.756 228 HA LEU 31 HA LEU 31 -9.541 7.113 -4.236 229 HB2 LEU 31 2HB LEU 31 -11.533 5.934 -4.417 230 HB3 LEU 31 1HB LEU 31 -11.861 7.185 -3.240 231 HG LEU 31 HG LEU 31 -12.678 7.441 -6.127 232 HD11 LEU 31 1HD1 LEU 31 -14.895 6.683 -5.430 233 HD12 LEU 31 2HD1 LEU 31 -14.271 6.339 -3.817 234 HD13 LEU 31 3HD1 LEU 31 -13.686 5.419 -5.202 235 HD21 LEU 31 3HD2 LEU 31 -12.608 9.507 -4.795 236 HD22 LEU 31 1HD2 LEU 31 -13.678 8.764 -3.608 237 HD23 LEU 31 2HD2 LEU 31 -14.256 9.068 -5.246 238 H ARG 32 HN ARG 32 -9.376 5.874 -6.051 239 HA ARG 32 HA ARG 32 -9.891 7.210 -8.626 240 HB2 ARG 32 2HB ARG 32 -7.379 6.100 -7.533 241 HB3 ARG 32 1HB ARG 32 -7.736 5.665 -9.195 242 HG2 ARG 32 2HG ARG 32 -7.645 8.488 -8.168 243 HG3 ARG 32 1HG ARG 32 -6.295 7.664 -8.951 244 HD2 ARG 32 2HD ARG 32 -8.056 7.210 -10.831 245 HD3 ARG 32 1HD ARG 32 -8.891 8.583 -10.104 246 HE ARG 32 HE ARG 32 -6.334 9.471 -10.445 247 HH11 ARG 32 1HH1 ARG 32 -8.785 8.110 -12.548 248 HH12 ARG 32 2HH1 ARG 32 -8.180 8.901 -13.975 249 HH21 ARG 32 1HH2 ARG 32 -5.530 10.499 -12.318 250 HH22 ARG 32 2HH2 ARG 32 -6.318 10.250 -13.849 251 H HIS 33 HN HIS 33 -8.407 4.082 -7.956 252 HA HIS 33 HA HIS 33 -10.772 2.613 -8.765 253 HB2 HIS 33 2HB HIS 33 -8.612 3.240 -10.625 254 HB3 HIS 33 1HB HIS 33 -8.845 1.506 -10.445 255 HD1 HIS 33 1HD HIS 33 -10.459 0.563 -12.048 256 HD2 HIS 33 2HD HIS 33 -11.294 4.544 -11.182 257 HE1 HIS 33 1HE HIS 33 -12.472 1.155 -13.440 258 HE2 HIS 33 2HE HIS 33 -13.048 3.522 -12.781 259 H LYS 34 HN LYS 34 -9.521 0.193 -9.358 260 HA LYS 34 HA LYS 34 -8.022 -0.396 -6.886 261 HB2 LYS 34 2HB LYS 34 -9.105 -2.553 -6.783 262 HB3 LYS 34 1HB LYS 34 -10.345 -1.314 -6.892 263 HG2 LYS 34 2HG LYS 34 -10.508 -1.779 -9.334 264 HG3 LYS 34 1HG LYS 34 -9.391 -3.123 -9.103 265 HD2 LYS 34 2HD LYS 34 -11.566 -4.055 -9.071 266 HD3 LYS 34 1HD LYS 34 -11.022 -4.019 -7.393 267 HE2 LYS 34 2HE LYS 34 -12.299 -1.984 -7.007 268 HE3 LYS 34 1HE LYS 34 -12.807 -1.968 -8.693 269 HZ1 LYS 34 3HZ LYS 34 -14.563 -2.877 -7.403 270 HZ2 LYS 34 1HZ LYS 34 -13.528 -3.974 -6.627 271 HZ3 LYS 34 2HZ LYS 34 -13.875 -4.157 -8.278 272 H HIS 35 HN HIS 35 -7.143 -2.940 -7.432 273 HA HIS 35 HA HIS 35 -6.100 -3.005 -10.130 274 HB2 HIS 35 2HB HIS 35 -4.559 -1.568 -8.553 275 HB3 HIS 35 1HB HIS 35 -4.017 -3.143 -7.984 276 HD1 HIS 35 1HD HIS 35 -2.904 -0.695 -10.168 277 HD2 HIS 35 2HD HIS 35 -3.497 -4.789 -10.626 278 HE1 HIS 35 1HE HIS 35 -1.468 -1.379 -12.111 279 HE2 HIS 35 2HE HIS 35 -2.097 -3.772 -12.550 280 H GLY 36 HN GLY 36 -6.244 -4.478 -6.920 281 HA2 GLY 36 2HA GLY 36 -6.898 -7.013 -7.918 282 HA3 GLY 36 1HA GLY 36 -5.167 -6.979 -7.615 283 H GLN 37 HN GLN 37 -5.579 -8.650 -6.054 284 HA GLN 37 HA GLN 37 -6.964 -7.789 -3.622 285 HB2 GLN 37 2HB GLN 37 -7.661 -9.942 -4.478 286 HB3 GLN 37 1HB GLN 37 -5.997 -10.507 -4.520 287 HG2 GLN 37 2HG GLN 37 -5.892 -10.348 -2.075 288 HG3 GLN 37 1HG GLN 37 -7.571 -9.815 -2.048 289 HE21 GLN 37 1HE2 GLN 37 -8.151 -11.550 -0.768 290 HE22 GLN 37 2HE2 GLN 37 -8.306 -13.153 -1.407 291 H PHE 38 HN PHE 38 -3.902 -9.259 -4.656 292 HA PHE 38 HA PHE 38 -2.630 -8.003 -2.312 293 HB2 PHE 38 2HB PHE 38 -1.944 -10.654 -3.604 294 HB3 PHE 38 1HB PHE 38 -0.945 -9.858 -2.395 295 HD1 PHE 38 2HD PHE 38 -2.116 -9.311 -0.146 296 HD2 PHE 38 1HD PHE 38 -3.533 -12.179 -2.946 297 HE1 PHE 38 2HE PHE 38 -3.392 -10.419 1.640 298 HE2 PHE 38 1HE PHE 38 -4.812 -13.294 -1.166 299 HZ PHE 38 HZ PHE 38 -4.743 -12.415 1.130 300 H ILE 39 HN ILE 39 -1.937 -6.169 -3.372 301 HA ILE 39 HA ILE 39 -0.228 -6.620 -5.732 302 HB ILE 39 HB ILE 39 -2.056 -4.260 -5.252 303 HG12 ILE 39 2HG1 ILE 39 -3.272 -6.299 -5.908 304 HG13 ILE 39 1HG1 ILE 39 -3.318 -5.091 -7.182 305 HG21 ILE 39 1HG2 ILE 39 0.020 -3.639 -6.392 306 HG22 ILE 39 2HG2 ILE 39 -1.376 -3.499 -7.459 307 HG23 ILE 39 3HG2 ILE 39 -0.282 -4.875 -7.614 308 HD11 ILE 39 3HD1 ILE 39 -1.529 -7.498 -7.096 309 HD12 ILE 39 1HD1 ILE 39 -1.544 -6.280 -8.370 310 HD13 ILE 39 2HD1 ILE 39 -2.963 -7.297 -8.103 311 H TYR 40 HN TYR 40 1.787 -6.035 -5.456 312 HA TYR 40 HA TYR 40 2.427 -3.889 -3.550 313 HB2 TYR 40 2HB TYR 40 3.535 -6.114 -3.206 314 HB3 TYR 40 1HB TYR 40 4.290 -5.933 -4.785 315 HD1 TYR 40 1HD TYR 40 5.985 -4.123 -5.139 316 HD2 TYR 40 2HD TYR 40 4.394 -5.002 -1.295 317 HE1 TYR 40 1HE TYR 40 7.853 -2.908 -4.093 318 HE2 TYR 40 2HE TYR 40 6.251 -3.791 -0.240 319 HH TYR 40 HH TYR 40 8.428 -3.015 -0.669 320 H VAL 41 HN VAL 41 2.718 -1.973 -4.472 321 HA VAL 41 HA VAL 41 3.848 -1.894 -7.192 322 HB VAL 41 HB VAL 41 2.476 0.272 -7.455 323 HG11 VAL 41 1HG1 VAL 41 1.076 -2.395 -7.385 324 HG12 VAL 41 2HG1 VAL 41 2.050 -1.766 -8.714 325 HG13 VAL 41 3HG1 VAL 41 0.538 -0.970 -8.275 326 HG21 VAL 41 3HG2 VAL 41 0.361 0.327 -6.203 327 HG22 VAL 41 1HG2 VAL 41 1.754 0.504 -5.136 328 HG23 VAL 41 2HG2 VAL 41 0.908 -1.039 -5.230 329 H TRP 42 HN TRP 42 5.877 -1.249 -6.855 330 HA TRP 42 HA TRP 42 6.451 0.724 -4.816 331 HB2 TRP 42 2HB TRP 42 8.837 0.331 -5.436 332 HB3 TRP 42 1HB TRP 42 7.985 -1.117 -4.922 333 HD1 TRP 42 1HD TRP 42 7.080 -2.697 -7.130 334 HE1 TRP 42 1HE TRP 42 8.426 -3.295 -9.239 335 HE3 TRP 42 3HE TRP 42 10.578 1.022 -6.940 336 HZ2 TRP 42 2HZ TRP 42 10.683 -2.331 -10.627 337 HZ3 TRP 42 3HZ TRP 42 12.305 1.110 -8.692 338 HH2 TRP 42 2HH TRP 42 12.353 -0.533 -10.495 339 H GLY 43 HN GLY 43 6.405 2.790 -5.170 340 HA2 GLY 43 2HA GLY 43 7.603 4.113 -7.331 341 HA3 GLY 43 1HA GLY 43 5.886 3.938 -7.675 342 H GLU 44 HN GLU 44 6.117 6.353 -7.613 343 HA GLU 44 HA GLU 44 5.719 8.365 -6.667 344 HB2 GLU 44 2HB GLU 44 4.578 6.633 -4.473 345 HB3 GLU 44 1HB GLU 44 4.453 8.387 -4.488 346 HG2 GLU 44 2HG GLU 44 3.321 8.185 -6.717 347 HG3 GLU 44 1HG GLU 44 3.273 6.444 -6.451 348 H GLU 45 HN GLU 45 5.870 9.288 -4.027 349 HA GLU 45 HA GLU 45 8.274 8.467 -2.757 350 HB2 GLU 45 2HB GLU 45 9.218 9.604 -4.766 351 HB3 GLU 45 1HB GLU 45 8.419 11.087 -4.260 352 HG2 GLU 45 2HG GLU 45 9.722 10.938 -2.121 353 HG3 GLU 45 1HG GLU 45 10.641 9.628 -2.861 354 H GLY 46 HN GLY 46 7.204 11.806 -3.193 355 HA2 GLY 46 2HA GLY 46 5.952 11.780 -0.549 356 HA3 GLY 46 1HA GLY 46 7.344 12.827 -0.781 357 H ALA 47 HN ALA 47 5.989 14.611 -0.287 358 HA ALA 47 HA ALA 47 4.701 16.419 -0.742 359 HB1 ALA 47 1HB ALA 47 4.729 15.442 -3.600 360 HB2 ALA 47 2HB ALA 47 5.919 16.519 -2.868 361 HB3 ALA 47 3HB ALA 47 4.247 17.049 -3.050 362 H GLY 48 HN GLY 48 3.300 14.228 -3.139 363 HA2 GLY 48 2HA GLY 48 0.830 14.150 -1.521 364 HA3 GLY 48 1HA GLY 48 0.876 13.968 -3.275 365 H LYS 49 HN LYS 49 2.632 12.539 -0.545 366 HA LYS 49 HA LYS 49 3.207 10.140 -1.879 367 HB2 LYS 49 2HB LYS 49 4.013 9.325 0.254 368 HB3 LYS 49 1HB LYS 49 4.508 10.998 0.036 369 HG2 LYS 49 2HG LYS 49 2.759 11.744 1.528 370 HG3 LYS 49 1HG LYS 49 2.162 10.093 1.694 371 HD2 LYS 49 2HD LYS 49 4.875 11.100 2.545 372 HD3 LYS 49 1HD LYS 49 3.519 10.743 3.614 373 HE2 LYS 49 2HE LYS 49 4.917 8.744 1.837 374 HE3 LYS 49 1HE LYS 49 5.189 8.932 3.567 375 HZ1 LYS 49 3HZ LYS 49 2.885 8.326 3.970 376 HZ2 LYS 49 1HZ LYS 49 3.679 7.105 3.098 377 HZ3 LYS 49 2HZ LYS 49 2.612 8.153 2.304 378 H SER 50 HN SER 50 2.457 8.051 -1.596 379 HA SER 50 HA SER 50 0.945 6.377 -1.340 380 HB2 SER 50 2HB SER 50 -0.388 8.032 0.808 381 HB3 SER 50 1HB SER 50 -0.323 6.275 0.668 382 HG SER 50 HG SER 50 1.850 6.314 1.205 383 H HIS 51 HN HIS 51 0.541 8.402 -3.240 384 HA HIS 51 HA HIS 51 -2.063 9.548 -3.116 385 HB2 HIS 51 2HB HIS 51 -0.061 10.428 -4.384 386 HB3 HIS 51 1HB HIS 51 -0.350 9.161 -5.570 387 HD1 HIS 51 1HD HIS 51 -1.317 10.253 -7.558 388 HD2 HIS 51 2HD HIS 51 -2.898 11.767 -4.024 389 HE1 HIS 51 1HE HIS 51 -3.063 11.932 -8.255 390 HE2 HIS 51 2HE HIS 51 -3.812 13.006 -6.098 391 H LEU 52 HN LEU 52 -0.703 6.972 -5.194 392 HA LEU 52 HA LEU 52 -3.263 6.163 -6.155 393 HB2 LEU 52 2HB LEU 52 -0.647 4.662 -6.093 394 HB3 LEU 52 1HB LEU 52 -2.076 4.150 -6.971 395 HG LEU 52 HG LEU 52 -0.491 6.666 -7.506 396 HD11 LEU 52 1HD1 LEU 52 -0.716 4.104 -9.080 397 HD12 LEU 52 2HD1 LEU 52 0.697 4.645 -8.171 398 HD13 LEU 52 3HD1 LEU 52 0.153 5.555 -9.581 399 HD21 LEU 52 3HD2 LEU 52 -2.856 6.980 -8.001 400 HD22 LEU 52 1HD2 LEU 52 -2.863 5.500 -8.963 401 HD23 LEU 52 2HD2 LEU 52 -1.912 6.888 -9.489 402 H LEU 53 HN LEU 53 -1.398 5.425 -3.349 403 HA LEU 53 HA LEU 53 -2.605 2.966 -2.634 404 HB2 LEU 53 2HB LEU 53 -0.457 3.808 -1.725 405 HB3 LEU 53 1HB LEU 53 -1.335 5.053 -0.857 406 HG LEU 53 HG LEU 53 -2.539 3.216 0.379 407 HD11 LEU 53 1HD1 LEU 53 -0.417 1.505 -0.909 408 HD12 LEU 53 2HD1 LEU 53 -2.154 1.408 -1.196 409 HD13 LEU 53 3HD1 LEU 53 -1.499 1.003 0.390 410 HD21 LEU 53 3HD2 LEU 53 0.461 3.371 0.648 411 HD22 LEU 53 1HD2 LEU 53 -0.647 2.746 1.871 412 HD23 LEU 53 2HD2 LEU 53 -0.719 4.443 1.401 413 H GLN 54 HN GLN 54 -3.205 6.301 -1.538 414 HA GLN 54 HA GLN 54 -5.376 5.642 0.162 415 HB2 GLN 54 2HB GLN 54 -5.804 8.048 0.231 416 HB3 GLN 54 1HB GLN 54 -4.090 7.714 0.393 417 HG2 GLN 54 2HG GLN 54 -3.797 8.247 -1.997 418 HG3 GLN 54 1HG GLN 54 -5.501 8.693 -2.067 419 HE21 GLN 54 1HE2 GLN 54 -2.362 9.550 -0.859 420 HE22 GLN 54 2HE2 GLN 54 -2.752 11.176 -0.419 421 H ALA 55 HN ALA 55 -5.100 6.511 -3.179 422 HA ALA 55 HA ALA 55 -7.765 7.026 -3.824 423 HB1 ALA 55 1HB ALA 55 -5.654 5.747 -5.555 424 HB2 ALA 55 2HB ALA 55 -5.872 7.478 -5.307 425 HB3 ALA 55 3HB ALA 55 -7.126 6.542 -6.121 426 H TRP 56 HN TRP 56 -6.093 4.005 -3.347 427 HA TRP 56 HA TRP 56 -8.205 2.371 -4.432 428 HB2 TRP 56 2HB TRP 56 -5.927 1.578 -4.542 429 HB3 TRP 56 1HB TRP 56 -5.743 1.730 -2.802 430 HD1 TRP 56 1HD TRP 56 -7.700 -0.421 -5.367 431 HE1 TRP 56 1HE TRP 56 -8.090 -2.742 -4.312 432 HE3 TRP 56 3HE TRP 56 -5.789 0.465 -0.710 433 HZ2 TRP 56 2HZ TRP 56 -7.641 -4.023 -1.842 434 HZ3 TRP 56 3HZ TRP 56 -5.808 -1.358 0.941 435 HH2 TRP 56 2HH TRP 56 -6.717 -3.553 0.385 436 H VAL 57 HN VAL 57 -7.063 3.335 -1.242 437 HA VAL 57 HA VAL 57 -8.716 1.711 0.326 438 HB VAL 57 HB VAL 57 -7.731 4.488 1.002 439 HG11 VAL 57 1HG1 VAL 57 -9.457 3.662 2.528 440 HG12 VAL 57 2HG1 VAL 57 -7.886 3.760 3.323 441 HG13 VAL 57 3HG1 VAL 57 -8.515 2.197 2.801 442 HG21 VAL 57 3HG2 VAL 57 -5.911 3.033 0.273 443 HG22 VAL 57 1HG2 VAL 57 -6.405 1.820 1.452 444 HG23 VAL 57 2HG2 VAL 57 -5.803 3.387 1.997 445 H ALA 58 HN ALA 58 -9.203 5.075 -0.747 446 HA ALA 58 HA ALA 58 -11.736 5.402 0.460 447 HB1 ALA 58 1HB ALA 58 -11.944 7.388 -0.935 448 HB2 ALA 58 2HB ALA 58 -10.585 6.853 -1.924 449 HB3 ALA 58 3HB ALA 58 -10.330 7.288 -0.233 450 H GLN 59 HN GLN 59 -10.719 4.065 -2.594 451 HA GLN 59 HA GLN 59 -13.208 4.054 -3.918 452 HB2 GLN 59 2HB GLN 59 -11.128 3.723 -5.126 453 HB3 GLN 59 1HB GLN 59 -10.782 2.266 -4.210 454 HG2 GLN 59 2HG GLN 59 -13.268 2.413 -5.843 455 HG3 GLN 59 1HG GLN 59 -11.720 2.133 -6.637 456 HE21 GLN 59 1HE2 GLN 59 -10.678 0.674 -4.288 457 HE22 GLN 59 2HE2 GLN 59 -11.431 -0.880 -4.346 458 H ALA 60 HN ALA 60 -11.636 1.782 -1.739 459 HA ALA 60 HA ALA 60 -13.654 -0.234 -1.959 460 HB1 ALA 60 1HB ALA 60 -12.502 -1.304 -0.106 461 HB2 ALA 60 2HB ALA 60 -11.545 0.152 0.159 462 HB3 ALA 60 3HB ALA 60 -11.349 -0.774 -1.330 463 H LEU 61 HN LEU 61 -13.127 2.553 0.046 464 HA LEU 61 HA LEU 61 -14.908 1.934 2.132 465 HB2 LEU 61 2HB LEU 61 -13.977 4.580 1.023 466 HB3 LEU 61 1HB LEU 61 -14.973 4.438 2.460 467 HG LEU 61 HG LEU 61 -12.207 3.262 2.142 468 HD11 LEU 61 1HD1 LEU 61 -12.180 5.706 2.241 469 HD12 LEU 61 2HD1 LEU 61 -11.500 4.991 3.702 470 HD13 LEU 61 3HD1 LEU 61 -13.134 5.658 3.724 471 HD21 LEU 61 3HD2 LEU 61 -12.373 2.847 4.552 472 HD22 LEU 61 1HD2 LEU 61 -13.595 1.957 3.646 473 HD23 LEU 61 2HD2 LEU 61 -14.042 3.417 4.531 474 H GLU 62 HN GLU 62 -15.423 3.804 -0.869 475 HA GLU 62 HA GLU 62 -18.208 4.138 -0.269 476 HB2 GLU 62 2HB GLU 62 -16.703 4.646 -2.826 477 HB3 GLU 62 1HB GLU 62 -18.390 5.072 -2.544 478 HG2 GLU 62 2HG GLU 62 -17.488 6.330 -0.491 479 HG3 GLU 62 1HG GLU 62 -15.936 6.201 -1.309 480 H ALA 63 HN ALA 63 -16.354 1.667 -1.590 481 HA ALA 63 HA ALA 63 -18.395 0.418 -3.160 482 HB1 ALA 63 1HB ALA 63 -16.930 -1.530 -3.171 483 HB2 ALA 63 2HB ALA 63 -15.918 -0.787 -1.932 484 HB3 ALA 63 3HB ALA 63 -16.024 -0.062 -3.536 485 H GLY 64 HN GLY 64 -18.018 0.890 0.128 486 HA2 GLY 64 2HA GLY 64 -19.696 0.311 1.683 487 HA3 GLY 64 1HA GLY 64 -20.167 -1.025 0.643 488 H LYS 65 HN LYS 65 -16.831 -0.848 1.023 489 HA LYS 65 HA LYS 65 -16.906 -3.224 2.717 490 HB2 LYS 65 2HB LYS 65 -14.511 -2.070 1.287 491 HB3 LYS 65 1HB LYS 65 -14.721 -3.707 1.885 492 HG2 LYS 65 2HG LYS 65 -16.285 -2.498 -0.384 493 HG3 LYS 65 1HG LYS 65 -14.856 -3.512 -0.573 494 HD2 LYS 65 2HD LYS 65 -16.013 -5.353 0.544 495 HD3 LYS 65 1HD LYS 65 -17.443 -4.337 0.745 496 HE2 LYS 65 2HE LYS 65 -17.623 -4.126 -1.693 497 HE3 LYS 65 1HE LYS 65 -16.209 -5.164 -1.881 498 HZ1 LYS 65 3HZ LYS 65 -17.393 -6.987 -0.960 499 HZ2 LYS 65 1HZ LYS 65 -18.381 -6.307 -2.155 500 HZ3 LYS 65 2HZ LYS 65 -18.704 -6.012 -0.516 501 H ASN 66 HN ASN 66 -14.765 -3.342 4.103 502 HA ASN 66 HA ASN 66 -14.483 -0.805 5.567 503 HB2 ASN 66 2HB ASN 66 -15.181 -2.915 6.832 504 HB3 ASN 66 1HB ASN 66 -13.571 -3.537 6.507 505 HD21 ASN 66 1HD2 ASN 66 -14.738 -3.061 9.067 506 HD22 ASN 66 2HD2 ASN 66 -13.769 -1.865 9.861 507 H ALA 67 HN ALA 67 -12.526 0.183 5.624 508 HA ALA 67 HA ALA 67 -10.181 -1.200 4.604 509 HB1 ALA 67 1HB ALA 67 -11.215 1.321 3.304 510 HB2 ALA 67 2HB ALA 67 -11.264 -0.292 2.593 511 HB3 ALA 67 3HB ALA 67 -9.712 0.484 2.911 512 H ALA 68 HN ALA 68 -8.290 -0.386 5.361 513 HA ALA 68 HA ALA 68 -8.373 2.114 6.891 514 HB1 ALA 68 1HB ALA 68 -8.684 0.261 8.477 515 HB2 ALA 68 2HB ALA 68 -7.167 1.121 8.743 516 HB3 ALA 68 3HB ALA 68 -7.164 -0.445 7.931 517 H TYR 69 HN TYR 69 -6.701 3.386 6.486 518 HA TYR 69 HA TYR 69 -4.388 2.240 5.094 519 HB2 TYR 69 2HB TYR 69 -4.002 4.484 4.153 520 HB3 TYR 69 1HB TYR 69 -5.589 3.868 3.722 521 HD1 TYR 69 1HD TYR 69 -7.621 4.830 4.815 522 HD2 TYR 69 2HD TYR 69 -3.743 6.487 5.414 523 HE1 TYR 69 1HE TYR 69 -8.643 6.912 5.636 524 HE2 TYR 69 2HE TYR 69 -4.754 8.569 6.242 525 HH TYR 69 HH TYR 69 -6.830 9.795 6.104 526 H ILE 70 HN ILE 70 -2.473 2.328 6.048 527 HA ILE 70 HA ILE 70 -2.197 4.062 8.416 528 HB ILE 70 HB ILE 70 -1.249 1.201 8.147 529 HG12 ILE 70 2HG1 ILE 70 -3.281 2.501 9.985 530 HG13 ILE 70 1HG1 ILE 70 -3.654 1.448 8.625 531 HG21 ILE 70 1HG2 ILE 70 -0.839 3.167 10.404 532 HG22 ILE 70 2HG2 ILE 70 0.410 2.534 9.331 533 HG23 ILE 70 3HG2 ILE 70 -0.419 1.454 10.451 534 HD11 ILE 70 3HD1 ILE 70 -2.194 0.677 11.128 535 HD12 ILE 70 1HD1 ILE 70 -2.496 -0.388 9.757 536 HD13 ILE 70 2HD1 ILE 70 -3.849 0.248 10.696 537 H ASP 71 HN ASP 71 -0.492 5.317 8.441 538 HA ASP 71 HA ASP 71 1.570 4.994 6.367 539 HB2 ASP 71 2HB ASP 71 0.259 7.147 6.481 540 HB3 ASP 71 1HB ASP 71 0.925 7.412 8.086 541 H ALA 72 HN ALA 72 3.269 3.868 7.159 542 HA ALA 72 HA ALA 72 3.634 3.338 9.879 543 HB1 ALA 72 1HB ALA 72 5.712 2.274 9.258 544 HB2 ALA 72 2HB ALA 72 5.682 3.080 7.689 545 HB3 ALA 72 3HB ALA 72 4.449 1.883 8.089 546 H ALA 73 HN ALA 73 4.799 5.999 7.988 547 HA ALA 73 HA ALA 73 6.764 6.682 10.034 548 HB1 ALA 73 1HB ALA 73 6.149 8.055 7.421 549 HB2 ALA 73 2HB ALA 73 7.453 6.899 7.702 550 HB3 ALA 73 3HB ALA 73 7.469 8.462 8.519 551 H SER 74 HN SER 74 3.629 6.932 10.001 552 HA SER 74 HA SER 74 3.673 9.492 11.446 553 HB2 SER 74 2HB SER 74 2.641 9.809 9.189 554 HB3 SER 74 1HB SER 74 1.425 8.602 9.616 555 HG SER 74 HG SER 74 1.527 11.226 10.241 556 H MET 75 HN MET 75 2.223 6.355 10.924 557 HA MET 75 HA MET 75 1.236 6.317 13.681 558 HB2 MET 75 2HB MET 75 -0.371 5.757 11.187 559 HB3 MET 75 1HB MET 75 -0.835 5.108 12.747 560 HG2 MET 75 2HG MET 75 -0.776 7.521 13.571 561 HG3 MET 75 1HG MET 75 -0.720 7.965 11.868 562 HE1 MET 75 3HE MET 75 -2.515 5.779 10.485 563 HE2 MET 75 1HE MET 75 -2.680 7.501 10.135 564 HE3 MET 75 2HE MET 75 -4.108 6.537 10.518 565 HA PRO 76 HA PRO 76 2.900 2.186 13.350 566 HB2 PRO 76 2HB PRO 76 2.105 1.225 15.724 567 HB3 PRO 76 1HB PRO 76 3.374 2.448 15.596 568 HG2 PRO 76 2HG PRO 76 0.503 2.766 16.352 569 HG3 PRO 76 1HG PRO 76 1.932 3.583 17.006 570 HD2 PRO 76 2HD PRO 76 0.198 4.659 15.135 571 HD3 PRO 76 1HD PRO 76 1.861 5.207 15.411 572 H LEU 77 HN LEU 77 2.159 -0.020 13.207 573 HA LEU 77 HA LEU 77 -0.492 -0.275 12.155 574 HB2 LEU 77 2HB LEU 77 1.443 -1.573 11.313 575 HB3 LEU 77 1HB LEU 77 1.535 -2.410 12.850 576 HG LEU 77 HG LEU 77 -0.691 -3.393 12.441 577 HD11 LEU 77 1HD1 LEU 77 -1.713 -3.201 10.231 578 HD12 LEU 77 2HD1 LEU 77 -0.480 -2.031 9.759 579 HD13 LEU 77 3HD1 LEU 77 -1.630 -1.634 11.036 580 HD21 LEU 77 3HD2 LEU 77 -0.005 -4.926 10.691 581 HD22 LEU 77 1HD2 LEU 77 1.341 -4.573 11.773 582 HD23 LEU 77 2HD2 LEU 77 1.261 -3.806 10.188 583 H THR 78 HN THR 78 -2.251 -1.384 13.090 584 HA THR 78 HA THR 78 -2.006 -1.821 15.976 585 HB THR 78 HB THR 78 -4.327 -0.776 16.153 586 HG1 THR 78 1HG THR 78 -3.803 0.838 13.976 587 HG21 THR 78 3HG2 THR 78 -1.984 0.978 15.407 588 HG22 THR 78 1HG2 THR 78 -2.336 0.336 17.010 589 HG23 THR 78 2HG2 THR 78 -3.424 1.512 16.273 590 H ASP 79 HN ASP 79 -3.689 -3.039 16.920 591 HA ASP 79 HA ASP 79 -4.358 -5.419 15.593 592 HB2 ASP 79 2HB ASP 79 -4.124 -5.237 18.015 593 HB3 ASP 79 1HB ASP 79 -5.519 -4.172 18.091 594 H ALA 80 HN ALA 80 -5.937 -2.370 15.699 595 HA ALA 80 HA ALA 80 -8.599 -3.079 15.218 596 HB1 ALA 80 1HB ALA 80 -7.910 -0.827 15.852 597 HB2 ALA 80 2HB ALA 80 -8.871 -0.810 14.373 598 HB3 ALA 80 3HB ALA 80 -7.120 -0.624 14.288 599 H ALA 81 HN ALA 81 -5.835 -3.130 13.150 600 HA ALA 81 HA ALA 81 -7.021 -2.808 10.637 601 HB1 ALA 81 1HB ALA 81 -5.020 -3.822 9.734 602 HB2 ALA 81 2HB ALA 81 -4.601 -4.470 11.321 603 HB3 ALA 81 3HB ALA 81 -4.600 -2.727 11.052 604 H PHE 82 HN PHE 82 -7.260 -5.438 12.825 605 HA PHE 82 HA PHE 82 -7.723 -7.465 10.851 606 HB2 PHE 82 2HB PHE 82 -8.031 -7.338 13.830 607 HB3 PHE 82 1HB PHE 82 -8.693 -8.694 12.924 608 HD1 PHE 82 1HD PHE 82 -7.190 -10.150 11.613 609 HD2 PHE 82 2HD PHE 82 -5.694 -7.150 14.238 610 HE1 PHE 82 1HE PHE 82 -4.984 -11.237 11.591 611 HE2 PHE 82 2HE PHE 82 -3.489 -8.240 14.226 612 HZ PHE 82 HZ PHE 82 -3.132 -10.282 12.899 613 H GLU 83 HN GLU 83 -9.617 -4.940 12.112 614 HA GLU 83 HA GLU 83 -12.139 -6.273 11.658 615 HB2 GLU 83 2HB GLU 83 -11.535 -3.372 12.209 616 HB3 GLU 83 1HB GLU 83 -13.129 -4.103 12.194 617 HG2 GLU 83 2HG GLU 83 -12.381 -5.608 14.028 618 HG3 GLU 83 1HG GLU 83 -10.890 -4.677 14.105 619 H ALA 84 HN ALA 84 -9.893 -4.391 9.891 620 HA ALA 84 HA ALA 84 -11.761 -3.574 7.844 621 HB1 ALA 84 1HB ALA 84 -8.757 -3.343 7.906 622 HB2 ALA 84 2HB ALA 84 -9.884 -2.124 8.500 623 HB3 ALA 84 3HB ALA 84 -9.850 -2.534 6.784 624 H GLU 85 HN GLU 85 -11.980 -4.425 5.875 625 HA GLU 85 HA GLU 85 -10.926 -7.088 5.399 626 HB2 GLU 85 2HB GLU 85 -13.312 -6.387 4.908 627 HB3 GLU 85 1HB GLU 85 -12.682 -5.411 3.593 628 HG2 GLU 85 2HG GLU 85 -13.489 -7.452 2.681 629 HG3 GLU 85 1HG GLU 85 -11.729 -7.476 2.595 630 H TYR 86 HN TYR 86 -10.644 -3.829 4.165 631 HA TYR 86 HA TYR 86 -8.545 -4.691 2.285 632 HB2 TYR 86 2HB TYR 86 -10.238 -2.179 2.353 633 HB3 TYR 86 1HB TYR 86 -8.898 -2.426 1.243 634 HD1 TYR 86 1HD TYR 86 -12.016 -4.227 2.301 635 HD2 TYR 86 2HD TYR 86 -9.438 -3.098 -0.886 636 HE1 TYR 86 1HE TYR 86 -13.552 -5.277 0.691 637 HE2 TYR 86 2HE TYR 86 -10.965 -4.142 -2.500 638 HH TYR 86 HH TYR 86 -12.717 -5.992 -2.445 639 H LEU 87 HN LEU 87 -6.541 -4.435 3.063 640 HA LEU 87 HA LEU 87 -6.075 -2.214 4.938 641 HB2 LEU 87 2HB LEU 87 -4.768 -4.904 4.681 642 HB3 LEU 87 1HB LEU 87 -3.965 -3.584 5.506 643 HG LEU 87 HG LEU 87 -4.978 -4.904 7.179 644 HD11 LEU 87 1HD1 LEU 87 -6.610 -3.374 8.188 645 HD12 LEU 87 2HD1 LEU 87 -6.729 -2.509 6.656 646 HD13 LEU 87 3HD1 LEU 87 -5.205 -2.523 7.541 647 HD21 LEU 87 3HD2 LEU 87 -7.544 -4.753 5.603 648 HD22 LEU 87 1HD2 LEU 87 -7.355 -5.494 7.192 649 HD23 LEU 87 2HD2 LEU 87 -6.518 -6.174 5.797 650 H ALA 88 HN ALA 88 -4.654 -0.670 4.455 651 HA ALA 88 HA ALA 88 -2.793 -1.134 2.222 652 HB1 ALA 88 1HB ALA 88 -4.621 0.357 1.523 653 HB2 ALA 88 2HB ALA 88 -3.060 1.177 1.530 654 HB3 ALA 88 3HB ALA 88 -4.208 1.457 2.838 655 H VAL 89 HN VAL 89 -0.802 -1.173 3.003 656 HA VAL 89 HA VAL 89 -0.181 0.489 5.353 657 HB VAL 89 HB VAL 89 1.233 -2.025 4.438 658 HG11 VAL 89 1HG1 VAL 89 2.707 -0.456 5.599 659 HG12 VAL 89 2HG1 VAL 89 2.408 -1.894 6.574 660 HG13 VAL 89 3HG1 VAL 89 1.573 -0.386 6.949 661 HG21 VAL 89 3HG2 VAL 89 0.241 -3.046 6.460 662 HG22 VAL 89 1HG2 VAL 89 -0.972 -2.563 5.274 663 HG23 VAL 89 2HG2 VAL 89 -0.702 -1.577 6.711 664 H ASP 90 HN ASP 90 1.243 2.068 5.123 665 HA ASP 90 HA ASP 90 2.773 2.216 2.614 666 HB2 ASP 90 2HB ASP 90 1.177 4.051 3.038 667 HB3 ASP 90 1HB ASP 90 1.998 4.404 4.553 668 H GLN 91 HN GLN 91 4.909 1.994 2.694 669 HA GLN 91 HA GLN 91 7.064 2.019 3.374 670 HB2 GLN 91 2HB GLN 91 5.932 3.643 5.645 671 HB3 GLN 91 1HB GLN 91 7.638 3.241 5.536 672 HG2 GLN 91 2HG GLN 91 7.881 4.468 3.516 673 HG3 GLN 91 1HG GLN 91 6.136 4.679 3.366 674 HE21 GLN 91 1HE2 GLN 91 5.084 6.135 4.674 675 HE22 GLN 91 2HE2 GLN 91 5.929 7.376 5.544 676 H VAL 92 HN VAL 92 7.764 0.068 3.763 677 HA VAL 92 HA VAL 92 6.728 -1.428 6.065 678 HB VAL 92 HB VAL 92 8.438 -2.403 3.767 679 HG11 VAL 92 1HG1 VAL 92 8.750 -3.773 5.744 680 HG12 VAL 92 2HG1 VAL 92 7.791 -4.654 4.553 681 HG13 VAL 92 3HG1 VAL 92 7.004 -3.918 5.947 682 HG21 VAL 92 3HG2 VAL 92 5.477 -2.688 4.251 683 HG22 VAL 92 1HG2 VAL 92 6.382 -3.476 2.958 684 HG23 VAL 92 2HG2 VAL 92 6.241 -1.718 2.992 685 H GLU 93 HN GLU 93 9.597 0.077 4.804 686 HA GLU 93 HA GLU 93 11.535 -1.176 6.423 687 HB2 GLU 93 2HB GLU 93 12.096 0.170 4.451 688 HB3 GLU 93 1HB GLU 93 11.498 1.614 5.250 689 HG2 GLU 93 2HG GLU 93 13.568 0.224 6.766 690 HG3 GLU 93 1HG GLU 93 14.101 0.773 5.179 691 H LYS 94 HN LYS 94 9.156 1.224 7.125 692 HA LYS 94 HA LYS 94 10.578 2.357 9.348 693 HB2 LYS 94 2HB LYS 94 7.695 2.761 8.588 694 HB3 LYS 94 1HB LYS 94 8.656 3.768 9.652 695 HG2 LYS 94 2HG LYS 94 8.759 3.526 6.682 696 HG3 LYS 94 1HG LYS 94 8.625 4.972 7.683 697 HD2 LYS 94 2HD LYS 94 11.064 3.220 7.405 698 HD3 LYS 94 1HD LYS 94 10.839 4.799 6.669 699 HE2 LYS 94 2HE LYS 94 10.759 5.839 8.858 700 HE3 LYS 94 1HE LYS 94 10.886 4.257 9.631 701 HZ1 LYS 94 3HZ LYS 94 13.057 3.981 8.522 702 HZ2 LYS 94 1HZ LYS 94 13.030 5.294 9.605 703 HZ3 LYS 94 2HZ LYS 94 12.939 5.569 7.934 704 H LEU 95 HN LEU 95 8.825 -0.449 8.948 705 HA LEU 95 HA LEU 95 7.317 -0.412 11.380 706 HB2 LEU 95 2HB LEU 95 8.097 -2.727 9.608 707 HB3 LEU 95 1HB LEU 95 6.916 -2.788 10.901 708 HG LEU 95 HG LEU 95 6.678 -1.150 8.379 709 HD11 LEU 95 1HD1 LEU 95 4.859 -2.705 7.839 710 HD12 LEU 95 2HD1 LEU 95 5.252 -3.647 9.278 711 HD13 LEU 95 3HD1 LEU 95 6.417 -3.522 7.960 712 HD21 LEU 95 3HD2 LEU 95 4.387 -0.709 9.156 713 HD22 LEU 95 1HD2 LEU 95 5.600 -0.043 10.252 714 HD23 LEU 95 2HD2 LEU 95 4.756 -1.534 10.671 715 H GLY 96 HN GLY 96 7.863 -1.105 13.368 716 HA2 GLY 96 2HA GLY 96 10.649 -1.746 13.854 717 HA3 GLY 96 1HA GLY 96 9.413 -1.460 15.070 718 H ASN 97 HN ASN 97 8.868 -3.188 16.233 719 HA ASN 97 HA ASN 97 9.478 -5.831 15.087 720 HB2 ASN 97 2HB ASN 97 10.752 -5.375 17.093 721 HB3 ASN 97 1HB ASN 97 9.289 -4.942 17.973 722 HD21 ASN 97 1HD2 ASN 97 8.049 -6.510 18.864 723 HD22 ASN 97 2HD2 ASN 97 8.454 -8.197 18.826 724 H GLU 98 HN GLU 98 7.116 -4.263 17.251 725 HA GLU 98 HA GLU 98 5.291 -6.400 17.281 726 HB2 GLU 98 2HB GLU 98 4.851 -3.447 17.750 727 HB3 GLU 98 1HB GLU 98 3.615 -4.667 18.009 728 HG2 GLU 98 2HG GLU 98 4.549 -4.182 20.116 729 HG3 GLU 98 1HG GLU 98 5.174 -5.760 19.641 730 H GLU 99 HN GLU 99 5.504 -3.532 15.230 731 HA GLU 99 HA GLU 99 3.105 -3.865 13.845 732 HB2 GLU 99 2HB GLU 99 5.669 -2.697 12.759 733 HB3 GLU 99 1HB GLU 99 4.055 -2.426 12.124 734 HG2 GLU 99 2HG GLU 99 4.411 -0.508 13.332 735 HG3 GLU 99 1HG GLU 99 3.556 -1.510 14.503 736 H GLN 100 HN GLN 100 6.330 -5.183 13.148 737 HA GLN 100 HA GLN 100 5.567 -6.402 10.707 738 HB2 GLN 100 2HB GLN 100 7.885 -6.872 12.570 739 HB3 GLN 100 1HB GLN 100 7.653 -7.834 11.118 740 HG2 GLN 100 2HG GLN 100 7.665 -5.699 9.810 741 HG3 GLN 100 1HG GLN 100 8.129 -4.871 11.295 742 HE21 GLN 100 1HE2 GLN 100 10.180 -5.169 12.130 743 HE22 GLN 100 2HE2 GLN 100 11.461 -5.899 11.215 744 H ALA 101 HN ALA 101 5.582 -7.508 14.049 745 HA ALA 101 HA ALA 101 4.893 -10.198 13.486 746 HB1 ALA 101 1HB ALA 101 5.828 -9.476 15.633 747 HB2 ALA 101 2HB ALA 101 4.310 -10.350 15.837 748 HB3 ALA 101 3HB ALA 101 4.341 -8.592 15.976 749 H LEU 102 HN LEU 102 3.007 -7.293 14.103 750 HA LEU 102 HA LEU 102 0.450 -8.510 14.105 751 HB2 LEU 102 2HB LEU 102 1.254 -6.119 14.815 752 HB3 LEU 102 1HB LEU 102 0.960 -5.713 13.140 753 HG LEU 102 HG LEU 102 -0.901 -5.085 14.628 754 HD11 LEU 102 1HD1 LEU 102 -1.367 -5.547 12.283 755 HD12 LEU 102 2HD1 LEU 102 -2.717 -6.020 13.314 756 HD13 LEU 102 3HD1 LEU 102 -1.629 -7.248 12.666 757 HD21 LEU 102 3HD2 LEU 102 -0.701 -6.856 16.268 758 HD22 LEU 102 1HD2 LEU 102 -1.175 -8.051 15.061 759 HD23 LEU 102 2HD2 LEU 102 -2.327 -6.824 15.587 760 H LEU 103 HN LEU 103 2.312 -6.845 11.592 761 HA LEU 103 HA LEU 103 0.583 -7.161 9.434 762 HB2 LEU 103 2HB LEU 103 2.884 -5.916 9.732 763 HB3 LEU 103 1HB LEU 103 3.550 -7.399 9.087 764 HG LEU 103 HG LEU 103 3.265 -5.643 7.383 765 HD11 LEU 103 1HD1 LEU 103 1.502 -8.040 6.946 766 HD12 LEU 103 2HD1 LEU 103 3.248 -7.973 6.702 767 HD13 LEU 103 3HD1 LEU 103 2.179 -7.003 5.688 768 HD21 LEU 103 3HD2 LEU 103 1.018 -5.050 6.609 769 HD22 LEU 103 1HD2 LEU 103 1.297 -4.544 8.276 770 HD23 LEU 103 2HD2 LEU 103 0.324 -5.977 7.942 771 H PHE 104 HN PHE 104 3.171 -9.286 10.581 772 HA PHE 104 HA PHE 104 3.016 -11.358 8.757 773 HB2 PHE 104 2HB PHE 104 4.705 -11.190 10.545 774 HB3 PHE 104 1HB PHE 104 3.470 -11.543 11.744 775 HD1 PHE 104 1HD PHE 104 5.430 -12.935 8.957 776 HD2 PHE 104 2HD PHE 104 2.779 -13.775 12.181 777 HE1 PHE 104 1HE PHE 104 5.923 -15.332 8.735 778 HE2 PHE 104 2HE PHE 104 3.269 -16.178 11.962 779 HZ PHE 104 HZ PHE 104 4.844 -16.958 10.238 780 H SER 105 HN SER 105 1.088 -10.840 11.677 781 HA SER 105 HA SER 105 -0.410 -13.236 11.471 782 HB2 SER 105 2HB SER 105 -0.078 -11.609 13.497 783 HB3 SER 105 1HB SER 105 -1.469 -10.767 12.823 784 HG SER 105 HG SER 105 -1.455 -12.917 14.358 785 H ILE 106 HN ILE 106 -0.825 -9.983 10.200 786 HA ILE 106 HA ILE 106 -3.457 -10.236 9.239 787 HB ILE 106 HB ILE 106 -1.173 -8.563 8.170 788 HG12 ILE 106 2HG1 ILE 106 -3.506 -7.872 9.967 789 HG13 ILE 106 1HG1 ILE 106 -1.836 -8.063 10.491 790 HG21 ILE 106 1HG2 ILE 106 -4.121 -8.300 7.591 791 HG22 ILE 106 2HG2 ILE 106 -2.921 -8.936 6.467 792 HG23 ILE 106 3HG2 ILE 106 -2.836 -7.253 6.988 793 HD11 ILE 106 3HD1 ILE 106 -1.217 -6.154 9.046 794 HD12 ILE 106 1HD1 ILE 106 -2.369 -5.732 10.315 795 HD13 ILE 106 2HD1 ILE 106 -2.924 -5.944 8.655 796 H PHE 107 HN PHE 107 -0.321 -10.904 7.682 797 HA PHE 107 HA PHE 107 -1.316 -11.836 5.236 798 HB2 PHE 107 2HB PHE 107 1.226 -12.121 6.725 799 HB3 PHE 107 1HB PHE 107 0.903 -13.353 5.513 800 HD1 PHE 107 1HD PHE 107 -0.104 -12.227 3.238 801 HD2 PHE 107 2HD PHE 107 2.547 -10.393 6.014 802 HE1 PHE 107 1HE PHE 107 0.714 -10.733 1.462 803 HE2 PHE 107 2HE PHE 107 3.369 -8.896 4.241 804 HZ PHE 107 HZ PHE 107 2.452 -9.067 1.962 805 H ASN 108 HN ASN 108 -0.746 -13.499 8.300 806 HA ASN 108 HA ASN 108 -1.337 -16.101 7.469 807 HB2 ASN 108 2HB ASN 108 -0.370 -15.788 9.636 808 HB3 ASN 108 1HB ASN 108 -1.700 -14.755 10.151 809 HD21 ASN 108 1HD2 ASN 108 -3.524 -15.666 10.965 810 HD22 ASN 108 2HD2 ASN 108 -3.722 -17.363 11.223 811 H ARG 109 HN ARG 109 -3.503 -13.587 8.754 812 HA ARG 109 HA ARG 109 -5.861 -15.111 8.695 813 HB2 ARG 109 2HB ARG 109 -5.660 -12.929 9.859 814 HB3 ARG 109 1HB ARG 109 -5.575 -12.121 8.299 815 HG2 ARG 109 2HG ARG 109 -7.822 -12.885 7.761 816 HG3 ARG 109 1HG ARG 109 -7.914 -13.731 9.304 817 HD2 ARG 109 2HD ARG 109 -9.083 -11.687 9.579 818 HD3 ARG 109 1HD ARG 109 -7.548 -11.507 10.422 819 HE ARG 109 HE ARG 109 -6.805 -10.275 8.353 820 HH11 ARG 109 1HH1 ARG 109 -10.176 -10.444 9.280 821 HH12 ARG 109 2HH1 ARG 109 -10.598 -8.928 8.534 822 HH21 ARG 109 1HH2 ARG 109 -7.352 -8.225 7.416 823 HH22 ARG 109 2HH2 ARG 109 -8.988 -7.651 7.513 824 H PHE 110 HN PHE 110 -4.418 -12.985 6.256 825 HA PHE 110 HA PHE 110 -6.521 -13.203 4.384 826 HB2 PHE 110 2HB PHE 110 -3.628 -12.415 4.108 827 HB3 PHE 110 1HB PHE 110 -4.739 -12.416 2.745 828 HD1 PHE 110 2HD PHE 110 -6.922 -11.552 5.112 829 HD2 PHE 110 1HD PHE 110 -3.392 -9.980 3.329 830 HE1 PHE 110 2HE PHE 110 -7.648 -9.271 5.684 831 HE2 PHE 110 1HE PHE 110 -4.111 -7.701 3.900 832 HZ PHE 110 HZ PHE 110 -6.244 -7.345 5.075 833 H ARG 111 HN ARG 111 -3.387 -14.882 4.605 834 HA ARG 111 HA ARG 111 -3.770 -16.355 2.207 835 HB2 ARG 111 2HB ARG 111 -1.557 -15.850 3.294 836 HB3 ARG 111 1HB ARG 111 -1.941 -17.065 4.498 837 HG2 ARG 111 2HG ARG 111 -0.503 -18.056 2.898 838 HG3 ARG 111 1HG ARG 111 -2.114 -18.737 2.669 839 HD2 ARG 111 2HD ARG 111 -1.148 -16.392 1.063 840 HD3 ARG 111 1HD ARG 111 -0.783 -18.047 0.595 841 HE ARG 111 HE ARG 111 -3.323 -18.342 0.660 842 HH11 ARG 111 1HH1 ARG 111 -1.735 -15.338 -0.183 843 HH12 ARG 111 2HH1 ARG 111 -3.002 -14.805 -1.233 844 HH21 ARG 111 1HH2 ARG 111 -5.011 -17.652 -0.721 845 HH22 ARG 111 2HH2 ARG 111 -4.867 -16.132 -1.551 846 H ASN 112 HN ASN 112 -4.491 -17.004 5.582 847 HA ASN 112 HA ASN 112 -5.010 -19.787 5.237 848 HB2 ASN 112 2HB ASN 112 -4.872 -17.967 7.400 849 HB3 ASN 112 1HB ASN 112 -6.462 -18.718 7.470 850 HD21 ASN 112 1HD2 ASN 112 -4.138 -19.000 9.230 851 HD22 ASN 112 2HD2 ASN 112 -3.767 -20.685 9.261 852 H SER 113 HN SER 113 -7.033 -16.896 5.252 853 HA SER 113 HA SER 113 -9.454 -18.457 4.990 854 HB2 SER 113 2HB SER 113 -9.024 -15.463 4.922 855 HB3 SER 113 1HB SER 113 -10.585 -16.280 5.009 856 HG SER 113 HG SER 113 -8.572 -16.059 6.955 857 H GLY 114 HN GLY 114 -7.175 -16.948 2.901 858 HA2 GLY 114 2HA GLY 114 -7.096 -16.787 0.600 859 HA3 GLY 114 1HA GLY 114 -8.581 -17.730 0.532 860 H LYS 115 HN LYS 115 -8.515 -14.938 2.506 861 HA LYS 115 HA LYS 115 -10.042 -13.407 0.555 862 HB2 LYS 115 2HB LYS 115 -11.478 -14.809 2.138 863 HB3 LYS 115 1HB LYS 115 -10.900 -13.771 3.427 864 HG2 LYS 115 2HG LYS 115 -11.936 -11.876 2.461 865 HG3 LYS 115 1HG LYS 115 -12.311 -12.764 0.985 866 HD2 LYS 115 2HD LYS 115 -13.759 -14.274 2.330 867 HD3 LYS 115 1HD LYS 115 -13.455 -13.251 3.735 868 HE2 LYS 115 2HE LYS 115 -14.679 -12.284 1.156 869 HE3 LYS 115 1HE LYS 115 -15.604 -12.775 2.575 870 HZ1 LYS 115 3HZ LYS 115 -14.922 -10.956 3.764 871 HZ2 LYS 115 1HZ LYS 115 -15.027 -10.296 2.207 872 HZ3 LYS 115 2HZ LYS 115 -13.512 -10.718 2.850 873 H GLY 116 HN GLY 116 -10.498 -11.155 1.667 874 HA2 GLY 116 2HA GLY 116 -9.649 -9.332 2.895 875 HA3 GLY 116 1HA GLY 116 -8.235 -10.298 3.303 876 H PHE 117 HN PHE 117 -8.306 -7.591 2.263 877 HA PHE 117 HA PHE 117 -6.871 -8.037 -0.272 878 HB2 PHE 117 2HB PHE 117 -8.765 -5.796 0.446 879 HB3 PHE 117 1HB PHE 117 -7.676 -5.734 -0.935 880 HD1 PHE 117 1HD PHE 117 -10.516 -7.600 0.530 881 HD2 PHE 117 2HD PHE 117 -8.237 -6.747 -2.957 882 HE1 PHE 117 1HE PHE 117 -12.200 -8.750 -0.848 883 HE2 PHE 117 2HE PHE 117 -9.909 -7.896 -4.342 884 HZ PHE 117 HZ PHE 117 -11.895 -8.900 -3.289 885 H LEU 118 HN LEU 118 -4.978 -6.957 -0.551 886 HA LEU 118 HA LEU 118 -4.157 -5.040 1.507 887 HB2 LEU 118 2HB LEU 118 -3.343 -7.361 2.092 888 HB3 LEU 118 1HB LEU 118 -2.413 -7.316 0.609 889 HG LEU 118 HG LEU 118 -1.177 -5.346 1.473 890 HD11 LEU 118 1HD1 LEU 118 -1.315 -4.815 3.846 891 HD12 LEU 118 2HD1 LEU 118 -2.636 -5.968 4.033 892 HD13 LEU 118 3HD1 LEU 118 -2.857 -4.529 3.038 893 HD21 LEU 118 3HD2 LEU 118 0.184 -6.608 3.071 894 HD22 LEU 118 1HD2 LEU 118 -0.241 -7.584 1.665 895 HD23 LEU 118 2HD2 LEU 118 -1.089 -7.822 3.194 896 H LEU 119 HN LEU 119 -2.894 -3.462 0.774 897 HA LEU 119 HA LEU 119 -1.724 -3.681 -1.900 898 HB2 LEU 119 2HB LEU 119 -3.838 -2.415 -2.103 899 HB3 LEU 119 1HB LEU 119 -3.264 -1.281 -0.895 900 HG LEU 119 HG LEU 119 -1.396 -0.664 -2.426 901 HD11 LEU 119 1HD1 LEU 119 -2.903 -2.370 -4.402 902 HD12 LEU 119 2HD1 LEU 119 -1.306 -2.713 -3.737 903 HD13 LEU 119 3HD1 LEU 119 -1.544 -1.309 -4.775 904 HD21 LEU 119 3HD2 LEU 119 -4.176 -0.325 -3.541 905 HD22 LEU 119 1HD2 LEU 119 -2.770 0.654 -3.960 906 HD23 LEU 119 2HD2 LEU 119 -3.414 0.692 -2.319 907 H LEU 120 HN LEU 120 0.355 -3.181 -1.858 908 HA LEU 120 HA LEU 120 1.326 -1.527 0.376 909 HB2 LEU 120 2HB LEU 120 2.688 -3.917 -0.862 910 HB3 LEU 120 1HB LEU 120 3.371 -2.895 0.386 911 HG LEU 120 HG LEU 120 0.898 -4.598 0.713 912 HD11 LEU 120 1HD1 LEU 120 2.897 -5.962 0.488 913 HD12 LEU 120 2HD1 LEU 120 2.314 -5.987 2.152 914 HD13 LEU 120 3HD1 LEU 120 3.713 -5.002 1.722 915 HD21 LEU 120 3HD2 LEU 120 0.855 -2.616 2.120 916 HD22 LEU 120 1HD2 LEU 120 2.479 -2.974 2.705 917 HD23 LEU 120 2HD2 LEU 120 1.141 -4.060 3.093 918 H GLY 121 HN GLY 121 1.967 0.347 -0.431 919 HA2 GLY 121 2HA GLY 121 3.178 0.529 -3.068 920 HA3 GLY 121 1HA GLY 121 2.881 1.867 -1.959 921 H SER 122 HN SER 122 4.132 1.375 0.227 922 HA SER 122 HA SER 122 6.059 1.155 1.379 923 HB2 SER 122 2HB SER 122 6.944 -0.660 -0.867 924 HB3 SER 122 1HB SER 122 7.608 -0.595 0.766 925 HG SER 122 HG SER 122 5.147 -1.602 -0.126 926 H GLU 123 HN GLU 123 8.728 0.796 0.332 927 HA GLU 123 HA GLU 123 9.061 3.483 -0.821 928 HB2 GLU 123 2HB GLU 123 11.003 3.798 0.645 929 HB3 GLU 123 1HB GLU 123 9.524 3.546 1.557 930 HG2 GLU 123 2HG GLU 123 11.649 1.468 1.053 931 HG3 GLU 123 1HG GLU 123 11.444 2.384 2.543 932 H TYR 124 HN TYR 124 10.332 0.183 -0.686 933 HA TYR 124 HA TYR 124 11.915 0.864 -3.064 934 HB2 TYR 124 2HB TYR 124 12.917 -0.696 -0.684 935 HB3 TYR 124 1HB TYR 124 13.720 -0.701 -2.251 936 HD1 TYR 124 1HD TYR 124 14.528 1.524 -3.185 937 HD2 TYR 124 2HD TYR 124 13.338 1.026 0.869 938 HE1 TYR 124 1HE TYR 124 15.739 3.577 -2.584 939 HE2 TYR 124 2HE TYR 124 14.544 3.081 1.480 940 HH TYR 124 HH TYR 124 16.328 4.475 0.678 941 H THR 125 HN THR 125 11.868 -2.238 -1.377 942 HA THR 125 HA THR 125 9.987 -3.471 -3.154 943 HB THR 125 HB THR 125 11.938 -5.165 -3.855 944 HG1 THR 125 1HG THR 125 13.316 -2.733 -4.162 945 HG21 THR 125 3HG2 THR 125 11.361 -2.605 -5.345 946 HG22 THR 125 1HG2 THR 125 10.380 -4.072 -5.400 947 HG23 THR 125 2HG2 THR 125 12.024 -4.084 -6.038 948 HA PRO 126 HA PRO 126 9.674 -6.196 0.222 949 HB2 PRO 126 2HB PRO 126 9.213 -8.503 -1.525 950 HB3 PRO 126 1HB PRO 126 8.093 -7.687 -0.434 951 HG2 PRO 126 2HG PRO 126 7.877 -7.524 -3.121 952 HG3 PRO 126 1HG PRO 126 7.401 -6.198 -2.044 953 HD2 PRO 126 2HD PRO 126 9.880 -6.515 -3.685 954 HD3 PRO 126 1HD PRO 126 8.908 -5.060 -3.377 955 H GLN 127 HN GLN 127 11.766 -7.228 -2.376 956 HA GLN 127 HA GLN 127 12.951 -9.321 -0.738 957 HB2 GLN 127 2HB GLN 127 13.469 -8.512 -3.601 958 HB3 GLN 127 1HB GLN 127 14.247 -9.859 -2.784 959 HG2 GLN 127 2HG GLN 127 12.061 -10.921 -2.479 960 HG3 GLN 127 1HG GLN 127 11.303 -9.579 -3.338 961 HE21 GLN 127 1HE2 GLN 127 11.592 -9.381 -5.548 962 HE22 GLN 127 2HE2 GLN 127 12.237 -10.661 -6.526 963 H GLN 128 HN GLN 128 13.534 -6.046 -1.449 964 HA GLN 128 HA GLN 128 16.411 -6.362 -0.973 965 HB2 GLN 128 2HB GLN 128 15.601 -5.082 -2.994 966 HB3 GLN 128 1HB GLN 128 15.000 -3.857 -1.883 967 HG2 GLN 128 2HG GLN 128 17.249 -3.483 -1.047 968 HG3 GLN 128 1HG GLN 128 17.869 -4.743 -2.111 969 HE21 GLN 128 1HE2 GLN 128 16.717 -1.492 -1.883 970 HE22 GLN 128 2HE2 GLN 128 17.148 -1.003 -3.489 971 H LEU 129 HN LEU 129 13.507 -5.171 0.462 972 HA LEU 129 HA LEU 129 14.567 -3.283 2.242 973 HB2 LEU 129 2HB LEU 129 12.161 -5.081 2.420 974 HB3 LEU 129 1HB LEU 129 12.557 -3.917 3.666 975 HG LEU 129 HG LEU 129 11.947 -3.252 0.789 976 HD11 LEU 129 1HD1 LEU 129 9.898 -2.274 1.710 977 HD12 LEU 129 2HD1 LEU 129 10.332 -2.881 3.307 978 HD13 LEU 129 3HD1 LEU 129 9.981 -4.011 2.000 979 HD21 LEU 129 3HD2 LEU 129 11.942 -0.925 1.597 980 HD22 LEU 129 1HD2 LEU 129 13.527 -1.681 1.748 981 HD23 LEU 129 2HD2 LEU 129 12.504 -1.486 3.172 982 H VAL 130 HN VAL 130 15.625 -3.415 4.112 983 HA VAL 130 HA VAL 130 16.442 -6.069 4.998 984 HB VAL 130 HB VAL 130 17.364 -3.392 6.060 985 HG11 VAL 130 1HG1 VAL 130 18.559 -6.154 6.295 986 HG12 VAL 130 2HG1 VAL 130 17.748 -5.260 7.581 987 HG13 VAL 130 3HG1 VAL 130 19.273 -4.668 6.919 988 HG21 VAL 130 3HG2 VAL 130 19.340 -3.683 4.638 989 HG22 VAL 130 1HG2 VAL 130 17.863 -3.575 3.678 990 HG23 VAL 130 2HG2 VAL 130 18.625 -5.142 3.950 991 H ILE 131 HN ILE 131 14.328 -6.587 5.697 992 HA ILE 131 HA ILE 131 13.635 -5.475 8.335 993 HB ILE 131 HB ILE 131 11.299 -6.221 7.879 994 HG12 ILE 131 2HG1 ILE 131 12.312 -6.602 5.050 995 HG13 ILE 131 1HG1 ILE 131 11.834 -7.896 6.144 996 HG21 ILE 131 1HG2 ILE 131 11.911 -3.894 7.596 997 HG22 ILE 131 2HG2 ILE 131 10.731 -4.368 6.371 998 HG23 ILE 131 3HG2 ILE 131 12.436 -4.212 5.942 999 HD11 ILE 131 3HD1 ILE 131 10.087 -7.429 4.541 1000 HD12 ILE 131 1HD1 ILE 131 10.040 -5.743 5.053 1001 HD13 ILE 131 2HD1 ILE 131 9.552 -7.016 6.170 1002 H ARG 132 HN ARG 132 11.935 -7.350 9.266 1003 HA ARG 132 HA ARG 132 13.646 -9.434 10.075 1004 HB2 ARG 132 2HB ARG 132 11.588 -8.567 11.282 1005 HB3 ARG 132 1HB ARG 132 10.630 -9.527 10.165 1006 HG2 ARG 132 2HG ARG 132 10.859 -10.792 12.151 1007 HG3 ARG 132 1HG ARG 132 11.919 -11.533 10.950 1008 HD2 ARG 132 2HD ARG 132 13.803 -10.208 11.920 1009 HD3 ARG 132 1HD ARG 132 12.709 -9.697 13.205 1010 HE ARG 132 HE ARG 132 12.989 -12.565 12.817 1011 HH11 ARG 132 1HH1 ARG 132 13.941 -9.719 14.625 1012 HH12 ARG 132 2HH1 ARG 132 14.604 -10.632 15.947 1013 HH21 ARG 132 1HH2 ARG 132 13.881 -13.762 14.528 1014 HH22 ARG 132 2HH2 ARG 132 14.589 -12.928 15.885 1015 H GLU 133 HN GLU 133 14.029 -11.408 9.316 1016 HA GLU 133 HA GLU 133 13.574 -12.043 6.635 1017 HB2 GLU 133 2HB GLU 133 14.297 -13.848 8.948 1018 HB3 GLU 133 1HB GLU 133 14.373 -14.324 7.259 1019 HG2 GLU 133 2HG GLU 133 15.938 -12.052 8.457 1020 HG3 GLU 133 1HG GLU 133 16.555 -13.688 8.227 1021 H ASP 134 HN ASP 134 11.606 -12.590 9.407 1022 HA ASP 134 HA ASP 134 10.105 -14.778 8.367 1023 HB2 ASP 134 2HB ASP 134 9.357 -12.838 10.564 1024 HB3 ASP 134 1HB ASP 134 8.606 -14.399 10.258 1025 H LEU 135 HN LEU 135 9.800 -11.289 8.230 1026 HA LEU 135 HA LEU 135 7.066 -11.392 7.299 1027 HB2 LEU 135 2HB LEU 135 7.888 -9.565 8.753 1028 HB3 LEU 135 1HB LEU 135 8.942 -9.038 7.454 1029 HG LEU 135 HG LEU 135 6.953 -8.591 6.047 1030 HD11 LEU 135 1HD1 LEU 135 5.427 -9.277 8.557 1031 HD12 LEU 135 2HD1 LEU 135 5.410 -10.179 7.041 1032 HD13 LEU 135 3HD1 LEU 135 4.739 -8.551 7.104 1033 HD21 LEU 135 3HD2 LEU 135 7.006 -7.215 8.728 1034 HD22 LEU 135 1HD2 LEU 135 6.190 -6.604 7.286 1035 HD23 LEU 135 2HD2 LEU 135 7.945 -6.779 7.299 1036 H ARG 136 HN ARG 136 10.229 -10.579 5.897 1037 HA ARG 136 HA ARG 136 9.273 -9.591 3.464 1038 HB2 ARG 136 2HB ARG 136 11.584 -9.902 2.669 1039 HB3 ARG 136 1HB ARG 136 11.498 -9.095 4.222 1040 HG2 ARG 136 2HG ARG 136 12.018 -11.247 5.314 1041 HG3 ARG 136 1HG ARG 136 12.223 -11.969 3.718 1042 HD2 ARG 136 2HD ARG 136 13.798 -9.638 4.798 1043 HD3 ARG 136 1HD ARG 136 14.362 -11.303 4.743 1044 HE ARG 136 HE ARG 136 13.616 -9.947 2.251 1045 HH11 ARG 136 1HH1 ARG 136 16.045 -11.396 4.316 1046 HH12 ARG 136 2HH1 ARG 136 17.254 -11.451 3.064 1047 HH21 ARG 136 1HH2 ARG 136 15.227 -9.983 0.611 1048 HH22 ARG 136 2HH2 ARG 136 16.788 -10.642 0.969 1049 H THR 137 HN THR 137 9.679 -12.866 4.521 1050 HA THR 137 HA THR 137 9.757 -14.003 1.894 1051 HB THR 137 HB THR 137 9.183 -16.145 3.137 1052 HG1 THR 137 1HG THR 137 9.674 -15.734 5.531 1053 HG21 THR 137 3HG2 THR 137 11.489 -15.536 2.604 1054 HG22 THR 137 1HG2 THR 137 11.405 -16.301 4.191 1055 HG23 THR 137 2HG2 THR 137 11.578 -14.551 4.064 1056 H ARG 138 HN ARG 138 7.263 -13.025 4.121 1057 HA ARG 138 HA ARG 138 5.140 -14.462 2.825 1058 HB2 ARG 138 2HB ARG 138 4.777 -12.074 4.618 1059 HB3 ARG 138 1HB ARG 138 3.709 -13.455 4.399 1060 HG2 ARG 138 2HG ARG 138 6.400 -13.499 5.744 1061 HG3 ARG 138 1HG ARG 138 4.835 -13.531 6.546 1062 HD2 ARG 138 2HD ARG 138 4.332 -15.681 5.700 1063 HD3 ARG 138 1HD ARG 138 5.662 -15.609 4.540 1064 HE ARG 138 HE ARG 138 6.933 -15.410 6.905 1065 HH11 ARG 138 1HH1 ARG 138 4.557 -17.680 5.684 1066 HH12 ARG 138 2HH1 ARG 138 5.145 -19.005 6.646 1067 HH21 ARG 138 1HH2 ARG 138 7.711 -17.159 8.158 1068 HH22 ARG 138 2HH2 ARG 138 6.940 -18.709 8.028 1069 H MET 139 HN MET 139 6.835 -11.601 2.234 1070 HA MET 139 HA MET 139 4.826 -10.034 1.007 1071 HB2 MET 139 2HB MET 139 7.828 -10.045 0.682 1072 HB3 MET 139 1HB MET 139 6.769 -8.819 0.006 1073 HG2 MET 139 2HG MET 139 7.007 -9.438 2.939 1074 HG3 MET 139 1HG MET 139 7.865 -8.141 2.109 1075 HE1 MET 139 3HE MET 139 6.029 -7.633 4.680 1076 HE2 MET 139 1HE MET 139 5.202 -6.158 4.171 1077 HE3 MET 139 2HE MET 139 6.916 -6.376 3.818 1078 H ALA 140 HN ALA 140 6.511 -12.821 0.024 1079 HA ALA 140 HA ALA 140 6.546 -12.395 -2.780 1080 HB1 ALA 140 1HB ALA 140 6.644 -14.986 -1.246 1081 HB2 ALA 140 2HB ALA 140 8.030 -13.984 -1.675 1082 HB3 ALA 140 3HB ALA 140 7.081 -14.762 -2.941 1083 H TYR 141 HN TYR 141 3.997 -13.072 -0.654 1084 HA TYR 141 HA TYR 141 2.430 -14.645 -2.490 1085 HB2 TYR 141 2HB TYR 141 1.691 -13.325 0.126 1086 HB3 TYR 141 1HB TYR 141 0.632 -14.383 -0.793 1087 HD1 TYR 141 2HD TYR 141 1.857 -16.724 -1.433 1088 HD2 TYR 141 1HD TYR 141 2.760 -14.269 1.920 1089 HE1 TYR 141 2HE TYR 141 2.809 -18.669 -0.269 1090 HE2 TYR 141 1HE TYR 141 3.712 -16.206 3.091 1091 HH TYR 141 HH TYR 141 4.468 -19.095 1.549 1092 H CYS 142 HN CYS 142 3.274 -11.490 -2.490 1093 HA CYS 142 HA CYS 142 0.698 -10.578 -3.544 1094 HB2 CYS 142 2HB CYS 142 3.054 -8.950 -2.556 1095 HB3 CYS 142 1HB CYS 142 1.525 -8.299 -3.137 1096 HG CYS 142 HG CYS 142 2.346 -9.289 -0.113 1097 H LEU 143 HN LEU 143 0.682 -9.441 -5.497 1098 HA LEU 143 HA LEU 143 2.701 -10.252 -7.395 1099 HB2 LEU 143 2HB LEU 143 0.201 -8.595 -7.681 1100 HB3 LEU 143 1HB LEU 143 1.294 -8.891 -9.012 1101 HG LEU 143 HG LEU 143 0.864 -11.372 -8.558 1102 HD11 LEU 143 1HD1 LEU 143 -1.489 -10.209 -7.085 1103 HD12 LEU 143 2HD1 LEU 143 -0.186 -11.166 -6.379 1104 HD13 LEU 143 3HD1 LEU 143 -1.291 -11.901 -7.539 1105 HD21 LEU 143 3HD2 LEU 143 0.029 -10.198 -10.511 1106 HD22 LEU 143 1HD2 LEU 143 -1.357 -9.620 -9.585 1107 HD23 LEU 143 2HD2 LEU 143 -1.170 -11.344 -9.911 1108 H VAL 144 HN VAL 144 3.857 -8.698 -8.765 1109 HA VAL 144 HA VAL 144 4.435 -6.216 -7.302 1110 HB VAL 144 HB VAL 144 6.477 -7.979 -8.672 1111 HG11 VAL 144 1HG1 VAL 144 6.794 -5.415 -7.116 1112 HG12 VAL 144 2HG1 VAL 144 7.082 -5.647 -8.841 1113 HG13 VAL 144 3HG1 VAL 144 8.123 -6.439 -7.657 1114 HG21 VAL 144 3HG2 VAL 144 5.998 -7.477 -5.734 1115 HG22 VAL 144 1HG2 VAL 144 7.348 -8.391 -6.410 1116 HG23 VAL 144 2HG2 VAL 144 5.698 -8.986 -6.597 1117 H TYR 145 HN TYR 145 4.125 -4.487 -8.479 1118 HA TYR 145 HA TYR 145 4.636 -4.604 -11.381 1119 HB2 TYR 145 2HB TYR 145 2.442 -3.080 -9.948 1120 HB3 TYR 145 1HB TYR 145 2.847 -2.865 -11.645 1121 HD1 TYR 145 1HD TYR 145 2.376 -4.670 -13.265 1122 HD2 TYR 145 2HD TYR 145 1.158 -4.957 -9.200 1123 HE1 TYR 145 1HE TYR 145 0.817 -6.471 -13.866 1124 HE2 TYR 145 2HE TYR 145 -0.407 -6.760 -9.793 1125 HH TYR 145 HH TYR 145 -0.334 -8.333 -12.818 1126 H GLU 146 HN GLU 146 5.926 -3.003 -12.183 1127 HA GLU 146 HA GLU 146 7.154 -1.222 -10.260 1128 HB2 GLU 146 2HB GLU 146 8.704 -0.635 -12.017 1129 HB3 GLU 146 1HB GLU 146 8.520 -2.380 -11.969 1130 HG2 GLU 146 2HG GLU 146 6.968 -2.233 -13.884 1131 HG3 GLU 146 1HG GLU 146 7.266 -0.498 -13.955 1132 H VAL 147 HN VAL 147 6.706 0.881 -9.979 1133 HA VAL 147 HA VAL 147 4.726 2.057 -11.811 1134 HB VAL 147 HB VAL 147 5.243 2.797 -8.923 1135 HG11 VAL 147 1HG1 VAL 147 4.430 4.682 -10.240 1136 HG12 VAL 147 2HG1 VAL 147 3.195 4.117 -9.115 1137 HG13 VAL 147 3HG1 VAL 147 3.082 3.703 -10.824 1138 HG21 VAL 147 3HG2 VAL 147 3.054 1.761 -8.486 1139 HG22 VAL 147 1HG2 VAL 147 4.245 0.596 -9.065 1140 HG23 VAL 147 2HG2 VAL 147 3.000 1.204 -10.158 1141 H LYS 148 HN LYS 148 6.163 2.943 -13.277 1142 HA LYS 148 HA LYS 148 7.211 5.505 -12.412 1143 HB2 LYS 148 2HB LYS 148 9.152 3.960 -12.179 1144 HB3 LYS 148 1HB LYS 148 9.002 3.558 -13.886 1145 HG2 LYS 148 2HG LYS 148 9.320 6.002 -14.381 1146 HG3 LYS 148 1HG LYS 148 9.734 6.216 -12.679 1147 HD2 LYS 148 2HD LYS 148 11.579 4.631 -12.927 1148 HD3 LYS 148 1HD LYS 148 11.154 4.394 -14.625 1149 HE2 LYS 148 2HE LYS 148 11.483 6.883 -14.923 1150 HE3 LYS 148 1HE LYS 148 12.178 6.896 -13.303 1151 HZ1 LYS 148 3HZ LYS 148 13.855 5.314 -14.055 1152 HZ2 LYS 148 1HZ LYS 148 13.892 6.738 -14.980 1153 HZ3 LYS 148 2HZ LYS 148 13.191 5.332 -15.614 1154 HA PRO 149 HA PRO 149 5.345 5.819 -16.563 1155 HB2 PRO 149 2HB PRO 149 3.828 8.052 -15.628 1156 HB3 PRO 149 1HB PRO 149 3.238 6.436 -16.015 1157 HG2 PRO 149 2HG PRO 149 3.278 7.546 -13.478 1158 HG3 PRO 149 1HG PRO 149 3.193 5.811 -13.827 1159 HD2 PRO 149 2HD PRO 149 5.555 7.479 -13.065 1160 HD3 PRO 149 1HD PRO 149 5.136 5.822 -12.576 Start of MODEL 11 1 H1 MET 1 H1 MET 1 -42.281 54.805 48.949 2 H2 MET 1 H2 MET 1 -42.191 55.602 50.444 3 H3 MET 1 H3 MET 1 -43.310 54.349 50.219 4 HA MET 1 HA MET 1 -40.357 54.112 50.261 5 HB2 MET 1 2HB MET 1 -41.398 54.382 52.476 6 HB3 MET 1 1HB MET 1 -42.482 53.042 52.131 7 HG2 MET 1 2HG MET 1 -40.495 51.565 51.918 8 HG3 MET 1 1HG MET 1 -39.490 52.919 52.435 9 HE1 MET 1 2HE MET 1 -39.368 50.145 53.914 10 HE2 MET 1 3HE MET 1 -39.417 50.643 55.604 11 HE3 MET 1 1HE MET 1 -38.454 51.556 54.441 12 H GLY 2 HN GLY 2 -39.508 52.378 49.299 13 HA2 GLY 2 2HA GLY 2 -39.431 50.107 48.680 14 HA3 GLY 2 1HA GLY 2 -41.175 50.015 48.878 15 H HIS 3 HN HIS 3 -40.639 48.812 46.788 16 HA HIS 3 HA HIS 3 -41.005 50.677 44.545 17 HB2 HIS 3 2HB HIS 3 -39.691 49.085 43.114 18 HB3 HIS 3 1HB HIS 3 -38.732 49.910 44.336 19 HD1 HIS 3 1HD HIS 3 -37.912 48.454 46.376 20 HD2 HIS 3 2HD HIS 3 -39.744 46.322 43.307 21 HE1 HIS 3 1HE HIS 3 -37.344 46.042 46.791 22 HE2 HIS 3 2HE HIS 3 -38.238 44.820 44.784 23 H HIS 4 HN HIS 4 -42.400 49.970 42.915 24 HA HIS 4 HA HIS 4 -43.971 47.574 43.571 25 HB2 HIS 4 2HB HIS 4 -46.074 48.864 43.163 26 HB3 HIS 4 1HB HIS 4 -45.199 49.365 44.602 27 HD1 HIS 4 1HD HIS 4 -47.037 50.789 41.984 28 HD2 HIS 4 2HD HIS 4 -43.419 51.755 43.797 29 HE1 HIS 4 1HE HIS 4 -46.630 53.217 41.449 30 HE2 HIS 4 2HE HIS 4 -44.366 53.734 42.430 31 H HIS 5 HN HIS 5 -44.569 46.386 41.901 32 HA HIS 5 HA HIS 5 -44.793 45.592 39.806 33 HB2 HIS 5 2HB HIS 5 -45.057 48.519 39.154 34 HB3 HIS 5 1HB HIS 5 -45.097 47.281 37.904 35 HD1 HIS 5 1HD HIS 5 -47.421 49.273 39.376 36 HD2 HIS 5 2HD HIS 5 -47.095 45.128 39.207 37 HE1 HIS 5 1HE HIS 5 -49.750 48.390 39.733 38 HE2 HIS 5 2HE HIS 5 -49.552 45.891 39.473 39 H HIS 6 HN HIS 6 -43.160 44.521 39.057 40 HA HIS 6 HA HIS 6 -40.932 45.912 37.794 41 HB2 HIS 6 2HB HIS 6 -39.268 44.466 39.013 42 HB3 HIS 6 1HB HIS 6 -40.041 45.692 40.011 43 HD1 HIS 6 1HD HIS 6 -39.919 41.969 39.461 44 HD2 HIS 6 2HD HIS 6 -41.597 44.723 42.090 45 HE1 HIS 6 1HE HIS 6 -40.777 40.623 41.401 46 HE2 HIS 6 2HE HIS 6 -41.655 42.319 43.044 47 H HIS 7 HN HIS 7 -39.725 44.576 36.355 48 HA HIS 7 HA HIS 7 -40.836 41.909 35.824 49 HB2 HIS 7 2HB HIS 7 -40.549 44.093 33.750 50 HB3 HIS 7 1HB HIS 7 -40.898 42.406 33.389 51 HD1 HIS 7 1HD HIS 7 -42.452 45.554 34.598 52 HD2 HIS 7 2HD HIS 7 -43.514 41.569 34.040 53 HE1 HIS 7 1HE HIS 7 -44.968 45.496 34.700 54 HE2 HIS 7 2HE HIS 7 -45.590 43.109 34.170 55 H HIS 8 HN HIS 8 -39.507 40.650 34.335 56 HA HIS 8 HA HIS 8 -36.803 41.680 33.849 57 HB2 HIS 8 2HB HIS 8 -37.480 39.001 35.079 58 HB3 HIS 8 1HB HIS 8 -35.921 39.348 34.342 59 HD1 HIS 8 1HD HIS 8 -37.402 39.174 37.504 60 HD2 HIS 8 2HD HIS 8 -34.822 41.892 35.704 61 HE1 HIS 8 1HE HIS 8 -36.265 40.381 39.394 62 HE2 HIS 8 2HE HIS 8 -34.823 42.124 38.288 63 H SER 9 HN SER 9 -36.603 41.692 31.705 64 HA SER 9 HA SER 9 -37.827 39.487 30.193 65 HB2 SER 9 2HB SER 9 -37.848 41.155 28.280 66 HB3 SER 9 1HB SER 9 -38.949 41.515 29.609 67 HG SER 9 HG SER 9 -37.974 43.399 29.493 68 H HIS 10 HN HIS 10 -36.589 38.371 28.763 69 HA HIS 10 HA HIS 10 -33.906 39.399 28.154 70 HB2 HIS 10 2HB HIS 10 -34.552 36.614 29.136 71 HB3 HIS 10 1HB HIS 10 -33.047 37.021 28.322 72 HD1 HIS 10 1HD HIS 10 -31.255 38.217 29.678 73 HD2 HIS 10 2HD HIS 10 -34.834 37.717 31.742 74 HE1 HIS 10 1HE HIS 10 -30.758 38.838 32.066 75 HE2 HIS 10 2HE HIS 10 -32.901 38.398 33.321 76 H MET 11 HN MET 11 -33.270 39.098 26.089 77 HA MET 11 HA MET 11 -34.913 37.373 24.354 78 HB2 MET 11 2HB MET 11 -34.010 40.185 23.689 79 HB3 MET 11 1HB MET 11 -34.831 39.093 22.586 80 HG2 MET 11 2HG MET 11 -36.821 39.153 23.964 81 HG3 MET 11 1HG MET 11 -35.995 40.176 25.140 82 HE1 MET 11 3HE MET 11 -38.801 40.959 23.917 83 HE2 MET 11 1HE MET 11 -38.555 42.665 23.540 84 HE3 MET 11 2HE MET 11 -37.924 41.994 25.046 85 H ASP 12 HN ASP 12 -33.164 35.869 24.474 86 HA ASP 12 HA ASP 12 -30.728 36.764 23.073 87 HB2 ASP 12 2HB ASP 12 -30.263 35.994 25.341 88 HB3 ASP 12 1HB ASP 12 -31.083 34.470 25.013 89 H TYR 13 HN TYR 13 -29.932 35.580 21.379 90 HA TYR 13 HA TYR 13 -31.828 33.995 19.934 91 HB2 TYR 13 2HB TYR 13 -28.946 34.717 19.388 92 HB3 TYR 13 1HB TYR 13 -29.915 33.730 18.301 93 HD1 TYR 13 1HD TYR 13 -30.012 37.043 20.027 94 HD2 TYR 13 2HD TYR 13 -31.069 34.766 16.596 95 HE1 TYR 13 1HE TYR 13 -30.877 39.077 18.954 96 HE2 TYR 13 2HE TYR 13 -31.940 36.793 15.512 97 HH TYR 13 HH TYR 13 -32.691 38.963 15.986 98 HA PRO 14 HA PRO 14 -30.824 30.289 22.171 99 HB2 PRO 14 2HB PRO 14 -32.358 29.052 19.951 100 HB3 PRO 14 1HB PRO 14 -32.595 28.919 21.698 101 HG2 PRO 14 2HG PRO 14 -34.242 30.394 20.223 102 HG3 PRO 14 1HG PRO 14 -33.727 30.946 21.830 103 HD2 PRO 14 2HD PRO 14 -32.765 31.813 19.130 104 HD3 PRO 14 1HD PRO 14 -33.097 32.791 20.576 105 H SER 15 HN SER 15 -30.466 30.483 18.632 106 HA SER 15 HA SER 15 -28.110 28.770 18.894 107 HB2 SER 15 2HB SER 15 -30.429 28.290 17.027 108 HB3 SER 15 1HB SER 15 -28.849 27.537 16.815 109 HG SER 15 HG SER 15 -29.196 26.914 19.159 110 H PHE 16 HN PHE 16 -26.568 28.945 17.295 111 HA PHE 16 HA PHE 16 -26.751 30.323 14.892 112 HB2 PHE 16 2HB PHE 16 -27.012 32.339 16.349 113 HB3 PHE 16 1HB PHE 16 -25.435 31.996 17.052 114 HD1 PHE 16 1HD PHE 16 -27.002 32.449 13.695 115 HD2 PHE 16 2HD PHE 16 -23.619 33.108 16.191 116 HE1 PHE 16 1HE PHE 16 -25.929 33.739 11.895 117 HE2 PHE 16 2HE PHE 16 -22.543 34.400 14.397 118 HZ PHE 16 HZ PHE 16 -23.696 34.717 12.245 119 H ASP 17 HN ASP 17 -25.636 28.352 14.482 120 HA ASP 17 HA ASP 17 -22.797 28.514 14.601 121 HB2 ASP 17 2HB ASP 17 -22.442 26.456 15.983 122 HB3 ASP 17 1HB ASP 17 -23.052 27.831 16.893 123 H LYS 18 HN LYS 18 -22.489 27.956 12.555 124 HA LYS 18 HA LYS 18 -22.692 25.317 11.634 125 HB2 LYS 18 2HB LYS 18 -25.105 25.695 11.565 126 HB3 LYS 18 1HB LYS 18 -24.875 27.164 10.629 127 HG2 LYS 18 2HG LYS 18 -23.848 25.732 8.837 128 HG3 LYS 18 1HG LYS 18 -24.392 24.329 9.755 129 HD2 LYS 18 2HD LYS 18 -26.679 24.976 9.515 130 HD3 LYS 18 1HD LYS 18 -26.217 26.530 8.814 131 HE2 LYS 18 2HE LYS 18 -26.937 25.005 7.069 132 HE3 LYS 18 1HE LYS 18 -25.218 25.363 6.905 133 HZ1 LYS 18 3HZ LYS 18 -24.736 23.234 8.003 134 HZ2 LYS 18 1HZ LYS 18 -25.621 23.024 6.572 135 HZ3 LYS 18 2HZ LYS 18 -26.395 22.894 8.074 136 H PHE 19 HN PHE 19 -21.770 25.060 9.552 137 HA PHE 19 HA PHE 19 -21.407 27.423 7.930 138 HB2 PHE 19 2HB PHE 19 -19.254 26.948 9.326 139 HB3 PHE 19 1HB PHE 19 -19.036 25.588 8.230 140 HD1 PHE 19 1HD PHE 19 -18.594 25.970 5.848 141 HD2 PHE 19 2HD PHE 19 -18.954 29.197 8.601 142 HE1 PHE 19 1HE PHE 19 -17.550 27.484 4.208 143 HE2 PHE 19 2HE PHE 19 -17.917 30.713 6.968 144 HZ PHE 19 HZ PHE 19 -17.212 29.858 4.770 145 H LEU 20 HN LEU 20 -21.555 23.527 6.677 146 HA LEU 20 HA LEU 20 -19.237 24.488 8.189 147 HB2 LEU 20 2HB LEU 20 -21.202 22.332 8.833 148 HB3 LEU 20 1HB LEU 20 -19.522 22.064 9.242 149 HG LEU 20 HG LEU 20 -21.151 24.409 10.188 150 HD11 LEU 20 1HD1 LEU 20 -20.408 21.868 11.635 151 HD12 LEU 20 2HD1 LEU 20 -22.026 22.326 11.105 152 HD13 LEU 20 3HD1 LEU 20 -21.208 23.267 12.354 153 HD21 LEU 20 3HD2 LEU 20 -18.432 23.377 10.997 154 HD22 LEU 20 1HD2 LEU 20 -19.300 24.688 11.795 155 HD23 LEU 20 2HD2 LEU 20 -18.771 24.871 10.123 156 H GLY 21 HN GLY 21 -17.636 24.181 6.676 157 HA2 GLY 21 2HA GLY 21 -16.008 22.624 5.878 158 HA3 GLY 21 1HA GLY 21 -17.277 21.414 5.752 159 H THR 22 HN THR 22 -17.663 20.877 3.728 160 HA THR 22 HA THR 22 -18.218 21.022 1.524 161 HB THR 22 HB THR 22 -18.150 24.039 1.861 162 HG1 THR 22 1HG THR 22 -19.738 22.405 3.061 163 HG21 THR 22 3HG2 THR 22 -19.458 22.297 -0.238 164 HG22 THR 22 1HG2 THR 22 -18.112 23.406 -0.488 165 HG23 THR 22 2HG2 THR 22 -19.705 24.034 -0.069 166 H GLU 23 HN GLU 23 -17.210 21.821 -0.619 167 HA GLU 23 HA GLU 23 -15.424 22.065 -1.988 168 HB2 GLU 23 2HB GLU 23 -14.009 23.132 0.468 169 HB3 GLU 23 1HB GLU 23 -13.314 23.106 -1.148 170 HG2 GLU 23 2HG GLU 23 -14.993 24.612 -1.956 171 HG3 GLU 23 1HG GLU 23 -15.853 24.541 -0.420 172 H ASN 24 HN ASN 24 -15.857 19.701 -1.744 173 HA ASN 24 HA ASN 24 -13.675 18.279 -0.361 174 HB2 ASN 24 2HB ASN 24 -16.346 17.216 -1.309 175 HB3 ASN 24 1HB ASN 24 -15.146 16.327 -0.383 176 HD21 ASN 24 1HD2 ASN 24 -14.510 18.575 1.373 177 HD22 ASN 24 2HD2 ASN 24 -15.862 18.728 2.441 178 H ALA 25 HN ALA 25 -13.753 19.532 -3.134 179 HA ALA 25 HA ALA 25 -13.912 17.547 -5.117 180 HB1 ALA 25 1HB ALA 25 -12.719 19.110 -6.552 181 HB2 ALA 25 2HB ALA 25 -12.255 20.070 -5.146 182 HB3 ALA 25 3HB ALA 25 -13.951 19.948 -5.612 183 H GLU 26 HN GLU 26 -11.388 18.328 -2.882 184 HA GLU 26 HA GLU 26 -9.214 17.150 -4.197 185 HB2 GLU 26 2HB GLU 26 -9.722 17.305 -1.222 186 HB3 GLU 26 1HB GLU 26 -8.165 17.053 -1.997 187 HG2 GLU 26 2HG GLU 26 -8.322 19.266 -3.019 188 HG3 GLU 26 1HG GLU 26 -9.874 19.514 -2.224 189 H LEU 27 HN LEU 27 -11.849 15.787 -2.371 190 HA LEU 27 HA LEU 27 -10.678 13.202 -2.045 191 HB2 LEU 27 2HB LEU 27 -13.439 14.327 -1.685 192 HB3 LEU 27 1HB LEU 27 -13.138 12.614 -1.555 193 HG LEU 27 HG LEU 27 -13.182 13.510 0.649 194 HD11 LEU 27 1HD1 LEU 27 -10.928 12.986 1.466 195 HD12 LEU 27 2HD1 LEU 27 -10.331 13.017 -0.194 196 HD13 LEU 27 3HD1 LEU 27 -11.512 11.802 0.298 197 HD21 LEU 27 3HD2 LEU 27 -11.681 15.305 1.391 198 HD22 LEU 27 1HD2 LEU 27 -12.800 15.853 0.141 199 HD23 LEU 27 2HD2 LEU 27 -11.118 15.512 -0.267 200 H VAL 28 HN VAL 28 -12.780 14.787 -4.352 201 HA VAL 28 HA VAL 28 -13.599 12.532 -5.827 202 HB VAL 28 HB VAL 28 -13.149 15.330 -6.891 203 HG11 VAL 28 1HG1 VAL 28 -14.972 13.125 -7.836 204 HG12 VAL 28 2HG1 VAL 28 -13.497 13.673 -8.633 205 HG13 VAL 28 3HG1 VAL 28 -14.884 14.756 -8.506 206 HG21 VAL 28 3HG2 VAL 28 -15.581 14.154 -5.555 207 HG22 VAL 28 1HG2 VAL 28 -15.514 15.727 -6.350 208 HG23 VAL 28 2HG2 VAL 28 -14.540 15.424 -4.914 209 H TYR 29 HN TYR 29 -10.724 14.525 -5.920 210 HA TYR 29 HA TYR 29 -9.528 13.436 -8.232 211 HB2 TYR 29 2HB TYR 29 -8.490 15.382 -7.543 212 HB3 TYR 29 1HB TYR 29 -8.577 14.952 -5.842 213 HD1 TYR 29 2HD TYR 29 -6.765 14.152 -9.002 214 HD2 TYR 29 1HD TYR 29 -6.730 14.019 -4.748 215 HE1 TYR 29 2HE TYR 29 -4.420 13.407 -9.047 216 HE2 TYR 29 1HE TYR 29 -4.389 13.265 -4.782 217 HH TYR 29 HH TYR 29 -2.453 13.390 -7.583 218 H VAL 30 HN VAL 30 -9.595 12.374 -4.893 219 HA VAL 30 HA VAL 30 -7.354 10.635 -5.080 220 HB VAL 30 HB VAL 30 -9.562 10.680 -3.017 221 HG11 VAL 30 1HG1 VAL 30 -7.982 9.522 -1.568 222 HG12 VAL 30 2HG1 VAL 30 -6.815 9.447 -2.887 223 HG13 VAL 30 3HG1 VAL 30 -8.339 8.569 -3.009 224 HG21 VAL 30 3HG2 VAL 30 -6.838 11.974 -2.986 225 HG22 VAL 30 1HG2 VAL 30 -8.012 11.993 -1.671 226 HG23 VAL 30 2HG2 VAL 30 -8.375 12.813 -3.190 227 H LEU 31 HN LEU 31 -10.856 10.093 -5.246 228 HA LEU 31 HA LEU 31 -10.703 7.281 -5.009 229 HB2 LEU 31 2HB LEU 31 -12.823 9.224 -5.771 230 HB3 LEU 31 1HB LEU 31 -13.089 7.528 -6.122 231 HG LEU 31 HG LEU 31 -14.126 8.095 -4.016 232 HD11 LEU 31 1HD1 LEU 31 -13.049 6.450 -2.561 233 HD12 LEU 31 2HD1 LEU 31 -11.636 6.449 -3.615 234 HD13 LEU 31 3HD1 LEU 31 -13.187 5.868 -4.219 235 HD21 LEU 31 3HD2 LEU 31 -12.790 8.814 -2.082 236 HD22 LEU 31 1HD2 LEU 31 -12.788 10.011 -3.378 237 HD23 LEU 31 2HD2 LEU 31 -11.382 8.976 -3.131 238 H ARG 32 HN ARG 32 -12.178 6.102 -6.856 239 HA ARG 32 HA ARG 32 -12.206 5.084 -8.875 240 HB2 ARG 32 2HB ARG 32 -10.716 7.498 -9.912 241 HB3 ARG 32 1HB ARG 32 -11.492 6.264 -10.892 242 HG2 ARG 32 2HG ARG 32 -13.666 6.917 -9.879 243 HG3 ARG 32 1HG ARG 32 -12.832 8.251 -9.075 244 HD2 ARG 32 2HD ARG 32 -13.218 7.790 -12.021 245 HD3 ARG 32 1HD ARG 32 -13.779 9.148 -11.049 246 HE ARG 32 HE ARG 32 -11.073 8.706 -12.057 247 HH11 ARG 32 1HH1 ARG 32 -13.246 10.629 -10.103 248 HH12 ARG 32 2HH1 ARG 32 -12.229 12.038 -10.122 249 HH21 ARG 32 1HH2 ARG 32 -9.720 10.561 -12.097 250 HH22 ARG 32 2HH2 ARG 32 -10.205 11.989 -11.218 251 H HIS 33 HN HIS 33 -10.113 4.502 -7.018 252 HA HIS 33 HA HIS 33 -8.134 3.517 -8.954 253 HB2 HIS 33 2HB HIS 33 -7.550 4.733 -6.251 254 HB3 HIS 33 1HB HIS 33 -6.392 3.731 -7.117 255 HD1 HIS 33 1HD HIS 33 -7.715 7.172 -6.926 256 HD2 HIS 33 2HD HIS 33 -5.453 4.894 -9.575 257 HE1 HIS 33 1HE HIS 33 -6.648 8.815 -8.491 258 HE2 HIS 33 2HE HIS 33 -5.436 7.412 -10.195 259 H LYS 34 HN LYS 34 -8.764 1.440 -9.089 260 HA LYS 34 HA LYS 34 -8.969 -0.101 -6.570 261 HB2 LYS 34 2HB LYS 34 -11.021 0.290 -8.269 262 HB3 LYS 34 1HB LYS 34 -10.277 -1.086 -9.062 263 HG2 LYS 34 2HG LYS 34 -11.350 -0.980 -6.249 264 HG3 LYS 34 1HG LYS 34 -12.042 -1.835 -7.623 265 HD2 LYS 34 2HD LYS 34 -9.946 -3.198 -7.718 266 HD3 LYS 34 1HD LYS 34 -9.456 -2.435 -6.206 267 HE2 LYS 34 2HE LYS 34 -11.839 -4.209 -6.698 268 HE3 LYS 34 1HE LYS 34 -10.443 -4.541 -5.676 269 HZ1 LYS 34 3HZ LYS 34 -12.702 -2.709 -5.183 270 HZ2 LYS 34 1HZ LYS 34 -11.223 -2.471 -4.389 271 HZ3 LYS 34 2HZ LYS 34 -12.072 -3.922 -4.179 272 H HIS 35 HN HIS 35 -7.558 -1.787 -6.387 273 HA HIS 35 HA HIS 35 -6.566 -3.037 -8.841 274 HB2 HIS 35 2HB HIS 35 -4.289 -3.241 -7.893 275 HB3 HIS 35 1HB HIS 35 -4.756 -1.572 -8.181 276 HD1 HIS 35 1HD HIS 35 -4.644 -4.007 -5.233 277 HD2 HIS 35 2HD HIS 35 -4.251 0.049 -6.085 278 HE1 HIS 35 1HE HIS 35 -3.933 -2.930 -3.079 279 HE2 HIS 35 2HE HIS 35 -3.894 -0.461 -3.574 280 H GLY 36 HN GLY 36 -5.160 -5.090 -8.032 281 HA2 GLY 36 2HA GLY 36 -7.142 -6.851 -7.046 282 HA3 GLY 36 1HA GLY 36 -5.470 -7.261 -7.376 283 H GLN 37 HN GLN 37 -5.928 -8.684 -5.513 284 HA GLN 37 HA GLN 37 -6.507 -7.663 -2.938 285 HB2 GLN 37 2HB GLN 37 -5.450 -10.304 -3.913 286 HB3 GLN 37 1HB GLN 37 -5.646 -9.968 -2.200 287 HG2 GLN 37 2HG GLN 37 -8.026 -9.575 -2.544 288 HG3 GLN 37 1HG GLN 37 -7.833 -9.902 -4.265 289 HE21 GLN 37 1HE2 GLN 37 -7.704 -11.286 -1.056 290 HE22 GLN 37 2HE2 GLN 37 -7.900 -12.936 -1.550 291 H PHE 38 HN PHE 38 -3.615 -9.588 -3.503 292 HA PHE 38 HA PHE 38 -2.233 -8.032 -1.490 293 HB2 PHE 38 2HB PHE 38 -1.458 -10.541 -2.991 294 HB3 PHE 38 1HB PHE 38 -0.471 -9.791 -1.740 295 HD1 PHE 38 1HD PHE 38 -1.125 -9.891 0.591 296 HD2 PHE 38 2HD PHE 38 -3.480 -11.732 -2.434 297 HE1 PHE 38 1HE PHE 38 -2.324 -11.181 2.312 298 HE2 PHE 38 2HE PHE 38 -4.686 -13.021 -0.722 299 HZ PHE 38 HZ PHE 38 -4.105 -12.747 1.654 300 H ILE 39 HN ILE 39 -1.476 -6.143 -2.254 301 HA ILE 39 HA ILE 39 0.164 -6.224 -4.702 302 HB ILE 39 HB ILE 39 -1.761 -4.017 -3.960 303 HG12 ILE 39 2HG1 ILE 39 -2.951 -6.012 -4.747 304 HG13 ILE 39 1HG1 ILE 39 -3.051 -4.715 -5.933 305 HG21 ILE 39 1HG2 ILE 39 -1.202 -3.093 -6.171 306 HG22 ILE 39 2HG2 ILE 39 0.009 -4.358 -6.374 307 HG23 ILE 39 3HG2 ILE 39 0.192 -3.160 -5.094 308 HD11 ILE 39 3HD1 ILE 39 -1.249 -5.807 -7.216 309 HD12 ILE 39 1HD1 ILE 39 -2.690 -6.810 -7.046 310 HD13 ILE 39 2HD1 ILE 39 -1.267 -7.136 -6.057 311 H TYR 40 HN TYR 40 2.122 -5.443 -4.427 312 HA TYR 40 HA TYR 40 2.612 -3.513 -2.255 313 HB2 TYR 40 2HB TYR 40 3.958 -5.444 -1.874 314 HB3 TYR 40 1HB TYR 40 4.413 -5.553 -3.570 315 HD1 TYR 40 1HD TYR 40 4.697 -3.184 -0.686 316 HD2 TYR 40 2HD TYR 40 6.499 -4.785 -4.187 317 HE1 TYR 40 1HE TYR 40 6.737 -1.890 -0.224 318 HE2 TYR 40 2HE TYR 40 8.535 -3.488 -3.739 319 HH TYR 40 HH TYR 40 8.938 -1.663 -0.760 320 H VAL 41 HN VAL 41 3.215 -1.519 -2.801 321 HA VAL 41 HA VAL 41 4.035 -1.043 -5.592 322 HB VAL 41 HB VAL 41 2.980 1.200 -5.423 323 HG11 VAL 41 1HG1 VAL 41 0.656 0.441 -5.646 324 HG12 VAL 41 2HG1 VAL 41 1.119 -1.127 -4.983 325 HG13 VAL 41 3HG1 VAL 41 1.784 -0.588 -6.524 326 HG21 VAL 41 3HG2 VAL 41 2.960 1.502 -3.025 327 HG22 VAL 41 1HG2 VAL 41 1.866 0.131 -2.831 328 HG23 VAL 41 2HG2 VAL 41 1.310 1.595 -3.641 329 H TRP 42 HN TRP 42 5.707 0.388 -5.934 330 HA TRP 42 HA TRP 42 7.355 1.064 -3.664 331 HB2 TRP 42 2HB TRP 42 7.701 1.902 -6.551 332 HB3 TRP 42 1HB TRP 42 8.924 1.958 -5.290 333 HD1 TRP 42 1HD TRP 42 8.139 -1.125 -4.274 334 HE1 TRP 42 1HE TRP 42 9.094 -3.062 -5.666 335 HE3 TRP 42 3HE TRP 42 9.152 1.404 -8.600 336 HZ2 TRP 42 2HZ TRP 42 10.145 -3.472 -8.251 337 HZ3 TRP 42 3HZ TRP 42 10.137 0.163 -10.487 338 HH2 TRP 42 2HH TRP 42 10.622 -2.222 -10.312 339 H GLY 43 HN GLY 43 6.508 3.185 -6.366 340 HA2 GLY 43 2HA GLY 43 4.962 4.990 -6.254 341 HA3 GLY 43 1HA GLY 43 5.139 4.987 -4.506 342 H GLU 44 HN GLU 44 5.300 7.351 -5.225 343 HA GLU 44 HA GLU 44 7.692 8.311 -6.361 344 HB2 GLU 44 2HB GLU 44 6.952 10.501 -5.382 345 HB3 GLU 44 1HB GLU 44 5.749 9.700 -6.382 346 HG2 GLU 44 2HG GLU 44 4.719 8.819 -4.272 347 HG3 GLU 44 1HG GLU 44 5.823 9.861 -3.379 348 H GLU 45 HN GLU 45 6.607 8.066 -3.006 349 HA GLU 45 HA GLU 45 8.950 7.167 -1.888 350 HB2 GLU 45 2HB GLU 45 9.981 9.314 -2.507 351 HB3 GLU 45 1HB GLU 45 8.711 10.180 -1.651 352 HG2 GLU 45 2HG GLU 45 9.450 9.181 0.456 353 HG3 GLU 45 1HG GLU 45 10.731 8.326 -0.401 354 H GLY 46 HN GLY 46 6.368 9.506 -1.414 355 HA2 GLY 46 2HA GLY 46 4.597 8.406 0.153 356 HA3 GLY 46 1HA GLY 46 5.915 8.546 1.312 357 H ALA 47 HN ALA 47 4.030 10.475 -0.996 358 HA ALA 47 HA ALA 47 4.191 12.735 0.850 359 HB1 ALA 47 1HB ALA 47 4.606 14.279 -0.983 360 HB2 ALA 47 2HB ALA 47 4.632 12.939 -2.130 361 HB3 ALA 47 3HB ALA 47 5.890 13.073 -0.901 362 H GLY 48 HN GLY 48 2.364 13.890 1.010 363 HA2 GLY 48 2HA GLY 48 0.208 14.640 0.364 364 HA3 GLY 48 1HA GLY 48 0.153 13.368 -0.851 365 H LYS 49 HN LYS 49 1.342 12.241 2.046 366 HA LYS 49 HA LYS 49 0.625 10.724 3.539 367 HB2 LYS 49 2HB LYS 49 -0.391 12.750 4.512 368 HB3 LYS 49 1HB LYS 49 -1.871 12.422 3.616 369 HG2 LYS 49 2HG LYS 49 -2.065 10.261 4.807 370 HG3 LYS 49 1HG LYS 49 -0.647 10.697 5.760 371 HD2 LYS 49 2HD LYS 49 -1.835 12.662 6.617 372 HD3 LYS 49 1HD LYS 49 -3.253 12.215 5.667 373 HE2 LYS 49 2HE LYS 49 -3.544 11.494 7.957 374 HE3 LYS 49 1HE LYS 49 -3.380 10.087 6.907 375 HZ1 LYS 49 3HZ LYS 49 -1.046 9.931 7.571 376 HZ2 LYS 49 1HZ LYS 49 -2.072 9.815 8.905 377 HZ3 LYS 49 2HZ LYS 49 -1.238 11.259 8.606 378 H SER 50 HN SER 50 0.574 9.074 1.949 379 HA SER 50 HA SER 50 -0.343 7.135 1.187 380 HB2 SER 50 2HB SER 50 -2.754 7.737 2.893 381 HB3 SER 50 1HB SER 50 -2.039 6.170 2.519 382 HG SER 50 HG SER 50 -0.105 7.214 3.690 383 H HIS 51 HN HIS 51 -1.091 9.694 -0.239 384 HA HIS 51 HA HIS 51 -3.799 9.812 -0.807 385 HB2 HIS 51 2HB HIS 51 -3.309 11.244 -2.650 386 HB3 HIS 51 1HB HIS 51 -2.144 11.587 -1.382 387 HD1 HIS 51 1HD HIS 51 -2.322 11.205 -4.895 388 HD2 HIS 51 2HD HIS 51 0.431 10.078 -1.992 389 HE1 HIS 51 1HE HIS 51 -0.159 10.846 -6.120 390 HE2 HIS 51 2HE HIS 51 1.547 10.442 -4.303 391 H LEU 52 HN LEU 52 -1.395 7.707 -2.251 392 HA LEU 52 HA LEU 52 -3.094 6.814 -4.365 393 HB2 LEU 52 2HB LEU 52 -0.749 6.704 -4.721 394 HB3 LEU 52 1HB LEU 52 -0.490 5.859 -3.207 395 HG LEU 52 HG LEU 52 -1.688 3.915 -4.136 396 HD11 LEU 52 1HD1 LEU 52 -3.022 5.089 -5.821 397 HD12 LEU 52 2HD1 LEU 52 -2.089 3.771 -6.532 398 HD13 LEU 52 3HD1 LEU 52 -1.553 5.439 -6.733 399 HD21 LEU 52 3HD2 LEU 52 0.711 4.850 -5.698 400 HD22 LEU 52 1HD2 LEU 52 0.133 3.188 -5.606 401 HD23 LEU 52 2HD2 LEU 52 0.735 3.992 -4.157 402 H LEU 53 HN LEU 53 -2.127 5.582 -1.190 403 HA LEU 53 HA LEU 53 -3.470 3.081 -1.495 404 HB2 LEU 53 2HB LEU 53 -2.299 4.450 0.925 405 HB3 LEU 53 1HB LEU 53 -2.997 2.844 0.965 406 HG LEU 53 HG LEU 53 -1.261 2.205 -0.800 407 HD11 LEU 53 1HD1 LEU 53 0.780 3.549 -0.835 408 HD12 LEU 53 2HD1 LEU 53 -0.018 4.783 0.139 409 HD13 LEU 53 3HD1 LEU 53 -0.598 4.433 -1.490 410 HD21 LEU 53 3HD2 LEU 53 0.454 1.815 0.878 411 HD22 LEU 53 1HD2 LEU 53 -1.151 1.495 1.534 412 HD23 LEU 53 2HD2 LEU 53 -0.309 2.989 1.950 413 H GLN 54 HN GLN 54 -4.266 6.157 -0.047 414 HA GLN 54 HA GLN 54 -6.494 5.358 1.489 415 HB2 GLN 54 2HB GLN 54 -5.245 7.510 1.703 416 HB3 GLN 54 1HB GLN 54 -5.972 8.043 0.200 417 HG2 GLN 54 2HG GLN 54 -8.144 8.073 1.166 418 HG3 GLN 54 1HG GLN 54 -7.568 7.281 2.633 419 HE21 GLN 54 1HE2 GLN 54 -8.937 9.850 2.324 420 HE22 GLN 54 2HE2 GLN 54 -7.889 11.036 3.027 421 H ALA 55 HN ALA 55 -6.088 6.295 -1.835 422 HA ALA 55 HA ALA 55 -8.741 6.654 -2.629 423 HB1 ALA 55 1HB ALA 55 -6.794 7.224 -4.011 424 HB2 ALA 55 2HB ALA 55 -7.932 6.198 -4.882 425 HB3 ALA 55 3HB ALA 55 -6.450 5.507 -4.227 426 H TRP 56 HN TRP 56 -6.773 3.766 -2.359 427 HA TRP 56 HA TRP 56 -8.661 2.026 -3.623 428 HB2 TRP 56 2HB TRP 56 -6.257 1.617 -3.692 429 HB3 TRP 56 1HB TRP 56 -6.209 1.479 -1.944 430 HD1 TRP 56 1HD TRP 56 -7.916 -0.388 -4.906 431 HE1 TRP 56 1HE TRP 56 -7.877 -2.911 -4.342 432 HE3 TRP 56 3HE TRP 56 -5.864 -0.134 -0.236 433 HZ2 TRP 56 2HZ TRP 56 -7.073 -4.559 -2.185 434 HZ3 TRP 56 3HZ TRP 56 -5.494 -2.219 1.014 435 HH2 TRP 56 2HH TRP 56 -6.089 -4.382 0.061 436 H VAL 57 HN VAL 57 -7.860 2.912 -0.343 437 HA VAL 57 HA VAL 57 -9.461 0.913 0.901 438 HB VAL 57 HB VAL 57 -8.246 3.479 1.910 439 HG11 VAL 57 1HG1 VAL 57 -8.863 2.778 4.178 440 HG12 VAL 57 2HG1 VAL 57 -9.786 1.432 3.509 441 HG13 VAL 57 3HG1 VAL 57 -10.288 3.091 3.188 442 HG21 VAL 57 3HG2 VAL 57 -7.620 0.557 2.301 443 HG22 VAL 57 1HG2 VAL 57 -6.853 1.859 3.207 444 HG23 VAL 57 2HG2 VAL 57 -6.647 1.762 1.459 445 H ALA 58 HN ALA 58 -9.987 4.334 0.099 446 HA ALA 58 HA ALA 58 -12.515 4.549 1.363 447 HB1 ALA 58 1HB ALA 58 -11.418 6.194 -0.923 448 HB2 ALA 58 2HB ALA 58 -11.141 6.500 0.793 449 HB3 ALA 58 3HB ALA 58 -12.769 6.629 0.127 450 H GLN 59 HN GLN 59 -11.580 3.607 -1.922 451 HA GLN 59 HA GLN 59 -14.248 3.642 -2.914 452 HB2 GLN 59 2HB GLN 59 -13.394 2.583 -4.893 453 HB3 GLN 59 1HB GLN 59 -12.230 3.787 -4.374 454 HG2 GLN 59 2HG GLN 59 -10.867 2.037 -4.948 455 HG3 GLN 59 1HG GLN 59 -11.056 1.778 -3.217 456 HE21 GLN 59 1HE2 GLN 59 -13.590 1.103 -5.509 457 HE22 GLN 59 2HE2 GLN 59 -13.547 -0.620 -5.361 458 H ALA 60 HN ALA 60 -12.293 1.306 -1.231 459 HA ALA 60 HA ALA 60 -14.026 -0.918 -1.617 460 HB1 ALA 60 1HB ALA 60 -11.704 -1.210 -0.929 461 HB2 ALA 60 2HB ALA 60 -12.806 -1.932 0.244 462 HB3 ALA 60 3HB ALA 60 -12.042 -0.379 0.589 463 H LEU 61 HN LEU 61 -13.758 1.643 0.763 464 HA LEU 61 HA LEU 61 -15.706 0.759 2.572 465 HB2 LEU 61 2HB LEU 61 -14.714 3.503 1.834 466 HB3 LEU 61 1HB LEU 61 -15.884 3.248 3.107 467 HG LEU 61 HG LEU 61 -13.088 2.113 3.061 468 HD11 LEU 61 1HD1 LEU 61 -14.268 4.354 4.698 469 HD12 LEU 61 2HD1 LEU 61 -13.101 4.531 3.387 470 HD13 LEU 61 3HD1 LEU 61 -12.644 3.691 4.869 471 HD21 LEU 61 3HD2 LEU 61 -13.545 1.403 5.336 472 HD22 LEU 61 1HD2 LEU 61 -14.715 0.685 4.228 473 HD23 LEU 61 2HD2 LEU 61 -15.180 2.058 5.234 474 H GLU 62 HN GLU 62 -15.968 2.818 -0.311 475 HA GLU 62 HA GLU 62 -18.780 3.193 -0.041 476 HB2 GLU 62 2HB GLU 62 -17.004 3.511 -2.455 477 HB3 GLU 62 1HB GLU 62 -18.679 4.044 -2.355 478 HG2 GLU 62 2HG GLU 62 -18.032 5.507 -0.460 479 HG3 GLU 62 1HG GLU 62 -16.355 5.047 -0.746 480 H ALA 63 HN ALA 63 -16.878 0.601 -1.095 481 HA ALA 63 HA ALA 63 -18.895 -0.555 -2.827 482 HB1 ALA 63 1HB ALA 63 -16.308 -1.714 -1.790 483 HB2 ALA 63 2HB ALA 63 -16.554 -0.940 -3.357 484 HB3 ALA 63 3HB ALA 63 -17.361 -2.465 -2.991 485 H GLY 64 HN GLY 64 -18.718 -0.169 0.400 486 HA2 GLY 64 2HA GLY 64 -20.038 -1.091 2.062 487 HA3 GLY 64 1HA GLY 64 -20.645 -2.253 0.889 488 H LYS 65 HN LYS 65 -17.256 -1.769 1.479 489 HA LYS 65 HA LYS 65 -17.130 -4.360 2.856 490 HB2 LYS 65 2HB LYS 65 -15.051 -3.248 0.966 491 HB3 LYS 65 1HB LYS 65 -15.082 -4.847 1.688 492 HG2 LYS 65 2HG LYS 65 -17.143 -3.839 -0.258 493 HG3 LYS 65 1HG LYS 65 -15.730 -4.799 -0.704 494 HD2 LYS 65 2HD LYS 65 -16.492 -6.642 0.634 495 HD3 LYS 65 1HD LYS 65 -17.825 -5.679 1.276 496 HE2 LYS 65 2HE LYS 65 -17.493 -6.273 -1.652 497 HE3 LYS 65 1HE LYS 65 -18.406 -7.313 -0.565 498 HZ1 LYS 65 3HZ LYS 65 -19.790 -5.703 -1.778 499 HZ2 LYS 65 1HZ LYS 65 -18.985 -4.429 -1.005 500 HZ3 LYS 65 2HZ LYS 65 -19.909 -5.528 -0.102 501 H ASN 66 HN ASN 66 -15.338 -4.557 4.332 502 HA ASN 66 HA ASN 66 -14.864 -2.069 5.728 503 HB2 ASN 66 2HB ASN 66 -15.293 -4.379 6.801 504 HB3 ASN 66 1HB ASN 66 -13.610 -4.712 6.441 505 HD21 ASN 66 1HD2 ASN 66 -14.912 -4.527 9.016 506 HD22 ASN 66 2HD2 ASN 66 -14.101 -3.276 9.887 507 H ALA 67 HN ALA 67 -13.023 -0.930 5.786 508 HA ALA 67 HA ALA 67 -10.561 -1.947 4.672 509 HB1 ALA 67 1HB ALA 67 -12.011 0.327 3.318 510 HB2 ALA 67 2HB ALA 67 -11.801 -1.298 2.664 511 HB3 ALA 67 3HB ALA 67 -10.396 -0.264 2.917 512 H ALA 68 HN ALA 68 -8.796 -0.809 5.351 513 HA ALA 68 HA ALA 68 -9.156 1.803 6.584 514 HB1 ALA 68 1HB ALA 68 -8.042 1.119 8.670 515 HB2 ALA 68 2HB ALA 68 -8.075 -0.557 8.120 516 HB3 ALA 68 3HB ALA 68 -9.585 0.297 8.440 517 H TYR 69 HN TYR 69 -7.376 3.082 6.382 518 HA TYR 69 HA TYR 69 -4.929 1.779 5.414 519 HB2 TYR 69 2HB TYR 69 -4.425 3.624 4.062 520 HB3 TYR 69 1HB TYR 69 -6.149 3.402 3.828 521 HD1 TYR 69 2HD TYR 69 -7.733 4.943 5.120 522 HD2 TYR 69 1HD TYR 69 -3.555 5.659 4.767 523 HE1 TYR 69 2HE TYR 69 -8.093 7.310 5.684 524 HE2 TYR 69 1HE TYR 69 -3.902 8.023 5.334 525 HH TYR 69 HH TYR 69 -5.796 9.685 5.180 526 H ILE 70 HN ILE 70 -3.130 2.059 6.539 527 HA ILE 70 HA ILE 70 -3.144 4.049 8.709 528 HB ILE 70 HB ILE 70 -2.125 1.207 8.895 529 HG12 ILE 70 2HG1 ILE 70 -4.387 2.591 10.360 530 HG13 ILE 70 1HG1 ILE 70 -4.584 1.414 9.066 531 HG21 ILE 70 1HG2 ILE 70 -1.591 1.756 11.229 532 HG22 ILE 70 2HG2 ILE 70 -2.046 3.433 10.931 533 HG23 ILE 70 3HG2 ILE 70 -0.661 2.731 10.092 534 HD11 ILE 70 3HD1 ILE 70 -4.957 0.373 11.205 535 HD12 ILE 70 1HD1 ILE 70 -3.374 0.907 11.773 536 HD13 ILE 70 2HD1 ILE 70 -3.491 -0.278 10.472 537 H ASP 71 HN ASP 71 -1.524 5.422 8.469 538 HA ASP 71 HA ASP 71 0.810 4.598 6.919 539 HB2 ASP 71 2HB ASP 71 1.343 7.000 6.758 540 HB3 ASP 71 1HB ASP 71 -0.257 6.642 6.125 541 H ALA 72 HN ALA 72 2.465 3.901 8.005 542 HA ALA 72 HA ALA 72 2.539 3.968 10.844 543 HB1 ALA 72 1HB ALA 72 4.609 2.718 10.629 544 HB2 ALA 72 2HB ALA 72 4.662 3.082 8.904 545 HB3 ALA 72 3HB ALA 72 3.368 2.074 9.554 546 H ALA 73 HN ALA 73 3.174 6.448 8.903 547 HA ALA 73 HA ALA 73 5.515 7.410 10.348 548 HB1 ALA 73 1HB ALA 73 5.500 7.719 7.926 549 HB2 ALA 73 2HB ALA 73 5.501 9.275 8.758 550 HB3 ALA 73 3HB ALA 73 4.010 8.655 8.046 551 H SER 74 HN SER 74 2.106 7.653 10.377 552 HA SER 74 HA SER 74 2.316 9.749 12.425 553 HB2 SER 74 2HB SER 74 1.513 10.765 10.320 554 HB3 SER 74 1HB SER 74 0.183 9.608 10.275 555 HG SER 74 HG SER 74 -0.147 10.579 12.560 556 H MET 75 HN MET 75 1.101 6.702 11.482 557 HA MET 75 HA MET 75 -0.486 6.561 13.945 558 HB2 MET 75 2HB MET 75 -1.420 5.733 11.194 559 HB3 MET 75 1HB MET 75 -2.216 5.225 12.673 560 HG2 MET 75 2HG MET 75 -2.502 7.673 13.209 561 HG3 MET 75 1HG MET 75 -1.966 8.003 11.564 562 HE1 MET 75 3HE MET 75 -4.772 6.232 9.445 563 HE2 MET 75 1HE MET 75 -3.234 5.547 9.971 564 HE3 MET 75 2HE MET 75 -3.303 7.206 9.379 565 HA PRO 76 HA PRO 76 1.534 2.580 14.048 566 HB2 PRO 76 2HB PRO 76 0.425 1.776 16.429 567 HB3 PRO 76 1HB PRO 76 1.800 2.868 16.292 568 HG2 PRO 76 2HG PRO 76 -0.884 3.443 17.190 569 HG3 PRO 76 1HG PRO 76 0.536 4.499 17.201 570 HD2 PRO 76 2HD PRO 76 -1.702 4.415 15.316 571 HD3 PRO 76 1HD PRO 76 -0.480 5.679 15.551 572 H LEU 77 HN LEU 77 1.027 0.324 13.976 573 HA LEU 77 HA LEU 77 -1.511 -0.219 12.723 574 HB2 LEU 77 2HB LEU 77 0.628 -1.226 11.958 575 HB3 LEU 77 1HB LEU 77 0.724 -2.115 13.466 576 HG LEU 77 HG LEU 77 -1.352 -3.320 12.872 577 HD11 LEU 77 1HD1 LEU 77 -2.406 -1.651 11.466 578 HD12 LEU 77 2HD1 LEU 77 -2.205 -3.158 10.572 579 HD13 LEU 77 3HD1 LEU 77 -1.113 -1.805 10.277 580 HD21 LEU 77 3HD2 LEU 77 0.813 -3.431 10.781 581 HD22 LEU 77 1HD2 LEU 77 -0.387 -4.687 11.088 582 HD23 LEU 77 2HD2 LEU 77 0.807 -4.289 12.321 583 H THR 78 HN THR 78 -3.136 -1.583 13.520 584 HA THR 78 HA THR 78 -2.981 -2.193 16.386 585 HB THR 78 HB THR 78 -5.421 -1.523 16.504 586 HG1 THR 78 1HG THR 78 -5.842 0.173 14.783 587 HG21 THR 78 3HG2 THR 78 -3.650 -0.127 17.448 588 HG22 THR 78 1HG2 THR 78 -4.933 0.865 16.758 589 HG23 THR 78 2HG2 THR 78 -3.416 0.653 15.883 590 H ASP 79 HN ASP 79 -4.763 -3.676 17.075 591 HA ASP 79 HA ASP 79 -4.804 -5.973 15.373 592 HB2 ASP 79 2HB ASP 79 -5.993 -7.074 17.176 593 HB3 ASP 79 1HB ASP 79 -4.668 -6.134 17.846 594 H ALA 80 HN ALA 80 -6.835 -3.271 15.804 595 HA ALA 80 HA ALA 80 -9.347 -4.273 15.111 596 HB1 ALA 80 1HB ALA 80 -8.161 -1.574 14.476 597 HB2 ALA 80 2HB ALA 80 -9.008 -2.021 15.958 598 HB3 ALA 80 3HB ALA 80 -9.875 -1.984 14.423 599 H ALA 81 HN ALA 81 -6.529 -3.760 13.186 600 HA ALA 81 HA ALA 81 -7.604 -3.372 10.652 601 HB1 ALA 81 1HB ALA 81 -5.228 -3.117 11.210 602 HB2 ALA 81 2HB ALA 81 -5.469 -4.143 9.797 603 HB3 ALA 81 3HB ALA 81 -5.085 -4.869 11.358 604 H PHE 82 HN PHE 82 -7.486 -6.275 12.568 605 HA PHE 82 HA PHE 82 -7.709 -8.125 10.426 606 HB2 PHE 82 2HB PHE 82 -8.273 -8.344 13.374 607 HB3 PHE 82 1HB PHE 82 -8.511 -9.688 12.268 608 HD1 PHE 82 1HD PHE 82 -6.443 -10.273 10.762 609 HD2 PHE 82 2HD PHE 82 -6.233 -8.094 14.413 610 HE1 PHE 82 1HE PHE 82 -4.070 -10.878 10.984 611 HE2 PHE 82 2HE PHE 82 -3.860 -8.697 14.636 612 HZ PHE 82 HZ PHE 82 -2.776 -10.089 12.924 613 H GLU 83 HN GLU 83 -9.969 -5.968 11.770 614 HA GLU 83 HA GLU 83 -12.314 -7.514 11.192 615 HB2 GLU 83 2HB GLU 83 -11.956 -4.560 11.667 616 HB3 GLU 83 1HB GLU 83 -13.508 -5.357 11.487 617 HG2 GLU 83 2HG GLU 83 -12.864 -6.793 13.440 618 HG3 GLU 83 1HG GLU 83 -11.506 -5.701 13.679 619 H ALA 84 HN ALA 84 -10.173 -5.527 9.410 620 HA ALA 84 HA ALA 84 -12.120 -4.764 7.414 621 HB1 ALA 84 1HB ALA 84 -10.317 -3.469 6.428 622 HB2 ALA 84 2HB ALA 84 -9.162 -4.199 7.545 623 HB3 ALA 84 3HB ALA 84 -10.441 -3.149 8.159 624 H GLU 85 HN GLU 85 -12.025 -5.282 5.273 625 HA GLU 85 HA GLU 85 -10.730 -7.802 4.594 626 HB2 GLU 85 2HB GLU 85 -13.132 -7.200 3.969 627 HB3 GLU 85 1HB GLU 85 -12.447 -6.066 2.815 628 HG2 GLU 85 2HG GLU 85 -13.033 -8.086 1.678 629 HG3 GLU 85 1HG GLU 85 -11.276 -7.945 1.720 630 H TYR 86 HN TYR 86 -10.639 -4.392 3.865 631 HA TYR 86 HA TYR 86 -8.337 -4.784 2.067 632 HB2 TYR 86 2HB TYR 86 -10.286 -2.498 2.358 633 HB3 TYR 86 1HB TYR 86 -8.813 -2.378 1.411 634 HD1 TYR 86 1HD TYR 86 -11.806 -4.645 1.692 635 HD2 TYR 86 2HD TYR 86 -8.994 -2.696 -0.837 636 HE1 TYR 86 1HE TYR 86 -13.009 -5.482 -0.287 637 HE2 TYR 86 2HE TYR 86 -10.181 -3.534 -2.814 638 HH TYR 86 HH TYR 86 -13.289 -4.994 -2.625 639 H LEU 87 HN LEU 87 -6.432 -4.532 3.074 640 HA LEU 87 HA LEU 87 -6.234 -2.403 5.107 641 HB2 LEU 87 2HB LEU 87 -4.922 -5.101 4.979 642 HB3 LEU 87 1HB LEU 87 -4.205 -3.796 5.899 643 HG LEU 87 HG LEU 87 -5.418 -5.114 7.437 644 HD11 LEU 87 1HD1 LEU 87 -5.671 -2.719 7.751 645 HD12 LEU 87 2HD1 LEU 87 -7.114 -3.587 8.276 646 HD13 LEU 87 3HD1 LEU 87 -7.114 -2.728 6.735 647 HD21 LEU 87 3HD2 LEU 87 -6.792 -6.356 5.870 648 HD22 LEU 87 1HD2 LEU 87 -7.777 -4.921 5.573 649 HD23 LEU 87 2HD2 LEU 87 -7.779 -5.680 7.166 650 H ALA 88 HN ALA 88 -5.023 -0.759 4.540 651 HA ALA 88 HA ALA 88 -2.789 -1.226 2.674 652 HB1 ALA 88 1HB ALA 88 -4.468 1.269 2.920 653 HB2 ALA 88 2HB ALA 88 -4.582 0.078 1.623 654 HB3 ALA 88 3HB ALA 88 -3.112 1.033 1.817 655 H VAL 89 HN VAL 89 -0.875 -0.928 3.587 656 HA VAL 89 HA VAL 89 -0.699 0.866 5.918 657 HB VAL 89 HB VAL 89 1.119 -1.443 5.206 658 HG11 VAL 89 1HG1 VAL 89 2.297 0.345 6.384 659 HG12 VAL 89 2HG1 VAL 89 2.111 -1.076 7.414 660 HG13 VAL 89 3HG1 VAL 89 1.068 0.327 7.649 661 HG21 VAL 89 3HG2 VAL 89 -1.063 -2.233 5.937 662 HG22 VAL 89 1HG2 VAL 89 -0.984 -1.192 7.357 663 HG23 VAL 89 2HG2 VAL 89 0.141 -2.540 7.190 664 H ASP 90 HN ASP 90 0.199 2.718 5.496 665 HA ASP 90 HA ASP 90 1.876 3.049 3.123 666 HB2 ASP 90 2HB ASP 90 -0.129 4.520 3.656 667 HB3 ASP 90 1HB ASP 90 0.812 5.179 4.987 668 H GLN 91 HN GLN 91 4.019 3.542 3.231 669 HA GLN 91 HA GLN 91 6.116 3.415 4.060 670 HB2 GLN 91 2HB GLN 91 4.808 4.913 6.312 671 HB3 GLN 91 1HB GLN 91 6.494 4.446 6.396 672 HG2 GLN 91 2HG GLN 91 6.556 6.624 5.616 673 HG3 GLN 91 1HG GLN 91 6.769 5.650 4.169 674 HE21 GLN 91 1HE2 GLN 91 3.700 6.138 5.788 675 HE22 GLN 91 2HE2 GLN 91 2.967 7.054 4.517 676 H VAL 92 HN VAL 92 5.866 1.095 4.041 677 HA VAL 92 HA VAL 92 5.239 -0.247 6.525 678 HB VAL 92 HB VAL 92 4.718 -1.291 4.334 679 HG11 VAL 92 1HG1 VAL 92 6.500 -2.324 3.008 680 HG12 VAL 92 2HG1 VAL 92 7.707 -1.581 4.059 681 HG13 VAL 92 3HG1 VAL 92 6.659 -0.568 3.067 682 HG21 VAL 92 3HG2 VAL 92 5.575 -3.550 4.862 683 HG22 VAL 92 1HG2 VAL 92 4.864 -2.725 6.249 684 HG23 VAL 92 2HG2 VAL 92 6.617 -2.831 6.091 685 H GLU 93 HN GLU 93 7.968 1.096 5.014 686 HA GLU 93 HA GLU 93 10.094 -0.279 6.195 687 HB2 GLU 93 2HB GLU 93 11.343 1.870 5.851 688 HB3 GLU 93 1HB GLU 93 10.497 1.293 4.420 689 HG2 GLU 93 2HG GLU 93 8.749 2.900 4.720 690 HG3 GLU 93 1HG GLU 93 9.392 3.380 6.287 691 H LYS 94 HN LYS 94 7.736 1.736 7.613 692 HA LYS 94 HA LYS 94 9.456 2.569 9.813 693 HB2 LYS 94 2HB LYS 94 7.011 3.561 8.581 694 HB3 LYS 94 1HB LYS 94 6.930 3.559 10.324 695 HG2 LYS 94 2HG LYS 94 7.681 5.672 9.522 696 HG3 LYS 94 1HG LYS 94 8.942 4.869 10.457 697 HD2 LYS 94 2HD LYS 94 10.274 4.546 8.631 698 HD3 LYS 94 1HD LYS 94 8.904 4.493 7.509 699 HE2 LYS 94 2HE LYS 94 8.594 6.814 7.632 700 HE3 LYS 94 1HE LYS 94 9.681 6.956 9.007 701 HZ1 LYS 94 3HZ LYS 94 11.544 6.675 7.672 702 HZ2 LYS 94 1HZ LYS 94 10.544 7.640 6.706 703 HZ3 LYS 94 2HZ LYS 94 10.674 5.975 6.394 704 H LEU 95 HN LEU 95 7.908 -0.185 9.206 705 HA LEU 95 HA LEU 95 6.654 -0.514 11.803 706 HB2 LEU 95 2HB LEU 95 7.182 -2.550 9.636 707 HB3 LEU 95 1HB LEU 95 6.198 -2.797 11.061 708 HG LEU 95 HG LEU 95 5.594 -0.924 8.777 709 HD11 LEU 95 1HD1 LEU 95 3.688 -2.411 8.401 710 HD12 LEU 95 2HD1 LEU 95 4.250 -3.457 9.706 711 HD13 LEU 95 3HD1 LEU 95 5.221 -3.269 8.247 712 HD21 LEU 95 3HD2 LEU 95 3.990 -1.479 11.266 713 HD22 LEU 95 1HD2 LEU 95 3.496 -0.465 9.912 714 HD23 LEU 95 2HD2 LEU 95 4.861 0.014 10.919 715 H GLY 96 HN GLY 96 7.564 -1.557 13.543 716 HA2 GLY 96 2HA GLY 96 10.421 -2.206 13.191 717 HA3 GLY 96 1HA GLY 96 9.738 -1.504 14.650 718 H ASN 97 HN ASN 97 8.401 -2.836 15.995 719 HA ASN 97 HA ASN 97 9.383 -5.610 15.877 720 HB2 ASN 97 2HB ASN 97 8.507 -3.966 18.262 721 HB3 ASN 97 1HB ASN 97 9.055 -5.637 18.329 722 HD21 ASN 97 1HD2 ASN 97 10.082 -3.065 19.472 723 HD22 ASN 97 2HD2 ASN 97 11.748 -3.020 19.003 724 H GLU 98 HN GLU 98 6.772 -4.210 17.774 725 HA GLU 98 HA GLU 98 5.108 -6.470 17.476 726 HB2 GLU 98 2HB GLU 98 4.461 -3.667 18.400 727 HB3 GLU 98 1HB GLU 98 3.389 -5.050 18.568 728 HG2 GLU 98 2HG GLU 98 4.897 -6.137 20.052 729 HG3 GLU 98 1HG GLU 98 6.142 -4.923 19.759 730 H GLU 99 HN GLU 99 5.339 -3.430 15.774 731 HA GLU 99 HA GLU 99 2.840 -3.551 14.450 732 HB2 GLU 99 2HB GLU 99 5.333 -2.214 13.386 733 HB3 GLU 99 1HB GLU 99 3.667 -1.806 13.020 734 HG2 GLU 99 2HG GLU 99 4.433 -0.127 14.462 735 HG3 GLU 99 1HG GLU 99 3.425 -1.176 15.460 736 H GLN 100 HN GLN 100 6.074 -4.692 13.653 737 HA GLN 100 HA GLN 100 5.361 -5.559 11.020 738 HB2 GLN 100 2HB GLN 100 7.705 -4.950 11.966 739 HB3 GLN 100 1HB GLN 100 7.719 -6.609 12.552 740 HG2 GLN 100 2HG GLN 100 7.402 -7.422 10.277 741 HG3 GLN 100 1HG GLN 100 7.381 -5.762 9.685 742 HE21 GLN 100 1HE2 GLN 100 9.302 -4.537 9.788 743 HE22 GLN 100 2HE2 GLN 100 10.848 -5.303 9.865 744 H ALA 101 HN ALA 101 5.633 -7.053 14.194 745 HA ALA 101 HA ALA 101 5.200 -9.727 13.388 746 HB1 ALA 101 1HB ALA 101 4.652 -10.143 15.729 747 HB2 ALA 101 2HB ALA 101 4.519 -8.409 16.017 748 HB3 ALA 101 3HB ALA 101 6.077 -9.117 15.595 749 H LEU 102 HN LEU 102 3.013 -7.105 14.287 750 HA LEU 102 HA LEU 102 0.618 -8.612 14.166 751 HB2 LEU 102 2HB LEU 102 1.132 -6.221 15.112 752 HB3 LEU 102 1HB LEU 102 0.768 -5.693 13.485 753 HG LEU 102 HG LEU 102 -1.140 -5.455 15.018 754 HD11 LEU 102 1HD1 LEU 102 -1.572 -5.741 12.645 755 HD12 LEU 102 2HD1 LEU 102 -2.839 -6.488 13.617 756 HD13 LEU 102 3HD1 LEU 102 -1.607 -7.491 12.850 757 HD21 LEU 102 3HD2 LEU 102 -1.011 -8.464 15.195 758 HD22 LEU 102 1HD2 LEU 102 -2.328 -7.460 15.802 759 HD23 LEU 102 2HD2 LEU 102 -0.715 -7.316 16.500 760 H LEU 103 HN LEU 103 2.247 -6.493 11.843 761 HA LEU 103 HA LEU 103 0.564 -6.766 9.656 762 HB2 LEU 103 2HB LEU 103 2.682 -5.315 10.056 763 HB3 LEU 103 1HB LEU 103 3.556 -6.673 9.382 764 HG LEU 103 HG LEU 103 3.090 -4.829 7.771 765 HD11 LEU 103 1HD1 LEU 103 1.859 -7.485 7.093 766 HD12 LEU 103 2HD1 LEU 103 3.568 -7.064 6.964 767 HD13 LEU 103 3HD1 LEU 103 2.380 -6.265 5.933 768 HD21 LEU 103 3HD2 LEU 103 0.838 -4.591 6.870 769 HD22 LEU 103 1HD2 LEU 103 0.883 -4.198 8.588 770 HD23 LEU 103 2HD2 LEU 103 0.239 -5.751 8.054 771 H PHE 104 HN PHE 104 3.346 -8.764 10.574 772 HA PHE 104 HA PHE 104 3.269 -10.627 8.503 773 HB2 PHE 104 2HB PHE 104 5.097 -10.468 10.141 774 HB3 PHE 104 1HB PHE 104 4.027 -11.065 11.402 775 HD1 PHE 104 2HD PHE 104 5.634 -11.988 8.196 776 HD2 PHE 104 1HD PHE 104 3.747 -13.352 11.758 777 HE1 PHE 104 2HE PHE 104 6.278 -14.293 7.646 778 HE2 PHE 104 1HE PHE 104 4.387 -15.666 11.212 779 HZ PHE 104 HZ PHE 104 5.656 -16.138 9.152 780 H SER 105 HN SER 105 1.564 -10.599 11.596 781 HA SER 105 HA SER 105 0.274 -13.081 11.357 782 HB2 SER 105 2HB SER 105 0.435 -11.640 13.435 783 HB3 SER 105 1HB SER 105 -0.845 -10.642 12.756 784 HG SER 105 HG SER 105 -1.500 -12.382 14.242 785 H ILE 106 HN ILE 106 -0.607 -9.854 10.258 786 HA ILE 106 HA ILE 106 -3.173 -10.393 9.279 787 HB ILE 106 HB ILE 106 -1.132 -8.451 8.177 788 HG12 ILE 106 2HG1 ILE 106 -3.386 -8.047 10.158 789 HG13 ILE 106 1HG1 ILE 106 -1.669 -8.071 10.552 790 HG21 ILE 106 1HG2 ILE 106 -3.043 -7.280 7.202 791 HG22 ILE 106 2HG2 ILE 106 -4.122 -8.547 7.787 792 HG23 ILE 106 3HG2 ILE 106 -2.906 -8.918 6.566 793 HD11 ILE 106 3HD1 ILE 106 -2.579 -5.801 10.447 794 HD12 ILE 106 1HD1 ILE 106 -3.015 -6.059 8.757 795 HD13 ILE 106 2HD1 ILE 106 -1.319 -6.065 9.244 796 H PHE 107 HN PHE 107 -0.021 -10.575 7.607 797 HA PHE 107 HA PHE 107 -0.932 -11.478 5.134 798 HB2 PHE 107 2HB PHE 107 1.637 -11.693 6.620 799 HB3 PHE 107 1HB PHE 107 1.410 -12.753 5.236 800 HD1 PHE 107 1HD PHE 107 0.150 -11.271 3.222 801 HD2 PHE 107 2HD PHE 107 2.957 -9.896 6.110 802 HE1 PHE 107 1HE PHE 107 0.829 -9.465 1.696 803 HE2 PHE 107 2HE PHE 107 3.634 -8.081 4.590 804 HZ PHE 107 HZ PHE 107 2.572 -7.867 2.379 805 H ASN 108 HN ASN 108 -0.023 -13.331 8.016 806 HA ASN 108 HA ASN 108 -0.469 -15.895 6.956 807 HB2 ASN 108 2HB ASN 108 0.685 -15.484 9.110 808 HB3 ASN 108 1HB ASN 108 -0.847 -14.979 9.819 809 HD21 ASN 108 1HD2 ASN 108 -0.838 -16.607 11.362 810 HD22 ASN 108 2HD2 ASN 108 -1.098 -18.269 10.958 811 H ARG 109 HN ARG 109 -2.636 -13.770 8.824 812 HA ARG 109 HA ARG 109 -4.857 -15.422 8.933 813 HB2 ARG 109 2HB ARG 109 -4.283 -12.643 9.386 814 HB3 ARG 109 1HB ARG 109 -5.821 -12.791 8.551 815 HG2 ARG 109 2HG ARG 109 -6.237 -12.759 10.894 816 HG3 ARG 109 1HG ARG 109 -6.554 -14.390 10.306 817 HD2 ARG 109 2HD ARG 109 -4.349 -15.100 11.103 818 HD3 ARG 109 1HD ARG 109 -4.042 -13.467 11.698 819 HE ARG 109 HE ARG 109 -6.442 -14.694 12.740 820 HH11 ARG 109 1HH1 ARG 109 -3.004 -14.191 13.206 821 HH12 ARG 109 2HH1 ARG 109 -3.055 -14.546 14.904 822 HH21 ARG 109 1HH2 ARG 109 -6.506 -15.161 14.968 823 HH22 ARG 109 2HH2 ARG 109 -5.046 -15.090 15.911 824 H PHE 110 HN PHE 110 -3.948 -13.119 6.389 825 HA PHE 110 HA PHE 110 -6.339 -13.535 4.890 826 HB2 PHE 110 2HB PHE 110 -3.734 -12.165 4.271 827 HB3 PHE 110 1HB PHE 110 -5.035 -12.280 3.094 828 HD1 PHE 110 1HD PHE 110 -6.919 -12.110 5.830 829 HD2 PHE 110 2HD PHE 110 -4.107 -9.673 3.764 830 HE1 PHE 110 1HE PHE 110 -7.978 -10.100 6.770 831 HE2 PHE 110 2HE PHE 110 -5.162 -7.658 4.703 832 HZ PHE 110 HZ PHE 110 -7.102 -7.874 6.208 833 H ARG 111 HN ARG 111 -2.954 -14.508 4.332 834 HA ARG 111 HA ARG 111 -3.502 -15.828 1.889 835 HB2 ARG 111 2HB ARG 111 -1.278 -14.975 2.546 836 HB3 ARG 111 1HB ARG 111 -1.175 -16.216 3.778 837 HG2 ARG 111 2HG ARG 111 0.139 -16.835 1.862 838 HG3 ARG 111 1HG ARG 111 -1.224 -17.937 2.039 839 HD2 ARG 111 2HD ARG 111 -1.449 -15.549 0.259 840 HD3 ARG 111 1HD ARG 111 -0.614 -16.993 -0.299 841 HE ARG 111 HE ARG 111 -2.900 -18.051 0.527 842 HH11 ARG 111 1HH1 ARG 111 -2.358 -15.144 -1.359 843 HH12 ARG 111 2HH1 ARG 111 -3.843 -15.290 -2.249 844 HH21 ARG 111 1HH2 ARG 111 -4.811 -18.281 -0.669 845 HH22 ARG 111 2HH2 ARG 111 -5.233 -17.088 -1.872 846 H ASN 112 HN ASN 112 -3.750 -16.829 5.190 847 HA ASN 112 HA ASN 112 -3.646 -19.645 4.690 848 HB2 ASN 112 2HB ASN 112 -3.454 -18.085 6.920 849 HB3 ASN 112 1HB ASN 112 -5.092 -18.704 7.081 850 HD21 ASN 112 1HD2 ASN 112 -2.456 -19.152 8.463 851 HD22 ASN 112 2HD2 ASN 112 -2.313 -20.868 8.547 852 H SER 113 HN SER 113 -6.099 -17.203 4.634 853 HA SER 113 HA SER 113 -8.243 -19.185 4.530 854 HB2 SER 113 2HB SER 113 -8.545 -17.199 5.968 855 HB3 SER 113 1HB SER 113 -8.356 -16.155 4.562 856 HG SER 113 HG SER 113 -10.570 -16.627 5.223 857 H GLY 114 HN GLY 114 -6.823 -16.566 2.602 858 HA2 GLY 114 2HA GLY 114 -6.470 -17.158 0.205 859 HA3 GLY 114 1HA GLY 114 -8.139 -17.720 0.218 860 H LYS 115 HN LYS 115 -8.994 -15.564 1.952 861 HA LYS 115 HA LYS 115 -9.408 -13.520 -0.033 862 HB2 LYS 115 2HB LYS 115 -10.566 -14.294 2.558 863 HB3 LYS 115 1HB LYS 115 -10.515 -12.566 2.275 864 HG2 LYS 115 2HG LYS 115 -11.550 -13.297 -0.057 865 HG3 LYS 115 1HG LYS 115 -12.080 -14.676 0.906 866 HD2 LYS 115 2HD LYS 115 -12.633 -11.765 1.471 867 HD3 LYS 115 1HD LYS 115 -13.795 -12.968 0.909 868 HE2 LYS 115 2HE LYS 115 -13.717 -14.132 2.964 869 HE3 LYS 115 1HE LYS 115 -12.292 -13.240 3.499 870 HZ1 LYS 115 3HZ LYS 115 -14.362 -12.488 4.557 871 HZ2 LYS 115 1HZ LYS 115 -14.970 -12.032 3.039 872 HZ3 LYS 115 2HZ LYS 115 -13.601 -11.253 3.674 873 H GLY 116 HN GLY 116 -9.570 -11.253 1.538 874 HA2 GLY 116 2HA GLY 116 -8.288 -9.815 2.900 875 HA3 GLY 116 1HA GLY 116 -6.928 -10.919 2.751 876 H PHE 117 HN PHE 117 -7.800 -7.955 2.053 877 HA PHE 117 HA PHE 117 -6.272 -7.878 -0.466 878 HB2 PHE 117 2HB PHE 117 -8.302 -5.935 0.670 879 HB3 PHE 117 1HB PHE 117 -7.310 -5.597 -0.743 880 HD1 PHE 117 2HD PHE 117 -9.878 -7.928 0.577 881 HD2 PHE 117 1HD PHE 117 -7.991 -6.275 -2.858 882 HE1 PHE 117 2HE PHE 117 -11.574 -8.987 -0.857 883 HE2 PHE 117 1HE PHE 117 -9.679 -7.332 -4.301 884 HZ PHE 117 HZ PHE 117 -11.473 -8.690 -3.302 885 H LEU 118 HN LEU 118 -4.235 -7.200 -0.207 886 HA LEU 118 HA LEU 118 -3.616 -5.563 2.166 887 HB2 LEU 118 2HB LEU 118 -2.926 -8.133 2.001 888 HB3 LEU 118 1HB LEU 118 -1.608 -7.460 1.067 889 HG LEU 118 HG LEU 118 -1.089 -7.864 3.482 890 HD11 LEU 118 1HD1 LEU 118 -0.885 -5.019 2.504 891 HD12 LEU 118 2HD1 LEU 118 0.264 -6.321 2.193 892 HD13 LEU 118 3HD1 LEU 118 0.045 -5.710 3.834 893 HD21 LEU 118 3HD2 LEU 118 -2.992 -5.563 3.898 894 HD22 LEU 118 1HD2 LEU 118 -1.937 -6.265 5.124 895 HD23 LEU 118 2HD2 LEU 118 -3.239 -7.228 4.427 896 H LEU 119 HN LEU 119 -2.445 -3.805 1.810 897 HA LEU 119 HA LEU 119 -0.995 -3.532 -0.724 898 HB2 LEU 119 2HB LEU 119 -3.110 -2.403 -1.050 899 HB3 LEU 119 1HB LEU 119 -2.917 -1.526 0.456 900 HG LEU 119 HG LEU 119 -0.988 -0.320 -0.508 901 HD11 LEU 119 1HD1 LEU 119 -1.723 -1.766 -3.048 902 HD12 LEU 119 2HD1 LEU 119 -0.253 -2.009 -2.104 903 HD13 LEU 119 3HD1 LEU 119 -0.545 -0.462 -2.903 904 HD21 LEU 119 3HD2 LEU 119 -2.274 1.084 -2.031 905 HD22 LEU 119 1HD2 LEU 119 -3.235 0.634 -0.622 906 HD23 LEU 119 2HD2 LEU 119 -3.503 -0.173 -2.167 907 H LEU 120 HN LEU 120 1.042 -3.073 -0.322 908 HA LEU 120 HA LEU 120 1.692 -1.362 1.988 909 HB2 LEU 120 2HB LEU 120 3.375 -3.526 0.708 910 HB3 LEU 120 1HB LEU 120 3.927 -2.451 1.980 911 HG LEU 120 HG LEU 120 1.703 -4.478 2.240 912 HD11 LEU 120 1HD1 LEU 120 4.508 -4.474 3.343 913 HD12 LEU 120 2HD1 LEU 120 3.894 -5.522 2.063 914 HD13 LEU 120 3HD1 LEU 120 3.256 -5.665 3.699 915 HD21 LEU 120 3HD2 LEU 120 1.772 -3.935 4.620 916 HD22 LEU 120 1HD2 LEU 120 1.346 -2.521 3.655 917 HD23 LEU 120 2HD2 LEU 120 2.978 -2.686 4.305 918 H GLY 121 HN GLY 121 2.968 0.421 1.589 919 HA2 GLY 121 2HA GLY 121 4.200 0.699 -1.044 920 HA3 GLY 121 1HA GLY 121 2.917 1.833 -0.652 921 H SER 122 HN SER 122 6.191 1.281 -0.582 922 HA SER 122 HA SER 122 6.829 3.836 0.291 923 HB2 SER 122 2HB SER 122 8.083 3.194 2.426 924 HB3 SER 122 1HB SER 122 6.329 3.297 2.544 925 HG SER 122 HG SER 122 7.919 0.942 2.304 926 H GLU 123 HN GLU 123 9.364 3.599 1.188 927 HA GLU 123 HA GLU 123 11.434 3.549 0.301 928 HB2 GLU 123 2HB GLU 123 12.463 1.349 0.226 929 HB3 GLU 123 1HB GLU 123 11.434 1.525 1.633 930 HG2 GLU 123 2HG GLU 123 10.323 0.221 -0.795 931 HG3 GLU 123 1HG GLU 123 11.461 -0.671 0.210 932 H TYR 124 HN TYR 124 12.725 1.836 -1.467 933 HA TYR 124 HA TYR 124 11.471 2.627 -4.004 934 HB2 TYR 124 2HB TYR 124 13.745 3.546 -3.481 935 HB3 TYR 124 1HB TYR 124 14.363 1.899 -3.503 936 HD1 TYR 124 2HD TYR 124 12.521 4.335 -5.650 937 HD2 TYR 124 1HD TYR 124 15.187 1.016 -5.500 938 HE1 TYR 124 2HE TYR 124 12.873 4.513 -8.076 939 HE2 TYR 124 1HE TYR 124 15.537 1.183 -7.931 940 HH TYR 124 HH TYR 124 14.622 3.896 -9.725 941 H THR 125 HN THR 125 12.806 -0.054 -2.206 942 HA THR 125 HA THR 125 11.491 -1.967 -3.902 943 HB THR 125 HB THR 125 13.773 -3.284 -4.037 944 HG1 THR 125 1HG THR 125 14.530 -0.584 -3.712 945 HG21 THR 125 3HG2 THR 125 14.158 -2.394 -6.305 946 HG22 THR 125 1HG2 THR 125 13.060 -1.060 -5.948 947 HG23 THR 125 2HG2 THR 125 12.452 -2.715 -5.992 948 HA PRO 126 HA PRO 126 11.300 -4.181 -0.078 949 HB2 PRO 126 2HB PRO 126 11.393 -6.779 -0.928 950 HB3 PRO 126 1HB PRO 126 9.969 -5.749 -1.072 951 HG2 PRO 126 2HG PRO 126 12.018 -6.438 -3.132 952 HG3 PRO 126 1HG PRO 126 10.255 -6.327 -3.300 953 HD2 PRO 126 2HD PRO 126 11.912 -4.365 -4.127 954 HD3 PRO 126 1HD PRO 126 10.294 -4.028 -3.481 955 H GLN 127 HN GLN 127 13.952 -4.559 -2.178 956 HA GLN 127 HA GLN 127 15.548 -6.352 -0.689 957 HB2 GLN 127 2HB GLN 127 16.142 -4.364 -2.844 958 HB3 GLN 127 1HB GLN 127 17.439 -5.228 -2.027 959 HG2 GLN 127 2HG GLN 127 16.936 -6.430 -3.979 960 HG3 GLN 127 1HG GLN 127 16.297 -7.356 -2.635 961 HE21 GLN 127 1HE2 GLN 127 14.812 -8.464 -3.853 962 HE22 GLN 127 2HE2 GLN 127 13.416 -7.708 -4.548 963 H GLN 128 HN GLN 128 14.822 -3.005 -0.291 964 HA GLN 128 HA GLN 128 17.064 -2.733 1.594 965 HB2 GLN 128 2HB GLN 128 16.745 -0.312 1.431 966 HB3 GLN 128 1HB GLN 128 17.016 -1.023 -0.151 967 HG2 GLN 128 2HG GLN 128 14.529 -0.986 -0.485 968 HG3 GLN 128 1HG GLN 128 14.419 -0.049 1.002 969 HE21 GLN 128 1HE2 GLN 128 17.013 0.218 -1.326 970 HE22 GLN 128 2HE2 GLN 128 16.635 1.828 -1.844 971 H LEU 129 HN LEU 129 14.089 -3.798 1.700 972 HA LEU 129 HA LEU 129 12.897 -2.268 3.791 973 HB2 LEU 129 2HB LEU 129 12.340 -4.835 2.440 974 HB3 LEU 129 1HB LEU 129 11.695 -4.658 4.057 975 HG LEU 129 HG LEU 129 11.155 -2.744 1.787 976 HD11 LEU 129 1HD1 LEU 129 8.912 -3.737 1.766 977 HD12 LEU 129 2HD1 LEU 129 9.434 -4.927 2.959 978 HD13 LEU 129 3HD1 LEU 129 10.152 -4.921 1.348 979 HD21 LEU 129 3HD2 LEU 129 11.041 -1.715 3.996 980 HD22 LEU 129 1HD2 LEU 129 9.963 -2.997 4.546 981 HD23 LEU 129 2HD2 LEU 129 9.430 -1.872 3.296 982 H VAL 130 HN VAL 130 13.018 -2.461 5.934 983 HA VAL 130 HA VAL 130 14.924 -4.377 7.041 984 HB VAL 130 HB VAL 130 13.522 -2.120 8.492 985 HG11 VAL 130 1HG1 VAL 130 15.949 -3.756 9.227 986 HG12 VAL 130 2HG1 VAL 130 14.351 -3.872 9.966 987 HG13 VAL 130 3HG1 VAL 130 15.303 -2.397 10.146 988 HG21 VAL 130 3HG2 VAL 130 14.879 -1.215 6.683 989 HG22 VAL 130 1HG2 VAL 130 16.266 -2.150 7.237 990 HG23 VAL 130 2HG2 VAL 130 15.611 -0.864 8.249 991 H ILE 131 HN ILE 131 13.485 -6.143 6.627 992 HA ILE 131 HA ILE 131 11.372 -6.409 8.656 993 HB ILE 131 HB ILE 131 10.024 -7.706 7.011 994 HG12 ILE 131 2HG1 ILE 131 11.989 -6.600 4.990 995 HG13 ILE 131 1HG1 ILE 131 11.877 -8.284 5.477 996 HG21 ILE 131 1HG2 ILE 131 10.595 -4.857 6.209 997 HG22 ILE 131 2HG2 ILE 131 9.487 -5.378 7.478 998 HG23 ILE 131 3HG2 ILE 131 9.148 -5.777 5.794 999 HD11 ILE 131 3HD1 ILE 131 9.615 -8.400 4.568 1000 HD12 ILE 131 1HD1 ILE 131 10.794 -7.925 3.343 1001 HD13 ILE 131 2HD1 ILE 131 9.739 -6.714 4.069 1002 H ARG 132 HN ARG 132 10.962 -8.591 9.324 1003 HA ARG 132 HA ARG 132 13.188 -10.317 9.409 1004 HB2 ARG 132 2HB ARG 132 11.158 -10.293 10.970 1005 HB3 ARG 132 1HB ARG 132 10.313 -11.196 9.727 1006 HG2 ARG 132 2HG ARG 132 11.070 -12.793 11.267 1007 HG3 ARG 132 1HG ARG 132 12.174 -12.906 9.895 1008 HD2 ARG 132 2HD ARG 132 12.761 -11.277 12.365 1009 HD3 ARG 132 1HD ARG 132 13.244 -12.961 12.181 1010 HE ARG 132 HE ARG 132 14.456 -12.088 10.096 1011 HH11 ARG 132 1HH1 ARG 132 14.061 -10.303 13.097 1012 HH12 ARG 132 2HH1 ARG 132 15.479 -9.328 12.841 1013 HH21 ARG 132 1HH2 ARG 132 16.283 -10.798 9.740 1014 HH22 ARG 132 2HH2 ARG 132 16.726 -9.573 10.904 1015 H GLU 133 HN GLU 133 13.614 -12.238 8.287 1016 HA GLU 133 HA GLU 133 13.181 -12.068 5.523 1017 HB2 GLU 133 2HB GLU 133 14.110 -14.455 7.137 1018 HB3 GLU 133 1HB GLU 133 14.294 -14.257 5.402 1019 HG2 GLU 133 2HG GLU 133 16.388 -13.776 6.439 1020 HG3 GLU 133 1HG GLU 133 15.716 -12.265 5.831 1021 H ASP 134 HN ASP 134 11.456 -13.692 8.052 1022 HA ASP 134 HA ASP 134 10.012 -15.513 6.411 1023 HB2 ASP 134 2HB ASP 134 9.479 -14.449 9.185 1024 HB3 ASP 134 1HB ASP 134 8.470 -15.663 8.405 1025 H LEU 135 HN LEU 135 9.652 -12.156 7.152 1026 HA LEU 135 HA LEU 135 6.917 -12.042 6.218 1027 HB2 LEU 135 2HB LEU 135 7.962 -10.488 7.948 1028 HB3 LEU 135 1HB LEU 135 8.804 -9.723 6.615 1029 HG LEU 135 HG LEU 135 5.815 -9.942 6.545 1030 HD11 LEU 135 1HD1 LEU 135 7.407 -7.862 8.036 1031 HD12 LEU 135 2HD1 LEU 135 6.276 -9.025 8.730 1032 HD13 LEU 135 3HD1 LEU 135 5.688 -7.750 7.663 1033 HD21 LEU 135 3HD2 LEU 135 7.773 -7.902 5.490 1034 HD22 LEU 135 1HD2 LEU 135 6.022 -7.861 5.274 1035 HD23 LEU 135 2HD2 LEU 135 6.972 -9.158 4.547 1036 H ARG 136 HN ARG 136 10.150 -11.573 4.995 1037 HA ARG 136 HA ARG 136 9.469 -10.293 2.576 1038 HB2 ARG 136 2HB ARG 136 11.755 -10.321 3.541 1039 HB3 ARG 136 1HB ARG 136 11.878 -12.029 3.147 1040 HG2 ARG 136 2HG ARG 136 11.854 -11.588 0.824 1041 HG3 ARG 136 1HG ARG 136 11.362 -9.913 1.080 1042 HD2 ARG 136 2HD ARG 136 13.696 -9.947 0.526 1043 HD3 ARG 136 1HD ARG 136 13.528 -9.508 2.224 1044 HE ARG 136 HE ARG 136 14.023 -12.318 1.676 1045 HH11 ARG 136 1HH1 ARG 136 15.375 -9.190 2.504 1046 HH12 ARG 136 2HH1 ARG 136 16.846 -9.859 3.151 1047 HH21 ARG 136 1HH2 ARG 136 15.987 -13.202 2.496 1048 HH22 ARG 136 2HH2 ARG 136 17.187 -12.128 3.173 1049 H THR 137 HN THR 137 9.649 -13.675 3.525 1050 HA THR 137 HA THR 137 9.352 -14.746 0.912 1051 HB THR 137 HB THR 137 8.593 -16.823 2.121 1052 HG1 THR 137 1HG THR 137 9.056 -16.613 4.503 1053 HG21 THR 137 3HG2 THR 137 11.155 -15.529 3.065 1054 HG22 THR 137 1HG2 THR 137 10.944 -16.479 1.596 1055 HG23 THR 137 2HG2 THR 137 10.784 -17.251 3.173 1056 H ARG 138 HN ARG 138 7.094 -13.708 3.408 1057 HA ARG 138 HA ARG 138 4.736 -14.637 2.142 1058 HB2 ARG 138 2HB ARG 138 5.048 -12.317 4.051 1059 HB3 ARG 138 1HB ARG 138 3.555 -13.170 3.684 1060 HG2 ARG 138 2HG ARG 138 5.956 -14.482 4.924 1061 HG3 ARG 138 1HG ARG 138 4.638 -13.775 5.851 1062 HD2 ARG 138 2HD ARG 138 3.061 -15.315 4.822 1063 HD3 ARG 138 1HD ARG 138 4.348 -15.988 3.820 1064 HE ARG 138 HE ARG 138 5.387 -16.490 6.156 1065 HH11 ARG 138 1HH1 ARG 138 2.023 -16.807 5.222 1066 HH12 ARG 138 2HH1 ARG 138 1.681 -18.024 6.403 1067 HH21 ARG 138 1HH2 ARG 138 4.956 -18.090 7.682 1068 HH22 ARG 138 2HH2 ARG 138 3.360 -18.771 7.811 1069 H MET 139 HN MET 139 6.726 -11.814 1.743 1070 HA MET 139 HA MET 139 4.888 -10.152 0.398 1071 HB2 MET 139 2HB MET 139 7.903 -10.290 0.283 1072 HB3 MET 139 1HB MET 139 6.960 -9.040 -0.511 1073 HG2 MET 139 2HG MET 139 6.970 -9.585 2.446 1074 HG3 MET 139 1HG MET 139 7.889 -8.320 1.636 1075 HE1 MET 139 3HE MET 139 5.052 -6.024 0.224 1076 HE2 MET 139 1HE MET 139 5.909 -7.333 -0.590 1077 HE3 MET 139 2HE MET 139 6.792 -6.208 0.444 1078 H ALA 140 HN ALA 140 6.604 -12.950 -0.589 1079 HA ALA 140 HA ALA 140 6.540 -12.416 -3.400 1080 HB1 ALA 140 1HB ALA 140 7.328 -14.687 -3.661 1081 HB2 ALA 140 2HB ALA 140 6.962 -15.033 -1.970 1082 HB3 ALA 140 3HB ALA 140 8.225 -13.872 -2.380 1083 H TYR 141 HN TYR 141 4.154 -13.220 -1.211 1084 HA TYR 141 HA TYR 141 2.534 -14.695 -3.137 1085 HB2 TYR 141 2HB TYR 141 2.076 -13.882 -0.263 1086 HB3 TYR 141 1HB TYR 141 0.839 -14.644 -1.252 1087 HD1 TYR 141 2HD TYR 141 1.377 -16.937 -2.255 1088 HD2 TYR 141 1HD TYR 141 3.634 -15.182 0.890 1089 HE1 TYR 141 2HE TYR 141 2.242 -19.156 -1.649 1090 HE2 TYR 141 1HE TYR 141 4.511 -17.395 1.509 1091 HH TYR 141 HH TYR 141 4.081 -20.170 -0.480 1092 H CYS 142 HN CYS 142 3.413 -11.675 -2.978 1093 HA CYS 142 HA CYS 142 0.754 -10.578 -3.550 1094 HB2 CYS 142 2HB CYS 142 3.203 -9.102 -2.554 1095 HB3 CYS 142 1HB CYS 142 1.611 -8.404 -2.834 1096 HG CYS 142 HG CYS 142 2.802 -9.698 -0.104 1097 H LEU 143 HN LEU 143 0.850 -8.767 -5.104 1098 HA LEU 143 HA LEU 143 2.816 -9.292 -7.220 1099 HB2 LEU 143 2HB LEU 143 0.180 -7.817 -7.297 1100 HB3 LEU 143 1HB LEU 143 1.289 -7.880 -8.642 1101 HG LEU 143 HG LEU 143 1.018 -10.417 -8.485 1102 HD11 LEU 143 1HD1 LEU 143 -1.414 -9.557 -6.938 1103 HD12 LEU 143 2HD1 LEU 143 -0.070 -10.518 -6.321 1104 HD13 LEU 143 3HD1 LEU 143 -1.122 -11.177 -7.574 1105 HD21 LEU 143 3HD2 LEU 143 -0.979 -10.345 -9.887 1106 HD22 LEU 143 1HD2 LEU 143 0.146 -9.054 -10.304 1107 HD23 LEU 143 2HD2 LEU 143 -1.293 -8.695 -9.351 1108 H VAL 144 HN VAL 144 3.870 -7.481 -8.232 1109 HA VAL 144 HA VAL 144 4.081 -5.172 -6.424 1110 HB VAL 144 HB VAL 144 6.198 -6.266 -8.292 1111 HG11 VAL 144 1HG1 VAL 144 6.330 -3.928 -6.388 1112 HG12 VAL 144 2HG1 VAL 144 6.288 -3.828 -8.148 1113 HG13 VAL 144 3HG1 VAL 144 7.670 -4.569 -7.343 1114 HG21 VAL 144 3HG2 VAL 144 6.040 -6.213 -5.279 1115 HG22 VAL 144 1HG2 VAL 144 7.449 -6.720 -6.213 1116 HG23 VAL 144 2HG2 VAL 144 5.947 -7.641 -6.309 1117 H TYR 145 HN TYR 145 3.112 -3.469 -7.186 1118 HA TYR 145 HA TYR 145 2.933 -3.048 -10.085 1119 HB2 TYR 145 2HB TYR 145 1.437 -1.887 -7.741 1120 HB3 TYR 145 1HB TYR 145 1.377 -1.132 -9.326 1121 HD1 TYR 145 1HD TYR 145 1.418 -4.789 -8.687 1122 HD2 TYR 145 2HD TYR 145 -0.911 -1.405 -9.790 1123 HE1 TYR 145 1HE TYR 145 -0.441 -6.274 -9.301 1124 HE2 TYR 145 2HE TYR 145 -2.773 -2.883 -10.410 1125 HH TYR 145 HH TYR 145 -3.049 -5.315 -11.127 1126 H GLU 146 HN GLU 146 4.398 -1.784 -10.974 1127 HA GLU 146 HA GLU 146 6.099 -0.173 -9.309 1128 HB2 GLU 146 2HB GLU 146 7.240 0.367 -11.479 1129 HB3 GLU 146 1HB GLU 146 7.184 -1.343 -11.076 1130 HG2 GLU 146 2HG GLU 146 5.274 -1.610 -12.608 1131 HG3 GLU 146 1HG GLU 146 5.426 0.091 -13.051 1132 H VAL 147 HN VAL 147 5.434 1.722 -8.627 1133 HA VAL 147 HA VAL 147 3.758 3.394 -10.340 1134 HB VAL 147 HB VAL 147 4.658 3.930 -7.494 1135 HG11 VAL 147 1HG1 VAL 147 4.059 5.947 -8.700 1136 HG12 VAL 147 2HG1 VAL 147 2.845 5.576 -7.475 1137 HG13 VAL 147 3HG1 VAL 147 2.520 5.230 -9.174 1138 HG21 VAL 147 3HG2 VAL 147 2.059 2.769 -8.497 1139 HG22 VAL 147 1HG2 VAL 147 2.395 3.242 -6.830 1140 HG23 VAL 147 2HG2 VAL 147 3.298 1.921 -7.571 1141 H LYS 148 HN LYS 148 4.969 4.344 -11.825 1142 HA LYS 148 HA LYS 148 7.724 4.954 -11.415 1143 HB2 LYS 148 2HB LYS 148 7.666 5.781 -13.713 1144 HB3 LYS 148 1HB LYS 148 6.859 4.224 -13.597 1145 HG2 LYS 148 2HG LYS 148 5.408 5.376 -14.945 1146 HG3 LYS 148 1HG LYS 148 4.708 5.697 -13.356 1147 HD2 LYS 148 2HD LYS 148 6.403 7.756 -13.492 1148 HD3 LYS 148 1HD LYS 148 6.126 7.519 -15.218 1149 HE2 LYS 148 2HE LYS 148 3.781 7.822 -14.959 1150 HE3 LYS 148 1HE LYS 148 3.909 7.768 -13.200 1151 HZ1 LYS 148 3HZ LYS 148 3.689 10.022 -13.803 1152 HZ2 LYS 148 1HZ LYS 148 4.867 9.905 -15.022 1153 HZ3 LYS 148 2HZ LYS 148 5.323 9.811 -13.388 1154 HA PRO 149 HA PRO 149 7.222 9.244 -10.241 1155 HB2 PRO 149 2HB PRO 149 9.740 10.100 -10.733 1156 HB3 PRO 149 1HB PRO 149 9.330 9.114 -9.324 1157 HG2 PRO 149 2HG PRO 149 10.623 8.315 -11.890 1158 HG3 PRO 149 1HG PRO 149 10.943 7.743 -10.245 1159 HD2 PRO 149 2HD PRO 149 9.439 6.382 -12.114 1160 HD3 PRO 149 1HD PRO 149 9.312 6.155 -10.361 Start of MODEL 12 1 H1 MET 1 H1 MET 1 -65.173 32.153 13.739 2 H2 MET 1 H2 MET 1 -65.928 31.762 12.270 3 H3 MET 1 H3 MET 1 -64.600 32.818 12.286 4 HA MET 1 HA MET 1 -63.191 31.020 13.118 5 HB2 MET 1 2HB MET 1 -65.707 29.418 12.650 6 HB3 MET 1 1HB MET 1 -64.114 28.691 12.805 7 HG2 MET 1 2HG MET 1 -63.922 29.692 15.056 8 HG3 MET 1 1HG MET 1 -65.567 30.298 14.890 9 HE1 MET 1 2HE MET 1 -67.007 27.898 13.359 10 HE2 MET 1 3HE MET 1 -67.703 28.769 14.725 11 HE3 MET 1 1HE MET 1 -67.657 27.006 14.733 12 H GLY 2 HN GLY 2 -62.415 29.199 11.582 13 HA2 GLY 2 2HA GLY 2 -62.816 28.541 9.130 14 HA3 GLY 2 1HA GLY 2 -62.675 30.274 8.852 15 H HIS 3 HN HIS 3 -61.002 27.333 9.390 16 HA HIS 3 HA HIS 3 -58.441 28.749 9.704 17 HB2 HIS 3 2HB HIS 3 -59.211 26.962 11.375 18 HB3 HIS 3 1HB HIS 3 -58.929 25.794 10.088 19 HD1 HIS 3 1HD HIS 3 -57.308 27.301 12.889 20 HD2 HIS 3 2HD HIS 3 -56.077 25.974 9.144 21 HE1 HIS 3 1HE HIS 3 -54.812 27.025 13.051 22 HE2 HIS 3 2HE HIS 3 -54.086 26.184 10.789 23 H HIS 4 HN HIS 4 -58.104 29.281 7.525 24 HA HIS 4 HA HIS 4 -58.289 27.193 5.528 25 HB2 HIS 4 2HB HIS 4 -58.950 29.592 5.087 26 HB3 HIS 4 1HB HIS 4 -57.239 30.003 5.149 27 HD1 HIS 4 1HD HIS 4 -59.844 28.874 2.870 28 HD2 HIS 4 2HD HIS 4 -55.693 28.647 3.042 29 HE1 HIS 4 1HE HIS 4 -59.096 28.270 0.544 30 HE2 HIS 4 2HE HIS 4 -56.614 27.898 0.743 31 H HIS 5 HN HIS 5 -56.709 25.755 6.271 32 HA HIS 5 HA HIS 5 -53.972 26.500 6.514 33 HB2 HIS 5 2HB HIS 5 -53.497 24.089 6.519 34 HB3 HIS 5 1HB HIS 5 -54.810 24.482 7.618 35 HD1 HIS 5 1HD HIS 5 -53.915 21.992 5.283 36 HD2 HIS 5 2HD HIS 5 -57.448 24.032 6.111 37 HE1 HIS 5 1HE HIS 5 -55.763 20.566 4.351 38 HE2 HIS 5 2HE HIS 5 -57.891 21.727 5.036 39 H HIS 6 HN HIS 6 -52.426 26.667 5.014 40 HA HIS 6 HA HIS 6 -52.952 25.731 2.300 41 HB2 HIS 6 2HB HIS 6 -52.321 27.982 1.377 42 HB3 HIS 6 1HB HIS 6 -53.876 27.938 2.199 43 HD1 HIS 6 1HD HIS 6 -53.932 29.052 4.637 44 HD2 HIS 6 2HD HIS 6 -50.513 29.794 2.382 45 HE1 HIS 6 1HE HIS 6 -52.809 31.015 5.730 46 HE2 HIS 6 2HE HIS 6 -50.870 31.571 4.230 47 H HIS 7 HN HIS 7 -51.144 25.106 1.233 48 HA HIS 7 HA HIS 7 -48.538 25.835 2.331 49 HB2 HIS 7 2HB HIS 7 -49.131 23.823 3.562 50 HB3 HIS 7 1HB HIS 7 -49.531 22.985 2.069 51 HD1 HIS 7 1HD HIS 7 -47.654 21.822 0.849 52 HD2 HIS 7 2HD HIS 7 -46.324 24.267 3.944 53 HE1 HIS 7 1HE HIS 7 -45.195 21.332 1.096 54 HE2 HIS 7 2HE HIS 7 -44.376 22.948 2.856 55 H HIS 8 HN HIS 8 -47.058 26.114 0.805 56 HA HIS 8 HA HIS 8 -47.279 24.609 -1.710 57 HB2 HIS 8 2HB HIS 8 -46.928 27.588 -1.427 58 HB3 HIS 8 1HB HIS 8 -46.293 26.735 -2.829 59 HD1 HIS 8 1HD HIS 8 -47.907 26.164 -4.669 60 HD2 HIS 8 2HD HIS 8 -49.807 27.481 -1.210 61 HE1 HIS 8 1HE HIS 8 -50.322 26.478 -5.295 62 HE2 HIS 8 2HE HIS 8 -51.481 27.102 -3.147 63 H SER 9 HN SER 9 -45.225 24.194 -2.721 64 HA SER 9 HA SER 9 -42.991 24.481 -0.822 65 HB2 SER 9 2HB SER 9 -43.407 22.350 -2.931 66 HB3 SER 9 1HB SER 9 -42.103 22.404 -1.744 67 HG SER 9 HG SER 9 -44.885 22.067 -1.266 68 H HIS 10 HN HIS 10 -41.409 25.768 -1.415 69 HA HIS 10 HA HIS 10 -40.894 26.171 -4.291 70 HB2 HIS 10 2HB HIS 10 -41.634 28.237 -3.168 71 HB3 HIS 10 1HB HIS 10 -40.339 28.067 -1.990 72 HD1 HIS 10 1HD HIS 10 -38.015 28.854 -2.662 73 HD2 HIS 10 2HD HIS 10 -40.779 29.036 -5.767 74 HE1 HIS 10 1HE HIS 10 -36.888 30.145 -4.502 75 HE2 HIS 10 2HE HIS 10 -38.637 30.396 -6.299 76 H MET 11 HN MET 11 -38.923 25.653 -5.028 77 HA MET 11 HA MET 11 -37.223 24.008 -3.545 78 HB2 MET 11 2HB MET 11 -36.709 25.527 -6.106 79 HB3 MET 11 1HB MET 11 -35.621 24.314 -5.448 80 HG2 MET 11 2HG MET 11 -36.915 23.282 -7.147 81 HG3 MET 11 1HG MET 11 -37.485 22.667 -5.598 82 HE1 MET 11 3HE MET 11 -39.125 22.271 -8.257 83 HE2 MET 11 1HE MET 11 -40.752 22.668 -7.708 84 HE3 MET 11 2HE MET 11 -39.681 21.722 -6.676 85 H ASP 12 HN ASP 12 -35.757 24.430 -2.062 86 HA ASP 12 HA ASP 12 -34.902 27.184 -1.633 87 HB2 ASP 12 2HB ASP 12 -34.437 24.677 0.000 88 HB3 ASP 12 1HB ASP 12 -33.899 26.286 0.462 89 H TYR 13 HN TYR 13 -33.627 27.148 -3.650 90 HA TYR 13 HA TYR 13 -30.917 26.181 -3.041 91 HB2 TYR 13 2HB TYR 13 -32.165 26.210 -5.803 92 HB3 TYR 13 1HB TYR 13 -30.517 25.726 -5.417 93 HD1 TYR 13 2HD TYR 13 -30.229 23.700 -3.837 94 HD2 TYR 13 1HD TYR 13 -33.881 24.620 -5.819 95 HE1 TYR 13 2HE TYR 13 -30.991 21.385 -3.502 96 HE2 TYR 13 1HE TYR 13 -34.653 22.309 -5.482 97 HH TYR 13 HH TYR 13 -33.111 20.149 -3.357 98 HA PRO 14 HA PRO 14 -30.894 30.715 -3.576 99 HB2 PRO 14 2HB PRO 14 -28.709 30.625 -1.643 100 HB3 PRO 14 1HB PRO 14 -30.273 31.427 -1.516 101 HG2 PRO 14 2HG PRO 14 -29.624 29.261 -0.034 102 HG3 PRO 14 1HG PRO 14 -31.283 29.597 -0.562 103 HD2 PRO 14 2HD PRO 14 -29.277 27.686 -1.707 104 HD3 PRO 14 1HD PRO 14 -31.021 27.463 -1.435 105 H SER 15 HN SER 15 -28.343 28.354 -3.754 106 HA SER 15 HA SER 15 -26.343 28.244 -4.813 107 HB2 SER 15 2HB SER 15 -27.360 30.601 -6.427 108 HB3 SER 15 1HB SER 15 -26.010 29.552 -6.857 109 HG SER 15 HG SER 15 -28.123 28.010 -6.377 110 H PHE 16 HN PHE 16 -25.108 28.775 -3.018 111 HA PHE 16 HA PHE 16 -24.750 31.566 -2.342 112 HB2 PHE 16 2HB PHE 16 -24.639 29.137 -0.910 113 HB3 PHE 16 1HB PHE 16 -23.030 29.854 -0.824 114 HD1 PHE 16 1HD PHE 16 -22.703 32.056 0.181 115 HD2 PHE 16 2HD PHE 16 -26.512 30.159 0.165 116 HE1 PHE 16 1HE PHE 16 -23.484 33.620 1.910 117 HE2 PHE 16 2HE PHE 16 -27.298 31.720 1.896 118 HZ PHE 16 HZ PHE 16 -25.781 33.455 2.769 119 H ASP 17 HN ASP 17 -22.745 32.609 -2.165 120 HA ASP 17 HA ASP 17 -20.910 31.846 -4.301 121 HB2 ASP 17 2HB ASP 17 -20.104 34.157 -4.130 122 HB3 ASP 17 1HB ASP 17 -21.855 34.117 -4.307 123 H LYS 18 HN LYS 18 -21.097 31.547 -0.967 124 HA LYS 18 HA LYS 18 -18.385 32.168 -0.320 125 HB2 LYS 18 2HB LYS 18 -20.675 30.988 1.185 126 HB3 LYS 18 1HB LYS 18 -19.051 30.818 1.835 127 HG2 LYS 18 2HG LYS 18 -20.143 32.746 2.798 128 HG3 LYS 18 1HG LYS 18 -18.788 33.259 1.794 129 HD2 LYS 18 2HD LYS 18 -20.451 33.636 -0.059 130 HD3 LYS 18 1HD LYS 18 -21.724 33.375 1.134 131 HE2 LYS 18 2HE LYS 18 -20.908 35.241 2.448 132 HE3 LYS 18 1HE LYS 18 -19.573 35.478 1.320 133 HZ1 LYS 18 3HZ LYS 18 -21.235 37.044 0.772 134 HZ2 LYS 18 1HZ LYS 18 -22.468 35.877 0.806 135 HZ3 LYS 18 2HZ LYS 18 -21.306 35.845 -0.429 136 H PHE 19 HN PHE 19 -19.857 28.971 0.396 137 HA PHE 19 HA PHE 19 -17.684 27.768 -1.092 138 HB2 PHE 19 2HB PHE 19 -18.332 27.185 1.799 139 HB3 PHE 19 1HB PHE 19 -17.347 26.144 0.791 140 HD1 PHE 19 2HD PHE 19 -15.218 27.119 -0.216 141 HD2 PHE 19 1HD PHE 19 -17.401 29.009 2.913 142 HE1 PHE 19 2HE PHE 19 -13.230 28.450 0.368 143 HE2 PHE 19 1HE PHE 19 -15.421 30.343 3.498 144 HZ PHE 19 HZ PHE 19 -13.329 30.063 2.228 145 H LEU 20 HN LEU 20 -21.301 26.031 -0.302 146 HA LEU 20 HA LEU 20 -19.586 27.107 1.804 147 HB2 LEU 20 2HB LEU 20 -22.489 27.077 1.299 148 HB3 LEU 20 1HB LEU 20 -22.027 26.748 2.957 149 HG LEU 20 HG LEU 20 -21.253 29.195 1.382 150 HD11 LEU 20 1HD1 LEU 20 -23.634 29.148 1.941 151 HD12 LEU 20 2HD1 LEU 20 -22.785 30.368 2.890 152 HD13 LEU 20 3HD1 LEU 20 -23.236 28.832 3.630 153 HD21 LEU 20 3HD2 LEU 20 -20.409 30.021 3.530 154 HD22 LEU 20 1HD2 LEU 20 -19.566 28.554 3.034 155 HD23 LEU 20 2HD2 LEU 20 -20.810 28.477 4.282 156 H GLY 21 HN GLY 21 -18.359 25.274 2.278 157 HA2 GLY 21 2HA GLY 21 -17.964 23.475 3.675 158 HA3 GLY 21 1HA GLY 21 -19.692 23.370 3.978 159 H THR 22 HN THR 22 -20.966 22.651 1.942 160 HA THR 22 HA THR 22 -19.885 20.070 1.322 161 HB THR 22 HB THR 22 -22.151 20.053 1.861 162 HG1 THR 22 1HG THR 22 -21.785 18.611 0.194 163 HG21 THR 22 3HG2 THR 22 -23.885 21.314 0.665 164 HG22 THR 22 1HG2 THR 22 -22.634 22.097 -0.300 165 HG23 THR 22 2HG2 THR 22 -22.714 22.384 1.438 166 H GLU 23 HN GLU 23 -18.301 20.156 0.019 167 HA GLU 23 HA GLU 23 -18.809 20.167 -2.757 168 HB2 GLU 23 2HB GLU 23 -18.521 22.649 -2.371 169 HB3 GLU 23 1HB GLU 23 -16.875 22.317 -1.846 170 HG2 GLU 23 2HG GLU 23 -16.326 21.419 -4.024 171 HG3 GLU 23 1HG GLU 23 -17.989 21.641 -4.559 172 H ASN 24 HN ASN 24 -17.835 18.277 -3.062 173 HA ASN 24 HA ASN 24 -15.639 17.530 -1.299 174 HB2 ASN 24 2HB ASN 24 -17.421 15.959 -3.156 175 HB3 ASN 24 1HB ASN 24 -16.056 15.235 -2.310 176 HD21 ASN 24 1HD2 ASN 24 -18.916 14.660 -2.083 177 HD22 ASN 24 2HD2 ASN 24 -19.312 14.904 -0.416 178 H ALA 25 HN ALA 25 -14.823 19.378 -3.170 179 HA ALA 25 HA ALA 25 -13.776 18.381 -5.555 180 HB1 ALA 25 1HB ALA 25 -13.938 20.766 -5.030 181 HB2 ALA 25 2HB ALA 25 -12.313 20.321 -5.548 182 HB3 ALA 25 3HB ALA 25 -12.652 20.590 -3.837 183 H GLU 26 HN GLU 26 -12.170 18.717 -2.391 184 HA GLU 26 HA GLU 26 -9.732 17.565 -3.246 185 HB2 GLU 26 2HB GLU 26 -10.856 17.917 -0.466 186 HB3 GLU 26 1HB GLU 26 -9.208 17.410 -0.819 187 HG2 GLU 26 2HG GLU 26 -8.930 19.541 -2.100 188 HG3 GLU 26 1HG GLU 26 -10.500 20.041 -1.475 189 H LEU 27 HN LEU 27 -12.708 16.193 -2.157 190 HA LEU 27 HA LEU 27 -11.668 13.636 -1.480 191 HB2 LEU 27 2HB LEU 27 -13.795 14.325 -0.585 192 HB3 LEU 27 1HB LEU 27 -14.443 14.576 -2.196 193 HG LEU 27 HG LEU 27 -14.217 12.154 -2.620 194 HD11 LEU 27 1HD1 LEU 27 -12.465 11.627 -1.024 195 HD12 LEU 27 2HD1 LEU 27 -13.891 10.636 -0.719 196 HD13 LEU 27 3HD1 LEU 27 -13.541 12.021 0.315 197 HD21 LEU 27 3HD2 LEU 27 -16.136 11.482 -1.253 198 HD22 LEU 27 1HD2 LEU 27 -16.352 13.090 -1.942 199 HD23 LEU 27 2HD2 LEU 27 -15.910 12.911 -0.244 200 H VAL 28 HN VAL 28 -13.209 15.025 -4.369 201 HA VAL 28 HA VAL 28 -13.062 12.733 -5.991 202 HB VAL 28 HB VAL 28 -12.921 15.641 -6.825 203 HG11 VAL 28 1HG1 VAL 28 -13.627 13.182 -8.432 204 HG12 VAL 28 2HG1 VAL 28 -12.176 14.164 -8.621 205 HG13 VAL 28 3HG1 VAL 28 -13.758 14.847 -8.998 206 HG21 VAL 28 3HG2 VAL 28 -14.917 15.126 -5.505 207 HG22 VAL 28 1HG2 VAL 28 -15.292 13.787 -6.590 208 HG23 VAL 28 2HG2 VAL 28 -15.331 15.445 -7.191 209 H TYR 29 HN TYR 29 -10.752 15.216 -5.187 210 HA TYR 29 HA TYR 29 -8.721 14.712 -7.020 211 HB2 TYR 29 2HB TYR 29 -8.672 16.646 -5.572 212 HB3 TYR 29 1HB TYR 29 -8.608 15.632 -4.139 213 HD1 TYR 29 1HD TYR 29 -6.679 16.928 -6.997 214 HD2 TYR 29 2HD TYR 29 -6.535 14.676 -3.391 215 HE1 TYR 29 1HE TYR 29 -4.222 17.069 -7.012 216 HE2 TYR 29 2HE TYR 29 -4.080 14.808 -3.398 217 HH TYR 29 HH TYR 29 -2.363 16.956 -5.308 218 H VAL 30 HN VAL 30 -9.714 12.892 -4.219 219 HA VAL 30 HA VAL 30 -7.275 11.422 -3.933 220 HB VAL 30 HB VAL 30 -10.032 10.780 -2.875 221 HG11 VAL 30 1HG1 VAL 30 -7.323 9.694 -2.102 222 HG12 VAL 30 2HG1 VAL 30 -8.631 8.801 -2.877 223 HG13 VAL 30 3HG1 VAL 30 -8.823 9.389 -1.226 224 HG21 VAL 30 3HG2 VAL 30 -9.183 11.723 -0.759 225 HG22 VAL 30 1HG2 VAL 30 -9.278 12.921 -2.049 226 HG23 VAL 30 2HG2 VAL 30 -7.719 12.231 -1.599 227 H LEU 31 HN LEU 31 -10.318 10.899 -5.614 228 HA LEU 31 HA LEU 31 -9.995 8.135 -6.097 229 HB2 LEU 31 2HB LEU 31 -11.666 10.266 -7.381 230 HB3 LEU 31 1HB LEU 31 -11.623 8.645 -8.041 231 HG LEU 31 HG LEU 31 -13.568 8.840 -6.669 232 HD11 LEU 31 1HD1 LEU 31 -13.178 7.093 -4.987 233 HD12 LEU 31 2HD1 LEU 31 -11.440 7.258 -5.240 234 HD13 LEU 31 3HD1 LEU 31 -12.473 6.696 -6.555 235 HD21 LEU 31 3HD2 LEU 31 -13.457 9.382 -4.278 236 HD22 LEU 31 1HD2 LEU 31 -12.933 10.727 -5.293 237 HD23 LEU 31 2HD2 LEU 31 -11.739 9.742 -4.450 238 H ARG 32 HN ARG 32 -8.773 7.064 -7.475 239 HA ARG 32 HA ARG 32 -7.867 8.395 -9.932 240 HB2 ARG 32 2HB ARG 32 -6.133 6.609 -8.206 241 HB3 ARG 32 1HB ARG 32 -5.663 7.334 -9.736 242 HG2 ARG 32 2HG ARG 32 -6.366 8.866 -7.242 243 HG3 ARG 32 1HG ARG 32 -4.730 8.505 -7.787 244 HD2 ARG 32 2HD ARG 32 -6.669 9.942 -9.566 245 HD3 ARG 32 1HD ARG 32 -5.756 10.811 -8.337 246 HE ARG 32 HE ARG 32 -3.989 9.254 -9.874 247 HH11 ARG 32 1HH1 ARG 32 -6.046 12.076 -10.176 248 HH12 ARG 32 2HH1 ARG 32 -5.019 12.858 -11.343 249 HH21 ARG 32 1HH2 ARG 32 -2.620 10.282 -11.400 250 HH22 ARG 32 2HH2 ARG 32 -3.055 11.851 -12.020 251 H HIS 33 HN HIS 33 -7.141 5.167 -8.649 252 HA HIS 33 HA HIS 33 -9.213 3.801 -9.992 253 HB2 HIS 33 2HB HIS 33 -7.909 2.634 -11.722 254 HB3 HIS 33 1HB HIS 33 -7.954 4.365 -12.022 255 HD1 HIS 33 1HD HIS 33 -5.644 1.540 -11.522 256 HD2 HIS 33 2HD HIS 33 -5.448 5.702 -11.483 257 HE1 HIS 33 1HE HIS 33 -3.196 2.114 -11.672 258 HE2 HIS 33 2HE HIS 33 -3.112 4.628 -11.793 259 H LYS 34 HN LYS 34 -9.158 1.522 -9.547 260 HA LYS 34 HA LYS 34 -6.929 0.518 -7.984 261 HB2 LYS 34 2HB LYS 34 -8.392 -0.140 -6.078 262 HB3 LYS 34 1HB LYS 34 -8.211 1.598 -6.252 263 HG2 LYS 34 2HG LYS 34 -10.447 1.460 -5.857 264 HG3 LYS 34 1HG LYS 34 -10.445 1.369 -7.619 265 HD2 LYS 34 2HD LYS 34 -10.509 -1.104 -7.443 266 HD3 LYS 34 1HD LYS 34 -10.634 -0.944 -5.690 267 HE2 LYS 34 2HE LYS 34 -12.708 0.387 -6.021 268 HE3 LYS 34 1HE LYS 34 -12.601 0.046 -7.748 269 HZ1 LYS 34 3HZ LYS 34 -14.106 -1.480 -6.574 270 HZ2 LYS 34 1HZ LYS 34 -12.813 -2.022 -5.623 271 HZ3 LYS 34 2HZ LYS 34 -12.810 -2.300 -7.291 272 H HIS 35 HN HIS 35 -6.726 -1.673 -8.052 273 HA HIS 35 HA HIS 35 -8.829 -3.469 -8.751 274 HB2 HIS 35 2HB HIS 35 -7.094 -2.420 -10.886 275 HB3 HIS 35 1HB HIS 35 -7.156 -4.175 -10.810 276 HD1 HIS 35 1HD HIS 35 -9.642 -5.222 -10.979 277 HD2 HIS 35 2HD HIS 35 -9.181 -1.268 -12.179 278 HE1 HIS 35 1HE HIS 35 -11.665 -4.697 -12.385 279 HE2 HIS 35 2HE HIS 35 -11.224 -2.385 -13.295 280 H GLY 36 HN GLY 36 -8.337 -5.248 -7.608 281 HA2 GLY 36 2HA GLY 36 -6.521 -7.092 -7.877 282 HA3 GLY 36 1HA GLY 36 -5.493 -5.872 -7.146 283 H GLN 37 HN GLN 37 -5.562 -8.175 -5.904 284 HA GLN 37 HA GLN 37 -7.144 -7.594 -3.485 285 HB2 GLN 37 2HB GLN 37 -8.107 -9.586 -4.370 286 HB3 GLN 37 1HB GLN 37 -6.532 -10.279 -4.723 287 HG2 GLN 37 2HG GLN 37 -6.062 -10.452 -2.336 288 HG3 GLN 37 1HG GLN 37 -7.623 -9.728 -1.969 289 HE21 GLN 37 1HE2 GLN 37 -8.137 -11.543 -0.731 290 HE22 GLN 37 2HE2 GLN 37 -8.628 -13.032 -1.467 291 H PHE 38 HN PHE 38 -4.185 -8.867 -4.865 292 HA PHE 38 HA PHE 38 -2.829 -8.394 -2.297 293 HB2 PHE 38 2HB PHE 38 -3.385 -10.865 -2.843 294 HB3 PHE 38 1HB PHE 38 -2.138 -10.725 -4.069 295 HD1 PHE 38 2HD PHE 38 -2.073 -9.154 -0.724 296 HD2 PHE 38 1HD PHE 38 -0.581 -12.251 -3.225 297 HE1 PHE 38 2HE PHE 38 -0.375 -9.702 0.969 298 HE2 PHE 38 1HE PHE 38 1.120 -12.802 -1.538 299 HZ PHE 38 HZ PHE 38 1.221 -11.529 0.563 300 H ILE 39 HN ILE 39 -2.127 -6.419 -3.249 301 HA ILE 39 HA ILE 39 -0.052 -6.772 -5.295 302 HB ILE 39 HB ILE 39 -2.212 -4.666 -5.317 303 HG12 ILE 39 2HG1 ILE 39 -1.398 -6.821 -7.279 304 HG13 ILE 39 1HG1 ILE 39 -2.857 -6.805 -6.297 305 HG21 ILE 39 1HG2 ILE 39 -0.096 -3.601 -5.834 306 HG22 ILE 39 2HG2 ILE 39 -1.068 -3.745 -7.300 307 HG23 ILE 39 3HG2 ILE 39 0.273 -4.856 -7.015 308 HD11 ILE 39 3HD1 ILE 39 -2.191 -4.852 -8.480 309 HD12 ILE 39 1HD1 ILE 39 -3.662 -4.859 -7.510 310 HD13 ILE 39 2HD1 ILE 39 -3.317 -6.202 -8.601 311 H TYR 40 HN TYR 40 1.782 -5.800 -4.924 312 HA TYR 40 HA TYR 40 1.961 -3.799 -2.775 313 HB2 TYR 40 2HB TYR 40 3.334 -5.710 -2.293 314 HB3 TYR 40 1HB TYR 40 3.977 -5.741 -3.928 315 HD1 TYR 40 2HD TYR 40 3.991 -3.793 -0.769 316 HD2 TYR 40 1HD TYR 40 5.940 -4.554 -4.472 317 HE1 TYR 40 2HE TYR 40 5.929 -2.487 -0.014 318 HE2 TYR 40 1HE TYR 40 7.880 -3.244 -3.727 319 HH TYR 40 HH TYR 40 8.453 -1.533 -2.122 320 H VAL 41 HN VAL 41 2.267 -1.773 -3.414 321 HA VAL 41 HA VAL 41 3.392 -1.321 -6.094 322 HB VAL 41 HB VAL 41 2.234 0.879 -6.058 323 HG11 VAL 41 1HG1 VAL 41 0.440 -1.521 -5.731 324 HG12 VAL 41 2HG1 VAL 41 1.235 -1.005 -7.219 325 HG13 VAL 41 3HG1 VAL 41 -0.012 0.007 -6.488 326 HG21 VAL 41 3HG2 VAL 41 0.461 1.289 -4.437 327 HG22 VAL 41 1HG2 VAL 41 2.023 1.131 -3.633 328 HG23 VAL 41 2HG2 VAL 41 0.871 -0.204 -3.594 329 H TRP 42 HN TRP 42 5.015 0.168 -6.356 330 HA TRP 42 HA TRP 42 5.972 1.531 -3.946 331 HB2 TRP 42 2HB TRP 42 8.249 0.891 -4.307 332 HB3 TRP 42 1HB TRP 42 7.297 -0.588 -4.355 333 HD1 TRP 42 1HD TRP 42 6.697 -1.442 -7.001 334 HE1 TRP 42 1HE TRP 42 8.281 -1.445 -9.035 335 HE3 TRP 42 3HE TRP 42 10.148 1.947 -5.346 336 HZ2 TRP 42 2HZ TRP 42 10.680 -0.184 -9.821 337 HZ3 TRP 42 3HZ TRP 42 12.059 2.489 -6.795 338 HH2 TRP 42 2HH TRP 42 12.316 1.444 -8.986 339 H GLY 43 HN GLY 43 7.162 3.456 -4.364 340 HA2 GLY 43 2HA GLY 43 8.278 4.784 -6.163 341 HA3 GLY 43 1HA GLY 43 6.858 4.434 -7.137 342 H GLU 44 HN GLU 44 7.335 6.928 -7.081 343 HA GLU 44 HA GLU 44 5.315 8.070 -5.303 344 HB2 GLU 44 2HB GLU 44 7.471 8.358 -4.122 345 HB3 GLU 44 1HB GLU 44 8.136 9.163 -5.532 346 HG2 GLU 44 2HG GLU 44 7.567 10.788 -3.858 347 HG3 GLU 44 1HG GLU 44 6.499 10.977 -5.244 348 H GLU 45 HN GLU 45 6.183 7.471 -8.260 349 HA GLU 45 HA GLU 45 6.336 9.904 -9.635 350 HB2 GLU 45 2HB GLU 45 5.127 7.316 -10.629 351 HB3 GLU 45 1HB GLU 45 5.670 8.653 -11.629 352 HG2 GLU 45 2HG GLU 45 7.385 7.102 -11.788 353 HG3 GLU 45 1HG GLU 45 7.975 8.249 -10.587 354 H GLY 46 HN GLY 46 4.915 11.498 -9.589 355 HA2 GLY 46 2HA GLY 46 2.778 12.307 -10.398 356 HA3 GLY 46 1HA GLY 46 2.049 10.813 -9.822 357 H ALA 47 HN ALA 47 4.180 11.563 -7.523 358 HA ALA 47 HA ALA 47 4.095 12.416 -5.432 359 HB1 ALA 47 1HB ALA 47 4.086 14.566 -6.583 360 HB2 ALA 47 2HB ALA 47 3.125 14.627 -5.105 361 HB3 ALA 47 3HB ALA 47 2.323 14.518 -6.672 362 H GLY 48 HN GLY 48 3.049 10.619 -4.576 363 HA2 GLY 48 2HA GLY 48 1.039 10.783 -2.903 364 HA3 GLY 48 1HA GLY 48 0.126 10.740 -4.404 365 H LYS 49 HN LYS 49 2.743 8.952 -2.764 366 HA LYS 49 HA LYS 49 2.187 6.476 -3.995 367 HB2 LYS 49 2HB LYS 49 3.437 5.484 -2.081 368 HB3 LYS 49 1HB LYS 49 4.292 6.809 -2.858 369 HG2 LYS 49 2HG LYS 49 3.724 8.303 -1.074 370 HG3 LYS 49 1HG LYS 49 2.673 7.094 -0.337 371 HD2 LYS 49 2HD LYS 49 4.595 5.658 0.089 372 HD3 LYS 49 1HD LYS 49 5.658 6.832 -0.693 373 HE2 LYS 49 2HE LYS 49 5.728 6.998 1.760 374 HE3 LYS 49 1HE LYS 49 5.137 8.478 1.008 375 HZ1 LYS 49 3HZ LYS 49 3.511 6.383 2.360 376 HZ2 LYS 49 1HZ LYS 49 2.853 7.676 1.484 377 HZ3 LYS 49 2HZ LYS 49 3.761 7.977 2.874 378 H SER 50 HN SER 50 0.899 8.072 -1.158 379 HA SER 50 HA SER 50 -0.728 5.768 -0.425 380 HB2 SER 50 2HB SER 50 -0.778 8.480 0.900 381 HB3 SER 50 1HB SER 50 -1.121 6.900 1.611 382 HG SER 50 HG SER 50 1.092 6.382 1.403 383 H HIS 51 HN HIS 51 -1.001 7.822 -2.794 384 HA HIS 51 HA HIS 51 -3.401 9.274 -2.340 385 HB2 HIS 51 2HB HIS 51 -1.552 9.777 -4.017 386 HB3 HIS 51 1HB HIS 51 -2.236 8.508 -5.019 387 HD1 HIS 51 1HD HIS 51 -2.209 10.940 -6.487 388 HD2 HIS 51 2HD HIS 51 -5.226 10.268 -3.694 389 HE1 HIS 51 1HE HIS 51 -4.093 12.474 -7.136 390 HE2 HIS 51 2HE HIS 51 -5.951 11.963 -5.518 391 H LEU 52 HN LEU 52 -2.700 6.324 -4.214 392 HA LEU 52 HA LEU 52 -5.449 5.982 -4.935 393 HB2 LEU 52 2HB LEU 52 -4.704 3.885 -5.972 394 HB3 LEU 52 1HB LEU 52 -3.749 5.264 -6.469 395 HG LEU 52 HG LEU 52 -2.193 4.363 -4.470 396 HD11 LEU 52 1HD1 LEU 52 -3.547 1.911 -5.582 397 HD12 LEU 52 2HD1 LEU 52 -3.608 2.481 -3.913 398 HD13 LEU 52 3HD1 LEU 52 -2.084 1.914 -4.597 399 HD21 LEU 52 3HD2 LEU 52 -0.852 3.260 -6.208 400 HD22 LEU 52 1HD2 LEU 52 -1.464 4.829 -6.732 401 HD23 LEU 52 2HD2 LEU 52 -2.229 3.349 -7.307 402 H LEU 53 HN LEU 53 -3.433 4.901 -2.333 403 HA LEU 53 HA LEU 53 -4.816 2.615 -1.516 404 HB2 LEU 53 2HB LEU 53 -3.132 4.620 -0.055 405 HB3 LEU 53 1HB LEU 53 -3.968 3.365 0.836 406 HG LEU 53 HG LEU 53 -2.770 1.671 -0.588 407 HD11 LEU 53 1HD1 LEU 53 -2.195 3.083 -2.473 408 HD12 LEU 53 2HD1 LEU 53 -0.740 2.405 -1.743 409 HD13 LEU 53 3HD1 LEU 53 -1.180 4.085 -1.434 410 HD21 LEU 53 3HD2 LEU 53 -1.068 3.528 1.066 411 HD22 LEU 53 1HD2 LEU 53 -0.670 1.863 0.640 412 HD23 LEU 53 2HD2 LEU 53 -2.054 2.200 1.680 413 H GLN 54 HN GLN 54 -5.354 6.018 -0.709 414 HA GLN 54 HA GLN 54 -7.372 5.521 1.212 415 HB2 GLN 54 2HB GLN 54 -6.703 7.990 -0.387 416 HB3 GLN 54 1HB GLN 54 -7.923 7.951 0.880 417 HG2 GLN 54 2HG GLN 54 -6.222 7.306 2.505 418 HG3 GLN 54 1HG GLN 54 -4.995 7.347 1.236 419 HE21 GLN 54 1HE2 GLN 54 -4.304 9.319 0.439 420 HE22 GLN 54 2HE2 GLN 54 -4.658 10.819 1.231 421 H ALA 55 HN ALA 55 -7.464 6.101 -2.260 422 HA ALA 55 HA ALA 55 -10.274 6.374 -2.491 423 HB1 ALA 55 1HB ALA 55 -8.725 7.093 -4.246 424 HB2 ALA 55 2HB ALA 55 -9.925 5.963 -4.875 425 HB3 ALA 55 3HB ALA 55 -8.280 5.414 -4.545 426 H TRP 56 HN TRP 56 -8.078 3.645 -2.597 427 HA TRP 56 HA TRP 56 -9.949 1.653 -3.317 428 HB2 TRP 56 2HB TRP 56 -7.491 1.421 -3.495 429 HB3 TRP 56 1HB TRP 56 -7.371 1.433 -1.743 430 HD1 TRP 56 1HD TRP 56 -9.056 -0.751 -4.482 431 HE1 TRP 56 1HE TRP 56 -8.909 -3.203 -3.716 432 HE3 TRP 56 3HE TRP 56 -6.879 -0.042 0.093 433 HZ2 TRP 56 2HZ TRP 56 -7.995 -4.638 -1.477 434 HZ3 TRP 56 3HZ TRP 56 -6.403 -2.016 1.484 435 HH2 TRP 56 2HH TRP 56 -6.950 -4.266 0.714 436 H VAL 57 HN VAL 57 -8.796 2.849 -0.199 437 HA VAL 57 HA VAL 57 -10.298 1.068 1.402 438 HB VAL 57 HB VAL 57 -9.143 3.791 2.024 439 HG11 VAL 57 1HG1 VAL 57 -10.290 1.763 3.944 440 HG12 VAL 57 2HG1 VAL 57 -11.006 3.323 3.541 441 HG13 VAL 57 3HG1 VAL 57 -9.460 3.258 4.386 442 HG21 VAL 57 3HG2 VAL 57 -8.201 1.004 2.700 443 HG22 VAL 57 1HG2 VAL 57 -7.421 2.505 3.200 444 HG23 VAL 57 2HG2 VAL 57 -7.493 2.076 1.491 445 H ALA 58 HN ALA 58 -10.944 4.357 0.237 446 HA ALA 58 HA ALA 58 -13.294 4.813 1.700 447 HB1 ALA 58 1HB ALA 58 -12.530 5.959 -0.986 448 HB2 ALA 58 2HB ALA 58 -12.018 6.582 0.584 449 HB3 ALA 58 3HB ALA 58 -13.722 6.622 0.133 450 H GLN 59 HN GLN 59 -12.847 3.426 -1.557 451 HA GLN 59 HA GLN 59 -15.619 3.358 -2.134 452 HB2 GLN 59 2HB GLN 59 -15.046 1.964 -4.040 453 HB3 GLN 59 1HB GLN 59 -13.901 3.286 -3.900 454 HG2 GLN 59 2HG GLN 59 -12.500 1.558 -4.372 455 HG3 GLN 59 1HG GLN 59 -12.473 1.520 -2.611 456 HE21 GLN 59 1HE2 GLN 59 -15.188 0.427 -4.529 457 HE22 GLN 59 2HE2 GLN 59 -15.012 -1.259 -4.158 458 H ALA 60 HN ALA 60 -13.423 1.084 -0.595 459 HA ALA 60 HA ALA 60 -15.265 -1.075 -0.440 460 HB1 ALA 60 1HB ALA 60 -12.841 -1.372 -0.167 461 HB2 ALA 60 2HB ALA 60 -13.744 -2.023 1.202 462 HB3 ALA 60 3HB ALA 60 -12.911 -0.475 1.351 463 H LEU 61 HN LEU 61 -14.463 1.635 1.656 464 HA LEU 61 HA LEU 61 -16.032 0.968 3.872 465 HB2 LEU 61 2HB LEU 61 -15.203 3.631 2.734 466 HB3 LEU 61 1HB LEU 61 -16.066 3.480 4.249 467 HG LEU 61 HG LEU 61 -13.332 2.354 3.641 468 HD11 LEU 61 1HD1 LEU 61 -13.301 4.755 3.923 469 HD12 LEU 61 2HD1 LEU 61 -12.582 3.969 5.330 470 HD13 LEU 61 3HD1 LEU 61 -14.221 4.616 5.421 471 HD21 LEU 61 3HD2 LEU 61 -13.265 1.723 5.996 472 HD22 LEU 61 1HD2 LEU 61 -14.578 0.896 5.157 473 HD23 LEU 61 2HD2 LEU 61 -14.927 2.274 6.201 474 H GLU 62 HN GLU 62 -16.854 2.902 0.996 475 HA GLU 62 HA GLU 62 -19.533 3.369 1.828 476 HB2 GLU 62 2HB GLU 62 -18.310 3.548 -0.927 477 HB3 GLU 62 1HB GLU 62 -19.899 4.159 -0.481 478 HG2 GLU 62 2HG GLU 62 -18.811 5.652 1.162 479 HG3 GLU 62 1HG GLU 62 -17.246 5.098 0.570 480 H ALA 63 HN ALA 63 -17.971 0.684 0.454 481 HA ALA 63 HA ALA 63 -20.362 -0.469 -0.714 482 HB1 ALA 63 1HB ALA 63 -17.622 -1.657 -0.264 483 HB2 ALA 63 2HB ALA 63 -18.220 -0.943 -1.762 484 HB3 ALA 63 3HB ALA 63 -18.937 -2.433 -1.146 485 H GLY 64 HN GLY 64 -19.392 0.008 2.369 486 HA2 GLY 64 2HA GLY 64 -20.476 -0.773 4.282 487 HA3 GLY 64 1HA GLY 64 -21.183 -2.067 3.323 488 H LYS 65 HN LYS 65 -17.876 -1.806 2.802 489 HA LYS 65 HA LYS 65 -17.416 -4.195 4.424 490 HB2 LYS 65 2HB LYS 65 -15.703 -3.020 2.222 491 HB3 LYS 65 1HB LYS 65 -15.492 -4.584 2.990 492 HG2 LYS 65 2HG LYS 65 -17.867 -3.788 1.320 493 HG3 LYS 65 1HG LYS 65 -16.500 -4.751 0.757 494 HD2 LYS 65 2HD LYS 65 -17.016 -6.462 2.420 495 HD3 LYS 65 1HD LYS 65 -18.376 -5.498 3.000 496 HE2 LYS 65 2HE LYS 65 -18.106 -6.515 0.177 497 HE3 LYS 65 1HE LYS 65 -19.000 -7.348 1.444 498 HZ1 LYS 65 3HZ LYS 65 -20.416 -5.377 1.661 499 HZ2 LYS 65 1HZ LYS 65 -20.491 -6.052 0.105 500 HZ3 LYS 65 2HZ LYS 65 -19.590 -4.642 0.380 501 H ASN 66 HN ASN 66 -15.349 -4.327 5.538 502 HA ASN 66 HA ASN 66 -14.711 -1.775 6.791 503 HB2 ASN 66 2HB ASN 66 -15.101 -4.043 8.018 504 HB3 ASN 66 1HB ASN 66 -13.439 -4.384 7.556 505 HD21 ASN 66 1HD2 ASN 66 -14.535 -4.049 10.203 506 HD22 ASN 66 2HD2 ASN 66 -13.693 -2.722 10.935 507 H ALA 67 HN ALA 67 -12.841 -0.729 6.562 508 HA ALA 67 HA ALA 67 -10.564 -1.911 5.233 509 HB1 ALA 67 1HB ALA 67 -11.975 -1.318 3.329 510 HB2 ALA 67 2HB ALA 67 -10.542 -0.291 3.389 511 HB3 ALA 67 3HB ALA 67 -12.100 0.337 3.927 512 H ALA 68 HN ALA 68 -8.678 -0.739 5.560 513 HA ALA 68 HA ALA 68 -8.850 1.890 6.800 514 HB1 ALA 68 1HB ALA 68 -9.027 0.370 8.700 515 HB2 ALA 68 2HB ALA 68 -7.499 1.249 8.731 516 HB3 ALA 68 3HB ALA 68 -7.537 -0.434 8.204 517 H TYR 69 HN TYR 69 -7.120 3.144 6.379 518 HA TYR 69 HA TYR 69 -4.831 1.895 5.026 519 HB2 TYR 69 2HB TYR 69 -4.379 4.146 4.057 520 HB3 TYR 69 1HB TYR 69 -5.918 3.472 3.555 521 HD1 TYR 69 1HD TYR 69 -8.041 4.376 4.586 522 HD2 TYR 69 2HD TYR 69 -4.254 6.234 5.170 523 HE1 TYR 69 1HE TYR 69 -9.170 6.455 5.264 524 HE2 TYR 69 2HE TYR 69 -5.375 8.311 5.855 525 HH TYR 69 HH TYR 69 -8.680 8.479 6.599 526 H ILE 70 HN ILE 70 -2.997 1.834 6.096 527 HA ILE 70 HA ILE 70 -2.764 3.510 8.507 528 HB ILE 70 HB ILE 70 -1.718 0.700 8.120 529 HG12 ILE 70 2HG1 ILE 70 -3.977 1.734 9.853 530 HG13 ILE 70 1HG1 ILE 70 -4.184 0.840 8.351 531 HG21 ILE 70 1HG2 ILE 70 -1.665 2.511 10.536 532 HG22 ILE 70 2HG2 ILE 70 -0.273 2.018 9.572 533 HG23 ILE 70 3HG2 ILE 70 -1.162 0.821 10.514 534 HD11 ILE 70 3HD1 ILE 70 -2.879 -0.202 10.854 535 HD12 ILE 70 1HD1 ILE 70 -3.104 -1.101 9.352 536 HD13 ILE 70 2HD1 ILE 70 -4.506 -0.584 10.289 537 H ASP 71 HN ASP 71 -1.101 4.804 8.613 538 HA ASP 71 HA ASP 71 1.094 4.563 6.697 539 HB2 ASP 71 2HB ASP 71 -0.038 6.744 6.850 540 HB3 ASP 71 1HB ASP 71 0.315 6.815 8.571 541 H ALA 72 HN ALA 72 2.771 3.405 7.412 542 HA ALA 72 HA ALA 72 2.976 2.677 10.159 543 HB1 ALA 72 1HB ALA 72 4.897 2.120 7.908 544 HB2 ALA 72 2HB ALA 72 3.503 1.129 8.338 545 HB3 ALA 72 3HB ALA 72 4.846 1.301 9.467 546 H ALA 73 HN ALA 73 4.156 5.368 8.515 547 HA ALA 73 HA ALA 73 6.578 5.588 10.099 548 HB1 ALA 73 1HB ALA 73 7.003 7.627 8.857 549 HB2 ALA 73 2HB ALA 73 5.403 7.539 8.124 550 HB3 ALA 73 3HB ALA 73 6.612 6.309 7.751 551 H SER 74 HN SER 74 3.414 7.100 9.831 552 HA SER 74 HA SER 74 4.053 8.867 12.083 553 HB2 SER 74 2HB SER 74 3.046 9.810 9.996 554 HB3 SER 74 1HB SER 74 1.600 8.851 10.305 555 HG SER 74 HG SER 74 2.380 11.221 11.396 556 H MET 75 HN MET 75 2.182 6.054 11.281 557 HA MET 75 HA MET 75 0.916 6.157 13.945 558 HB2 MET 75 2HB MET 75 -0.323 5.316 11.316 559 HB3 MET 75 1HB MET 75 -1.045 4.953 12.877 560 HG2 MET 75 2HG MET 75 -1.116 7.383 13.354 561 HG3 MET 75 1HG MET 75 -0.515 7.681 11.727 562 HE1 MET 75 3HE MET 75 -1.879 7.147 9.520 563 HE2 MET 75 1HE MET 75 -3.464 6.380 9.515 564 HE3 MET 75 2HE MET 75 -2.047 5.462 10.023 565 HA PRO 76 HA PRO 76 2.580 2.054 14.324 566 HB2 PRO 76 2HB PRO 76 1.344 1.316 16.600 567 HB3 PRO 76 1HB PRO 76 2.640 2.511 16.581 568 HG2 PRO 76 2HG PRO 76 -0.296 2.897 16.833 569 HG3 PRO 76 1HG PRO 76 1.023 3.819 17.568 570 HD2 PRO 76 2HD PRO 76 -0.442 4.579 15.320 571 HD3 PRO 76 1HD PRO 76 1.123 5.254 15.807 572 H LEU 77 HN LEU 77 1.982 -0.096 14.054 573 HA LEU 77 HA LEU 77 -0.631 -0.529 12.890 574 HB2 LEU 77 2HB LEU 77 1.467 -1.540 11.971 575 HB3 LEU 77 1HB LEU 77 1.587 -2.513 13.423 576 HG LEU 77 HG LEU 77 -0.463 -3.690 12.860 577 HD11 LEU 77 1HD1 LEU 77 -1.632 -1.825 11.768 578 HD12 LEU 77 2HD1 LEU 77 -1.635 -3.285 10.778 579 HD13 LEU 77 3HD1 LEU 77 -0.537 -1.961 10.391 580 HD21 LEU 77 3HD2 LEU 77 0.301 -4.848 10.868 581 HD22 LEU 77 1HD2 LEU 77 1.661 -4.498 11.936 582 HD23 LEU 77 2HD2 LEU 77 1.397 -3.517 10.495 583 H THR 78 HN THR 78 -2.223 -1.937 13.757 584 HA THR 78 HA THR 78 -1.872 -2.635 16.576 585 HB THR 78 HB THR 78 -4.458 -1.354 15.978 586 HG1 THR 78 1HG THR 78 -2.017 -0.039 15.587 587 HG21 THR 78 3HG2 THR 78 -3.766 -2.076 18.234 588 HG22 THR 78 1HG2 THR 78 -4.074 -0.340 18.165 589 HG23 THR 78 2HG2 THR 78 -2.416 -0.940 18.170 590 H ASP 79 HN ASP 79 -3.778 -3.881 17.397 591 HA ASP 79 HA ASP 79 -4.233 -6.121 15.735 592 HB2 ASP 79 2HB ASP 79 -5.535 -6.994 17.577 593 HB3 ASP 79 1HB ASP 79 -4.108 -6.193 18.224 594 H ALA 80 HN ALA 80 -5.942 -3.185 16.196 595 HA ALA 80 HA ALA 80 -8.559 -3.857 15.570 596 HB1 ALA 80 1HB ALA 80 -7.083 -1.341 14.810 597 HB2 ALA 80 2HB ALA 80 -7.871 -1.648 16.359 598 HB3 ALA 80 3HB ALA 80 -8.835 -1.536 14.885 599 H ALA 81 HN ALA 81 -5.772 -3.748 13.521 600 HA ALA 81 HA ALA 81 -7.006 -3.349 11.023 601 HB1 ALA 81 1HB ALA 81 -4.600 -3.126 11.366 602 HB2 ALA 81 2HB ALA 81 -4.960 -4.261 10.064 603 HB3 ALA 81 3HB ALA 81 -4.477 -4.864 11.649 604 H PHE 82 HN PHE 82 -6.997 -6.096 13.097 605 HA PHE 82 HA PHE 82 -7.429 -8.048 11.045 606 HB2 PHE 82 2HB PHE 82 -7.649 -8.088 14.041 607 HB3 PHE 82 1HB PHE 82 -8.214 -9.447 13.075 608 HD1 PHE 82 2HD PHE 82 -6.664 -10.830 11.838 609 HD2 PHE 82 1HD PHE 82 -5.292 -7.591 14.234 610 HE1 PHE 82 2HE PHE 82 -4.373 -11.724 11.730 611 HE2 PHE 82 1HE PHE 82 -3.001 -8.477 14.128 612 HZ PHE 82 HZ PHE 82 -2.541 -10.547 12.874 613 H GLU 83 HN GLU 83 -9.416 -5.711 12.514 614 HA GLU 83 HA GLU 83 -11.882 -7.160 12.170 615 HB2 GLU 83 2HB GLU 83 -11.362 -4.242 12.715 616 HB3 GLU 83 1HB GLU 83 -12.936 -5.017 12.756 617 HG2 GLU 83 2HG GLU 83 -12.076 -6.498 14.556 618 HG3 GLU 83 1HG GLU 83 -10.607 -5.530 14.574 619 H ALA 84 HN ALA 84 -9.848 -5.133 10.306 620 HA ALA 84 HA ALA 84 -11.867 -4.403 8.385 621 HB1 ALA 84 1HB ALA 84 -10.063 -2.838 8.961 622 HB2 ALA 84 2HB ALA 84 -10.085 -3.231 7.242 623 HB3 ALA 84 3HB ALA 84 -8.885 -3.974 8.299 624 H GLU 85 HN GLU 85 -12.054 -5.165 6.341 625 HA GLU 85 HA GLU 85 -10.829 -7.757 5.800 626 HB2 GLU 85 2HB GLU 85 -13.346 -7.073 5.456 627 HB3 GLU 85 1HB GLU 85 -12.746 -6.397 3.947 628 HG2 GLU 85 2HG GLU 85 -13.561 -8.586 3.506 629 HG3 GLU 85 1HG GLU 85 -11.800 -8.628 3.397 630 H TYR 86 HN TYR 86 -10.872 -4.456 4.681 631 HA TYR 86 HA TYR 86 -8.877 -5.094 2.611 632 HB2 TYR 86 2HB TYR 86 -10.691 -2.687 2.930 633 HB3 TYR 86 1HB TYR 86 -9.437 -2.821 1.704 634 HD1 TYR 86 1HD TYR 86 -12.423 -4.733 2.937 635 HD2 TYR 86 2HD TYR 86 -10.067 -3.529 -0.397 636 HE1 TYR 86 1HE TYR 86 -14.035 -5.801 1.420 637 HE2 TYR 86 2HE TYR 86 -11.672 -4.599 -1.925 638 HH TYR 86 HH TYR 86 -13.388 -6.264 -1.932 639 H LEU 87 HN LEU 87 -6.865 -4.850 3.381 640 HA LEU 87 HA LEU 87 -6.373 -2.629 5.253 641 HB2 LEU 87 2HB LEU 87 -5.030 -5.296 4.929 642 HB3 LEU 87 1HB LEU 87 -4.222 -3.968 5.734 643 HG LEU 87 HG LEU 87 -5.148 -5.327 7.426 644 HD11 LEU 87 1HD1 LEU 87 -6.712 -3.837 8.542 645 HD12 LEU 87 2HD1 LEU 87 -6.991 -2.978 7.028 646 HD13 LEU 87 3HD1 LEU 87 -5.401 -2.930 7.789 647 HD21 LEU 87 3HD2 LEU 87 -6.730 -6.594 6.080 648 HD22 LEU 87 1HD2 LEU 87 -7.781 -5.181 5.962 649 HD23 LEU 87 2HD2 LEU 87 -7.509 -5.951 7.525 650 H ALA 88 HN ALA 88 -5.280 -0.967 4.524 651 HA ALA 88 HA ALA 88 -3.397 -1.376 2.297 652 HB1 ALA 88 1HB ALA 88 -5.213 0.131 1.707 653 HB2 ALA 88 2HB ALA 88 -3.684 1.010 1.789 654 HB3 ALA 88 3HB ALA 88 -4.850 1.141 3.107 655 H VAL 89 HN VAL 89 -1.394 -1.525 3.039 656 HA VAL 89 HA VAL 89 -0.664 -0.018 5.461 657 HB VAL 89 HB VAL 89 0.739 -2.408 4.246 658 HG11 VAL 89 1HG1 VAL 89 2.271 -0.970 5.462 659 HG12 VAL 89 2HG1 VAL 89 1.984 -2.455 6.369 660 HG13 VAL 89 3HG1 VAL 89 1.189 -0.959 6.854 661 HG21 VAL 89 3HG2 VAL 89 -1.441 -3.025 5.144 662 HG22 VAL 89 1HG2 VAL 89 -1.052 -2.229 6.669 663 HG23 VAL 89 2HG2 VAL 89 -0.149 -3.657 6.166 664 H ASP 90 HN ASP 90 0.517 1.716 5.186 665 HA ASP 90 HA ASP 90 1.962 2.071 2.653 666 HB2 ASP 90 2HB ASP 90 0.246 3.752 3.206 667 HB3 ASP 90 1HB ASP 90 1.081 4.108 4.713 668 H GLN 91 HN GLN 91 4.108 2.371 2.586 669 HA GLN 91 HA GLN 91 6.286 2.477 3.174 670 HB2 GLN 91 2HB GLN 91 5.136 3.804 5.626 671 HB3 GLN 91 1HB GLN 91 6.864 3.631 5.345 672 HG2 GLN 91 2HG GLN 91 6.776 5.009 3.419 673 HG3 GLN 91 1HG GLN 91 5.011 5.001 3.418 674 HE21 GLN 91 1HE2 GLN 91 3.899 6.250 4.900 675 HE22 GLN 91 2HE2 GLN 91 4.663 7.515 5.809 676 H VAL 92 HN VAL 92 5.643 0.064 3.251 677 HA VAL 92 HA VAL 92 5.570 -1.337 5.693 678 HB VAL 92 HB VAL 92 6.657 -2.337 3.053 679 HG11 VAL 92 1HG1 VAL 92 7.188 -3.803 4.931 680 HG12 VAL 92 2HG1 VAL 92 5.997 -4.545 3.862 681 HG13 VAL 92 3HG1 VAL 92 5.487 -3.836 5.393 682 HG21 VAL 92 3HG2 VAL 92 3.833 -2.386 4.103 683 HG22 VAL 92 1HG2 VAL 92 4.392 -3.150 2.615 684 HG23 VAL 92 2HG2 VAL 92 4.428 -1.393 2.772 685 H GLU 93 HN GLU 93 8.207 -0.072 3.796 686 HA GLU 93 HA GLU 93 10.338 -1.480 5.009 687 HB2 GLU 93 2HB GLU 93 11.732 0.361 4.082 688 HB3 GLU 93 1HB GLU 93 10.636 -0.346 2.901 689 HG2 GLU 93 2HG GLU 93 9.061 1.526 3.344 690 HG3 GLU 93 1HG GLU 93 10.297 2.258 4.365 691 H LYS 94 HN LYS 94 8.335 1.043 6.169 692 HA LYS 94 HA LYS 94 10.375 2.063 7.995 693 HB2 LYS 94 2HB LYS 94 8.013 3.166 6.747 694 HB3 LYS 94 1HB LYS 94 7.963 3.402 8.488 695 HG2 LYS 94 2HG LYS 94 9.001 5.315 7.582 696 HG3 LYS 94 1HG LYS 94 10.278 4.360 8.329 697 HD2 LYS 94 2HD LYS 94 11.190 5.039 6.286 698 HD3 LYS 94 1HD LYS 94 10.659 3.386 5.986 699 HE2 LYS 94 2HE LYS 94 8.691 4.153 4.857 700 HE3 LYS 94 1HE LYS 94 9.011 5.821 5.325 701 HZ1 LYS 94 3HZ LYS 94 10.615 4.169 3.438 702 HZ2 LYS 94 1HZ LYS 94 11.050 5.719 3.963 703 HZ3 LYS 94 2HZ LYS 94 9.641 5.504 3.049 704 H LEU 95 HN LEU 95 8.646 -0.572 8.143 705 HA LEU 95 HA LEU 95 7.225 -0.384 10.588 706 HB2 LEU 95 2HB LEU 95 8.454 -2.759 9.190 707 HB3 LEU 95 1HB LEU 95 7.445 -2.881 10.614 708 HG LEU 95 HG LEU 95 6.565 -1.807 7.933 709 HD11 LEU 95 1HD1 LEU 95 5.205 -3.841 7.844 710 HD12 LEU 95 2HD1 LEU 95 5.940 -4.393 9.350 711 HD13 LEU 95 3HD1 LEU 95 6.929 -4.208 7.901 712 HD21 LEU 95 3HD2 LEU 95 5.396 -0.709 9.757 713 HD22 LEU 95 1HD2 LEU 95 5.018 -2.273 10.481 714 HD23 LEU 95 2HD2 LEU 95 4.319 -1.830 8.924 715 H GLY 96 HN GLY 96 7.823 -1.245 12.654 716 HA2 GLY 96 2HA GLY 96 10.651 -0.752 13.227 717 HA3 GLY 96 1HA GLY 96 9.337 -0.710 14.393 718 H ASN 97 HN ASN 97 8.371 -2.767 15.023 719 HA ASN 97 HA ASN 97 10.000 -5.147 14.574 720 HB2 ASN 97 2HB ASN 97 11.084 -3.817 16.442 721 HB3 ASN 97 1HB ASN 97 9.619 -4.078 17.379 722 HD21 ASN 97 1HD2 ASN 97 12.355 -4.896 17.903 723 HD22 ASN 97 2HD2 ASN 97 12.319 -6.618 18.089 724 H GLU 98 HN GLU 98 7.720 -4.012 17.048 725 HA GLU 98 HA GLU 98 6.159 -6.333 17.193 726 HB2 GLU 98 2HB GLU 98 6.193 -4.504 18.859 727 HB3 GLU 98 1HB GLU 98 5.375 -3.460 17.714 728 HG2 GLU 98 2HG GLU 98 3.436 -4.967 17.754 729 HG3 GLU 98 1HG GLU 98 4.257 -5.956 18.965 730 H GLU 99 HN GLU 99 6.012 -3.505 15.180 731 HA GLU 99 HA GLU 99 3.500 -3.874 13.992 732 HB2 GLU 99 2HB GLU 99 5.975 -2.602 12.791 733 HB3 GLU 99 1HB GLU 99 4.328 -2.383 12.224 734 HG2 GLU 99 2HG GLU 99 4.948 -0.450 13.454 735 HG3 GLU 99 1HG GLU 99 3.776 -1.345 14.418 736 H GLN 100 HN GLN 100 6.653 -5.247 13.311 737 HA GLN 100 HA GLN 100 5.991 -6.319 10.761 738 HB2 GLN 100 2HB GLN 100 8.192 -6.962 12.721 739 HB3 GLN 100 1HB GLN 100 8.037 -7.758 11.162 740 HG2 GLN 100 2HG GLN 100 8.213 -5.554 10.062 741 HG3 GLN 100 1HG GLN 100 8.483 -4.823 11.643 742 HE21 GLN 100 1HE2 GLN 100 10.442 -5.095 12.662 743 HE22 GLN 100 2HE2 GLN 100 11.822 -5.778 11.880 744 H ALA 101 HN ALA 101 5.992 -7.626 14.050 745 HA ALA 101 HA ALA 101 5.301 -10.272 13.377 746 HB1 ALA 101 1HB ALA 101 6.147 -9.647 15.581 747 HB2 ALA 101 2HB ALA 101 4.603 -10.487 15.713 748 HB3 ALA 101 3HB ALA 101 4.672 -8.735 15.898 749 H LEU 102 HN LEU 102 3.357 -7.418 14.089 750 HA LEU 102 HA LEU 102 0.826 -8.674 13.919 751 HB2 LEU 102 2HB LEU 102 1.572 -6.306 14.785 752 HB3 LEU 102 1HB LEU 102 1.282 -5.821 13.130 753 HG LEU 102 HG LEU 102 -0.618 -5.323 14.585 754 HD11 LEU 102 1HD1 LEU 102 -1.203 -7.458 12.547 755 HD12 LEU 102 2HD1 LEU 102 -1.091 -5.722 12.254 756 HD13 LEU 102 3HD1 LEU 102 -2.395 -6.366 13.253 757 HD21 LEU 102 3HD2 LEU 102 -0.356 -7.109 16.201 758 HD22 LEU 102 1HD2 LEU 102 -0.775 -8.305 14.974 759 HD23 LEU 102 2HD2 LEU 102 -1.980 -7.135 15.513 760 H LEU 103 HN LEU 103 2.763 -6.852 11.575 761 HA LEU 103 HA LEU 103 1.115 -7.007 9.347 762 HB2 LEU 103 2HB LEU 103 3.522 -5.932 9.851 763 HB3 LEU 103 1HB LEU 103 4.044 -7.340 8.952 764 HG LEU 103 HG LEU 103 3.873 -5.386 7.514 765 HD11 LEU 103 1HD1 LEU 103 2.445 -6.302 5.760 766 HD12 LEU 103 2HD1 LEU 103 1.733 -7.419 6.926 767 HD13 LEU 103 3HD1 LEU 103 3.443 -7.546 6.509 768 HD21 LEU 103 3HD2 LEU 103 0.959 -5.365 8.277 769 HD22 LEU 103 1HD2 LEU 103 1.702 -4.363 7.030 770 HD23 LEU 103 2HD2 LEU 103 2.167 -4.158 8.719 771 H PHE 104 HN PHE 104 3.656 -9.272 10.384 772 HA PHE 104 HA PHE 104 3.389 -11.160 8.346 773 HB2 PHE 104 2HB PHE 104 5.228 -11.150 9.999 774 HB3 PHE 104 1HB PHE 104 4.099 -11.666 11.245 775 HD1 PHE 104 1HD PHE 104 5.525 -12.692 7.971 776 HD2 PHE 104 2HD PHE 104 3.725 -13.922 11.624 777 HE1 PHE 104 1HE PHE 104 5.966 -15.044 7.395 778 HE2 PHE 104 2HE PHE 104 4.168 -16.272 11.057 779 HZ PHE 104 HZ PHE 104 5.289 -16.835 8.939 780 H SER 105 HN SER 105 1.674 -10.846 11.411 781 HA SER 105 HA SER 105 0.140 -13.180 11.241 782 HB2 SER 105 2HB SER 105 -0.462 -10.538 12.589 783 HB3 SER 105 1HB SER 105 -1.303 -12.049 12.891 784 HG SER 105 HG SER 105 1.410 -11.427 13.425 785 H ILE 106 HN ILE 106 -0.307 -9.961 9.902 786 HA ILE 106 HA ILE 106 -2.943 -10.266 8.963 787 HB ILE 106 HB ILE 106 -0.699 -8.615 7.774 788 HG12 ILE 106 2HG1 ILE 106 -2.914 -7.855 9.695 789 HG13 ILE 106 1HG1 ILE 106 -1.218 -8.065 10.121 790 HG21 ILE 106 1HG2 ILE 106 -3.678 -8.485 7.316 791 HG22 ILE 106 2HG2 ILE 106 -2.446 -8.933 6.138 792 HG23 ILE 106 3HG2 ILE 106 -2.517 -7.283 6.753 793 HD11 ILE 106 3HD1 ILE 106 -0.614 -6.197 8.701 794 HD12 ILE 106 1HD1 ILE 106 -1.821 -5.716 9.892 795 HD13 ILE 106 2HD1 ILE 106 -2.299 -6.000 8.218 796 H PHE 107 HN PHE 107 0.187 -10.876 7.348 797 HA PHE 107 HA PHE 107 -0.799 -11.942 4.953 798 HB2 PHE 107 2HB PHE 107 1.730 -12.387 6.521 799 HB3 PHE 107 1HB PHE 107 1.403 -13.331 5.079 800 HD1 PHE 107 1HD PHE 107 0.814 -11.946 2.939 801 HD2 PHE 107 2HD PHE 107 2.857 -10.396 6.334 802 HE1 PHE 107 1HE PHE 107 1.773 -10.159 1.544 803 HE2 PHE 107 2HE PHE 107 3.821 -8.614 4.943 804 HZ PHE 107 HZ PHE 107 3.281 -8.493 2.546 805 H ASN 108 HN ASN 108 -0.057 -13.477 8.038 806 HA ASN 108 HA ASN 108 -0.549 -16.135 7.381 807 HB2 ASN 108 2HB ASN 108 0.461 -15.354 9.504 808 HB3 ASN 108 1HB ASN 108 -1.110 -14.748 10.010 809 HD21 ASN 108 1HD2 ASN 108 -1.170 -16.046 11.811 810 HD22 ASN 108 2HD2 ASN 108 -1.399 -17.760 11.737 811 H ARG 109 HN ARG 109 -2.790 -13.643 8.533 812 HA ARG 109 HA ARG 109 -5.089 -15.250 8.667 813 HB2 ARG 109 2HB ARG 109 -5.047 -13.074 9.718 814 HB3 ARG 109 1HB ARG 109 -4.759 -12.281 8.175 815 HG2 ARG 109 2HG ARG 109 -7.004 -13.090 7.428 816 HG3 ARG 109 1HG ARG 109 -7.279 -13.664 9.074 817 HD2 ARG 109 2HD ARG 109 -7.069 -11.419 9.937 818 HD3 ARG 109 1HD ARG 109 -6.630 -10.809 8.343 819 HE ARG 109 HE ARG 109 -9.232 -12.107 8.558 820 HH11 ARG 109 1HH1 ARG 109 -7.444 -9.088 8.587 821 HH12 ARG 109 2HH1 ARG 109 -8.818 -8.113 8.164 822 HH21 ARG 109 1HH2 ARG 109 -11.046 -10.822 8.004 823 HH22 ARG 109 2HH2 ARG 109 -10.871 -9.105 7.844 824 H PHE 110 HN PHE 110 -3.969 -13.098 6.034 825 HA PHE 110 HA PHE 110 -6.192 -13.661 4.376 826 HB2 PHE 110 2HB PHE 110 -3.491 -12.472 3.744 827 HB3 PHE 110 1HB PHE 110 -4.799 -12.592 2.574 828 HD1 PHE 110 1HD PHE 110 -6.901 -12.071 4.915 829 HD2 PHE 110 2HD PHE 110 -3.472 -10.035 3.433 830 HE1 PHE 110 1HE PHE 110 -7.828 -9.936 5.712 831 HE2 PHE 110 2HE PHE 110 -4.392 -7.898 4.229 832 HZ PHE 110 HZ PHE 110 -6.574 -7.847 5.370 833 H ARG 111 HN ARG 111 -2.911 -14.997 4.495 834 HA ARG 111 HA ARG 111 -3.188 -16.630 2.198 835 HB2 ARG 111 2HB ARG 111 -0.980 -16.224 2.929 836 HB3 ARG 111 1HB ARG 111 -1.340 -16.708 4.578 837 HG2 ARG 111 2HG ARG 111 0.021 -18.368 3.460 838 HG3 ARG 111 1HG ARG 111 -1.566 -19.026 3.857 839 HD2 ARG 111 2HD ARG 111 -2.207 -18.352 1.452 840 HD3 ARG 111 1HD ARG 111 -0.467 -18.237 1.179 841 HE ARG 111 HE ARG 111 -0.542 -20.650 2.163 842 HH11 ARG 111 1HH1 ARG 111 -2.733 -19.192 -0.142 843 HH12 ARG 111 2HH1 ARG 111 -3.336 -20.715 -0.728 844 HH21 ARG 111 1HH2 ARG 111 -1.313 -22.653 1.402 845 HH22 ARG 111 2HH2 ARG 111 -2.491 -22.691 0.120 846 H ASN 112 HN ASN 112 -3.890 -17.154 5.614 847 HA ASN 112 HA ASN 112 -4.404 -19.951 5.306 848 HB2 ASN 112 2HB ASN 112 -4.105 -18.129 7.456 849 HB3 ASN 112 1HB ASN 112 -5.669 -18.912 7.648 850 HD21 ASN 112 1HD2 ASN 112 -3.141 -19.127 9.150 851 HD22 ASN 112 2HD2 ASN 112 -2.755 -20.812 9.169 852 H SER 113 HN SER 113 -6.413 -17.051 5.400 853 HA SER 113 HA SER 113 -8.849 -18.616 5.437 854 HB2 SER 113 2HB SER 113 -8.657 -16.483 6.696 855 HB3 SER 113 1HB SER 113 -8.488 -15.620 5.168 856 HG SER 113 HG SER 113 -10.605 -15.485 5.589 857 H GLY 114 HN GLY 114 -7.112 -16.539 3.141 858 HA2 GLY 114 2HA GLY 114 -7.185 -16.812 0.785 859 HA3 GLY 114 1HA GLY 114 -8.688 -17.715 0.960 860 H LYS 115 HN LYS 115 -9.679 -15.695 2.863 861 HA LYS 115 HA LYS 115 -10.728 -13.772 0.961 862 HB2 LYS 115 2HB LYS 115 -12.219 -15.019 2.508 863 HB3 LYS 115 1HB LYS 115 -11.384 -14.310 3.873 864 HG2 LYS 115 2HG LYS 115 -12.186 -12.094 3.213 865 HG3 LYS 115 1HG LYS 115 -13.032 -12.818 1.839 866 HD2 LYS 115 2HD LYS 115 -14.469 -14.061 3.292 867 HD3 LYS 115 1HD LYS 115 -13.517 -13.618 4.707 868 HE2 LYS 115 2HE LYS 115 -15.552 -12.323 4.652 869 HE3 LYS 115 1HE LYS 115 -14.166 -11.269 4.381 870 HZ1 LYS 115 3HZ LYS 115 -14.645 -11.217 2.047 871 HZ2 LYS 115 1HZ LYS 115 -16.057 -10.810 2.898 872 HZ3 LYS 115 2HZ LYS 115 -15.889 -12.357 2.220 873 H GLY 116 HN GLY 116 -10.982 -11.500 1.996 874 HA2 GLY 116 2HA GLY 116 -10.015 -9.701 3.180 875 HA3 GLY 116 1HA GLY 116 -8.628 -10.722 3.540 876 H PHE 117 HN PHE 117 -8.660 -8.021 2.479 877 HA PHE 117 HA PHE 117 -7.256 -8.530 -0.061 878 HB2 PHE 117 2HB PHE 117 -9.112 -6.227 0.593 879 HB3 PHE 117 1HB PHE 117 -8.060 -6.276 -0.815 880 HD1 PHE 117 2HD PHE 117 -10.884 -8.039 0.823 881 HD2 PHE 117 1HD PHE 117 -8.750 -7.310 -2.781 882 HE1 PHE 117 2HE PHE 117 -12.632 -9.216 -0.446 883 HE2 PHE 117 1HE PHE 117 -10.492 -8.486 -4.057 884 HZ PHE 117 HZ PHE 117 -12.437 -9.442 -2.887 885 H LEU 118 HN LEU 118 -5.294 -7.530 -0.268 886 HA LEU 118 HA LEU 118 -4.514 -5.696 1.901 887 HB2 LEU 118 2HB LEU 118 -3.651 -8.068 2.189 888 HB3 LEU 118 1HB LEU 118 -2.712 -7.790 0.738 889 HG LEU 118 HG LEU 118 -1.503 -5.966 1.839 890 HD11 LEU 118 1HD1 LEU 118 -3.268 -5.248 3.368 891 HD12 LEU 118 2HD1 LEU 118 -1.766 -5.583 4.228 892 HD13 LEU 118 3HD1 LEU 118 -3.089 -6.746 4.282 893 HD21 LEU 118 3HD2 LEU 118 -0.587 -8.212 1.936 894 HD22 LEU 118 1HD2 LEU 118 -1.517 -8.547 3.397 895 HD23 LEU 118 2HD2 LEU 118 -0.235 -7.335 3.425 896 H LEU 119 HN LEU 119 -3.394 -3.997 1.311 897 HA LEU 119 HA LEU 119 -2.241 -3.865 -1.385 898 HB2 LEU 119 2HB LEU 119 -4.419 -2.660 -1.321 899 HB3 LEU 119 1HB LEU 119 -3.792 -1.647 -0.036 900 HG LEU 119 HG LEU 119 -2.071 -0.777 -1.578 901 HD11 LEU 119 1HD1 LEU 119 -1.849 -2.668 -3.067 902 HD12 LEU 119 2HD1 LEU 119 -2.299 -1.234 -3.990 903 HD13 LEU 119 3HD1 LEU 119 -3.510 -2.462 -3.623 904 HD21 LEU 119 3HD2 LEU 119 -4.926 -0.542 -2.517 905 HD22 LEU 119 1HD2 LEU 119 -3.614 0.534 -2.995 906 HD23 LEU 119 2HD2 LEU 119 -4.122 0.458 -1.309 907 H LEU 120 HN LEU 120 -0.142 -3.636 -1.115 908 HA LEU 120 HA LEU 120 0.818 -2.296 1.320 909 HB2 LEU 120 2HB LEU 120 2.190 -4.324 -0.445 910 HB3 LEU 120 1HB LEU 120 2.899 -3.580 0.976 911 HG LEU 120 HG LEU 120 0.445 -5.338 1.010 912 HD11 LEU 120 1HD1 LEU 120 1.894 -7.033 1.979 913 HD12 LEU 120 2HD1 LEU 120 3.288 -5.970 1.787 914 HD13 LEU 120 3HD1 LEU 120 2.447 -6.587 0.365 915 HD21 LEU 120 3HD2 LEU 120 0.814 -5.358 3.434 916 HD22 LEU 120 1HD2 LEU 120 0.497 -3.730 2.836 917 HD23 LEU 120 2HD2 LEU 120 2.145 -4.217 3.236 918 H GLY 121 HN GLY 121 2.037 -0.514 1.160 919 HA2 GLY 121 2HA GLY 121 3.125 0.163 -1.503 920 HA3 GLY 121 1HA GLY 121 2.334 1.362 -0.486 921 H SER 122 HN SER 122 5.097 1.215 -1.557 922 HA SER 122 HA SER 122 6.395 2.180 0.799 923 HB2 SER 122 2HB SER 122 6.621 -0.512 0.571 924 HB3 SER 122 1HB SER 122 7.991 -0.010 -0.419 925 HG SER 122 HG SER 122 8.911 0.968 1.310 926 H GLU 123 HN GLU 123 8.844 2.663 0.113 927 HA GLU 123 HA GLU 123 8.567 3.950 -2.498 928 HB2 GLU 123 2HB GLU 123 10.508 4.502 -0.253 929 HB3 GLU 123 1HB GLU 123 10.424 5.398 -1.763 930 HG2 GLU 123 2HG GLU 123 9.119 6.785 -0.597 931 HG3 GLU 123 1HG GLU 123 7.864 5.596 -0.932 932 H TYR 124 HN TYR 124 10.414 1.526 -0.855 933 HA TYR 124 HA TYR 124 12.209 1.348 -3.180 934 HB2 TYR 124 2HB TYR 124 12.545 0.395 -0.340 935 HB3 TYR 124 1HB TYR 124 13.619 -0.100 -1.646 936 HD1 TYR 124 1HD TYR 124 12.494 2.746 0.401 937 HD2 TYR 124 2HD TYR 124 15.244 1.406 -2.556 938 HE1 TYR 124 1HE TYR 124 13.808 4.801 0.698 939 HE2 TYR 124 2HE TYR 124 16.563 3.457 -2.267 940 HH TYR 124 HH TYR 124 15.982 5.663 0.326 941 H THR 125 HN THR 125 13.093 -1.184 -3.078 942 HA THR 125 HA THR 125 10.717 -2.650 -3.919 943 HB THR 125 HB THR 125 12.558 -4.243 -4.843 944 HG1 THR 125 1HG THR 125 14.270 -2.168 -5.180 945 HG21 THR 125 3HG2 THR 125 12.795 -2.862 -6.856 946 HG22 THR 125 1HG2 THR 125 12.212 -1.459 -5.961 947 HG23 THR 125 2HG2 THR 125 11.138 -2.830 -6.249 948 HA PRO 126 HA PRO 126 10.330 -5.317 -0.568 949 HB2 PRO 126 2HB PRO 126 10.395 -7.684 -2.348 950 HB3 PRO 126 1HB PRO 126 9.124 -7.126 -1.258 951 HG2 PRO 126 2HG PRO 126 8.884 -6.854 -3.903 952 HG3 PRO 126 1HG PRO 126 8.291 -5.602 -2.793 953 HD2 PRO 126 2HD PRO 126 10.775 -5.645 -4.453 954 HD3 PRO 126 1HD PRO 126 9.678 -4.296 -4.100 955 H GLN 127 HN GLN 127 12.900 -6.260 -2.776 956 HA GLN 127 HA GLN 127 13.927 -8.256 -0.967 957 HB2 GLN 127 2HB GLN 127 14.975 -7.205 -3.589 958 HB3 GLN 127 1HB GLN 127 15.769 -8.465 -2.655 959 HG2 GLN 127 2HG GLN 127 13.794 -9.873 -2.869 960 HG3 GLN 127 1HG GLN 127 12.992 -8.608 -3.800 961 HE21 GLN 127 1HE2 GLN 127 13.678 -8.182 -5.898 962 HE22 GLN 127 2HE2 GLN 127 14.657 -9.299 -6.783 963 H GLN 128 HN GLN 128 14.190 -4.929 -1.110 964 HA GLN 128 HA GLN 128 16.680 -5.078 0.454 965 HB2 GLN 128 2HB GLN 128 17.394 -2.932 -0.445 966 HB3 GLN 128 1HB GLN 128 17.167 -4.102 -1.736 967 HG2 GLN 128 2HG GLN 128 15.021 -3.099 -2.281 968 HG3 GLN 128 1HG GLN 128 15.228 -1.931 -0.978 969 HE21 GLN 128 1HE2 GLN 128 17.855 -3.017 -3.013 970 HE22 GLN 128 2HE2 GLN 128 18.087 -1.514 -3.836 971 H LEU 129 HN LEU 129 13.589 -4.774 0.873 972 HA LEU 129 HA LEU 129 13.332 -2.354 2.356 973 HB2 LEU 129 2HB LEU 129 11.746 -4.921 2.489 974 HB3 LEU 129 1HB LEU 129 11.306 -3.439 3.308 975 HG LEU 129 HG LEU 129 11.426 -3.865 0.324 976 HD11 LEU 129 1HD1 LEU 129 9.006 -3.488 0.450 977 HD12 LEU 129 2HD1 LEU 129 9.118 -3.394 2.208 978 HD13 LEU 129 3HD1 LEU 129 9.500 -4.903 1.379 979 HD21 LEU 129 3HD2 LEU 129 12.135 -1.597 0.936 980 HD22 LEU 129 1HD2 LEU 129 10.656 -1.394 1.875 981 HD23 LEU 129 2HD2 LEU 129 10.569 -1.599 0.125 982 H VAL 130 HN VAL 130 13.174 -2.154 4.667 983 HA VAL 130 HA VAL 130 15.088 -3.828 6.065 984 HB VAL 130 HB VAL 130 13.554 -1.480 7.185 985 HG11 VAL 130 1HG1 VAL 130 15.460 -1.351 8.743 986 HG12 VAL 130 2HG1 VAL 130 16.120 -2.821 8.026 987 HG13 VAL 130 3HG1 VAL 130 14.576 -2.872 8.879 988 HG21 VAL 130 3HG2 VAL 130 15.499 -0.106 6.651 989 HG22 VAL 130 1HG2 VAL 130 14.761 -0.766 5.191 990 HG23 VAL 130 2HG2 VAL 130 16.245 -1.476 5.828 991 H ILE 131 HN ILE 131 13.808 -5.749 6.060 992 HA ILE 131 HA ILE 131 11.829 -5.796 8.220 993 HB ILE 131 HB ILE 131 10.437 -7.403 6.848 994 HG12 ILE 131 2HG1 ILE 131 12.128 -6.256 4.611 995 HG13 ILE 131 1HG1 ILE 131 12.055 -7.941 5.111 996 HG21 ILE 131 1HG2 ILE 131 10.631 -4.544 5.928 997 HG22 ILE 131 2HG2 ILE 131 9.679 -5.160 7.279 998 HG23 ILE 131 3HG2 ILE 131 9.264 -5.616 5.626 999 HD11 ILE 131 3HD1 ILE 131 10.793 -7.534 3.064 1000 HD12 ILE 131 1HD1 ILE 131 9.774 -6.389 3.934 1001 HD13 ILE 131 2HD1 ILE 131 9.755 -8.095 4.377 1002 H ARG 132 HN ARG 132 11.401 -8.008 9.003 1003 HA ARG 132 HA ARG 132 13.877 -9.470 9.157 1004 HB2 ARG 132 2HB ARG 132 11.197 -9.941 10.470 1005 HB3 ARG 132 1HB ARG 132 12.618 -10.937 10.756 1006 HG2 ARG 132 2HG ARG 132 13.816 -8.869 11.491 1007 HG3 ARG 132 1HG ARG 132 12.275 -8.019 11.391 1008 HD2 ARG 132 2HD ARG 132 11.321 -9.561 13.041 1009 HD3 ARG 132 1HD ARG 132 12.863 -10.412 13.135 1010 HE ARG 132 HE ARG 132 12.978 -7.570 13.697 1011 HH11 ARG 132 1HH1 ARG 132 12.645 -10.791 15.061 1012 HH12 ARG 132 2HH1 ARG 132 13.203 -10.310 16.636 1013 HH21 ARG 132 1HH2 ARG 132 13.676 -6.952 15.757 1014 HH22 ARG 132 2HH2 ARG 132 13.755 -8.117 17.040 1015 H GLU 133 HN GLU 133 13.674 -11.945 9.176 1016 HA GLU 133 HA GLU 133 13.730 -12.587 6.482 1017 HB2 GLU 133 2HB GLU 133 13.656 -14.376 8.910 1018 HB3 GLU 133 1HB GLU 133 13.995 -14.952 7.287 1019 HG2 GLU 133 2HG GLU 133 16.045 -14.655 8.532 1020 HG3 GLU 133 1HG GLU 133 15.976 -13.529 7.181 1021 H ASP 134 HN ASP 134 11.355 -13.793 8.876 1022 HA ASP 134 HA ASP 134 9.887 -15.345 7.077 1023 HB2 ASP 134 2HB ASP 134 8.977 -13.997 9.624 1024 HB3 ASP 134 1HB ASP 134 8.058 -15.228 8.762 1025 H LEU 135 HN LEU 135 9.503 -11.958 7.981 1026 HA LEU 135 HA LEU 135 7.059 -11.590 6.563 1027 HB2 LEU 135 2HB LEU 135 7.825 -10.159 8.448 1028 HB3 LEU 135 1HB LEU 135 9.095 -9.526 7.420 1029 HG LEU 135 HG LEU 135 7.348 -8.619 5.898 1030 HD11 LEU 135 1HD1 LEU 135 5.050 -8.466 6.737 1031 HD12 LEU 135 2HD1 LEU 135 5.485 -9.505 8.093 1032 HD13 LEU 135 3HD1 LEU 135 5.535 -10.137 6.447 1033 HD21 LEU 135 3HD2 LEU 135 8.394 -7.206 7.574 1034 HD22 LEU 135 1HD2 LEU 135 7.215 -7.734 8.774 1035 HD23 LEU 135 2HD2 LEU 135 6.691 -6.783 7.385 1036 H ARG 136 HN ARG 136 10.445 -11.297 5.810 1037 HA ARG 136 HA ARG 136 10.306 -9.744 3.479 1038 HB2 ARG 136 2HB ARG 136 12.323 -10.398 4.925 1039 HB3 ARG 136 1HB ARG 136 12.353 -11.893 4.003 1040 HG2 ARG 136 2HG ARG 136 12.729 -10.660 1.957 1041 HG3 ARG 136 1HG ARG 136 12.602 -9.131 2.832 1042 HD2 ARG 136 2HD ARG 136 14.517 -9.946 4.271 1043 HD3 ARG 136 1HD ARG 136 14.722 -11.249 3.102 1044 HE ARG 136 HE ARG 136 14.814 -9.099 1.524 1045 HH11 ARG 136 1HH1 ARG 136 16.414 -9.790 4.561 1046 HH12 ARG 136 2HH1 ARG 136 17.818 -8.834 4.187 1047 HH21 ARG 136 1HH2 ARG 136 16.645 -7.811 1.041 1048 HH22 ARG 136 2HH2 ARG 136 17.927 -7.681 2.209 1049 H THR 137 HN THR 137 10.125 -13.249 3.958 1050 HA THR 137 HA THR 137 10.094 -13.863 1.171 1051 HB THR 137 HB THR 137 9.267 -16.123 1.936 1052 HG1 THR 137 1HG THR 137 9.918 -15.608 4.561 1053 HG21 THR 137 3HG2 THR 137 11.386 -16.745 3.006 1054 HG22 THR 137 1HG2 THR 137 11.744 -15.040 3.280 1055 HG23 THR 137 2HG2 THR 137 11.648 -15.668 1.634 1056 H ARG 138 HN ARG 138 7.614 -13.344 3.628 1057 HA ARG 138 HA ARG 138 5.378 -14.070 2.086 1058 HB2 ARG 138 2HB ARG 138 5.625 -12.066 4.333 1059 HB3 ARG 138 1HB ARG 138 4.102 -12.679 3.700 1060 HG2 ARG 138 2HG ARG 138 6.238 -14.467 4.822 1061 HG3 ARG 138 1HG ARG 138 4.952 -13.769 5.800 1062 HD2 ARG 138 2HD ARG 138 3.280 -14.935 4.613 1063 HD3 ARG 138 1HD ARG 138 4.393 -15.354 3.312 1064 HE ARG 138 HE ARG 138 5.546 -16.778 5.034 1065 HH11 ARG 138 1HH1 ARG 138 2.145 -15.998 5.318 1066 HH12 ARG 138 2HH1 ARG 138 1.735 -17.465 6.156 1067 HH21 ARG 138 1HH2 ARG 138 5.031 -18.709 6.126 1068 HH22 ARG 138 2HH2 ARG 138 3.384 -19.017 6.612 1069 H MET 139 HN MET 139 7.227 -11.109 2.314 1070 HA MET 139 HA MET 139 5.481 -9.423 0.881 1071 HB2 MET 139 2HB MET 139 8.465 -9.362 1.318 1072 HB3 MET 139 1HB MET 139 7.613 -8.096 0.452 1073 HG2 MET 139 2HG MET 139 7.065 -8.919 3.292 1074 HG3 MET 139 1HG MET 139 8.040 -7.537 2.803 1075 HE1 MET 139 3HE MET 139 7.060 -5.401 1.556 1076 HE2 MET 139 1HE MET 139 5.372 -5.255 1.060 1077 HE3 MET 139 2HE MET 139 6.415 -6.455 0.296 1078 H ALA 140 HN ALA 140 7.630 -11.922 -0.138 1079 HA ALA 140 HA ALA 140 7.876 -10.952 -2.847 1080 HB1 ALA 140 1HB ALA 140 8.709 -13.596 -1.677 1081 HB2 ALA 140 2HB ALA 140 9.716 -12.152 -1.770 1082 HB3 ALA 140 3HB ALA 140 9.178 -12.950 -3.247 1083 H TYR 141 HN TYR 141 5.560 -12.735 -1.125 1084 HA TYR 141 HA TYR 141 4.647 -14.322 -3.356 1085 HB2 TYR 141 2HB TYR 141 3.309 -13.694 -0.717 1086 HB3 TYR 141 1HB TYR 141 2.725 -14.853 -1.897 1087 HD1 TYR 141 1HD TYR 141 5.142 -16.318 -2.654 1088 HD2 TYR 141 2HD TYR 141 3.911 -14.882 1.158 1089 HE1 TYR 141 1HE TYR 141 6.462 -18.088 -1.567 1090 HE2 TYR 141 2HE TYR 141 5.225 -16.642 2.255 1091 HH TYR 141 HH TYR 141 7.515 -18.562 0.570 1092 H CYS 142 HN CYS 142 4.333 -11.124 -2.364 1093 HA CYS 142 HA CYS 142 1.690 -10.707 -3.476 1094 HB2 CYS 142 2HB CYS 142 2.463 -9.637 -1.329 1095 HB3 CYS 142 1HB CYS 142 3.624 -8.709 -2.268 1096 HG CYS 142 HG CYS 142 2.021 -6.845 -3.039 1097 H LEU 143 HN LEU 143 1.320 -9.505 -5.284 1098 HA LEU 143 HA LEU 143 3.296 -9.496 -7.309 1099 HB2 LEU 143 2HB LEU 143 0.517 -8.461 -7.096 1100 HB3 LEU 143 1HB LEU 143 1.521 -7.864 -8.398 1101 HG LEU 143 HG LEU 143 1.229 -10.802 -7.959 1102 HD11 LEU 143 1HD1 LEU 143 -0.654 -10.808 -9.528 1103 HD12 LEU 143 2HD1 LEU 143 -0.652 -9.045 -9.533 1104 HD13 LEU 143 3HD1 LEU 143 -1.049 -9.921 -8.056 1105 HD21 LEU 143 3HD2 LEU 143 1.737 -9.109 -10.398 1106 HD22 LEU 143 1HD2 LEU 143 1.688 -10.872 -10.354 1107 HD23 LEU 143 2HD2 LEU 143 2.953 -10.002 -9.485 1108 H VAL 144 HN VAL 144 4.052 -7.660 -8.480 1109 HA VAL 144 HA VAL 144 4.555 -5.355 -6.708 1110 HB VAL 144 HB VAL 144 6.576 -6.634 -8.562 1111 HG11 VAL 144 1HG1 VAL 144 6.888 -4.236 -8.399 1112 HG12 VAL 144 2HG1 VAL 144 8.165 -5.071 -7.513 1113 HG13 VAL 144 3HG1 VAL 144 6.827 -4.324 -6.639 1114 HG21 VAL 144 3HG2 VAL 144 6.163 -8.012 -6.595 1115 HG22 VAL 144 1HG2 VAL 144 6.431 -6.619 -5.549 1116 HG23 VAL 144 2HG2 VAL 144 7.760 -7.269 -6.510 1117 H TYR 145 HN TYR 145 3.720 -3.596 -7.554 1118 HA TYR 145 HA TYR 145 4.041 -3.126 -10.441 1119 HB2 TYR 145 2HB TYR 145 1.563 -2.672 -8.776 1120 HB3 TYR 145 1HB TYR 145 1.818 -1.893 -10.334 1121 HD1 TYR 145 2HD TYR 145 1.801 -3.215 -12.400 1122 HD2 TYR 145 1HD TYR 145 1.037 -5.027 -8.628 1123 HE1 TYR 145 2HE TYR 145 0.891 -5.192 -13.542 1124 HE2 TYR 145 1HE TYR 145 0.129 -7.012 -9.761 1125 HH TYR 145 HH TYR 145 0.514 -7.541 -13.122 1126 H GLU 146 HN GLU 146 4.071 -0.887 -11.039 1127 HA GLU 146 HA GLU 146 4.749 0.956 -8.863 1128 HB2 GLU 146 2HB GLU 146 6.674 1.743 -10.371 1129 HB3 GLU 146 1HB GLU 146 6.899 0.251 -9.469 1130 HG2 GLU 146 2HG GLU 146 5.984 -0.853 -11.659 1131 HG3 GLU 146 1HG GLU 146 6.512 0.663 -12.389 1132 H VAL 147 HN VAL 147 4.598 3.197 -9.455 1133 HA VAL 147 HA VAL 147 2.312 3.517 -11.198 1134 HB VAL 147 HB VAL 147 2.289 5.877 -10.296 1135 HG11 VAL 147 1HG1 VAL 147 2.204 3.606 -8.307 1136 HG12 VAL 147 2HG1 VAL 147 0.885 4.112 -9.362 1137 HG13 VAL 147 3HG1 VAL 147 1.458 5.190 -8.090 1138 HG21 VAL 147 3HG2 VAL 147 4.434 4.772 -8.483 1139 HG22 VAL 147 1HG2 VAL 147 3.635 6.335 -8.309 1140 HG23 VAL 147 2HG2 VAL 147 4.666 6.019 -9.706 1141 H LYS 148 HN LYS 148 5.580 3.709 -11.682 1142 HA LYS 148 HA LYS 148 5.732 5.936 -13.428 1143 HB2 LYS 148 2HB LYS 148 7.849 4.973 -14.170 1144 HB3 LYS 148 1HB LYS 148 7.722 4.869 -12.422 1145 HG2 LYS 148 2HG LYS 148 8.584 2.805 -12.983 1146 HG3 LYS 148 1HG LYS 148 6.856 2.468 -12.869 1147 HD2 LYS 148 2HD LYS 148 6.787 2.922 -15.388 1148 HD3 LYS 148 1HD LYS 148 8.545 2.791 -15.334 1149 HE2 LYS 148 2HE LYS 148 8.438 0.542 -14.583 1150 HE3 LYS 148 1HE LYS 148 6.701 0.658 -14.286 1151 HZ1 LYS 148 3HZ LYS 148 6.354 0.933 -16.668 1152 HZ2 LYS 148 1HZ LYS 148 7.160 -0.527 -16.338 1153 HZ3 LYS 148 2HZ LYS 148 8.020 0.804 -16.943 1154 HA PRO 149 HA PRO 149 3.921 4.240 -17.140 1155 HB2 PRO 149 2HB PRO 149 5.917 5.549 -18.816 1156 HB3 PRO 149 1HB PRO 149 4.208 5.942 -18.614 1157 HG2 PRO 149 2HG PRO 149 6.201 7.539 -17.697 1158 HG3 PRO 149 1HG PRO 149 4.613 7.433 -16.915 1159 HD2 PRO 149 2HD PRO 149 7.195 6.118 -16.150 1160 HD3 PRO 149 1HD PRO 149 5.972 6.888 -15.115 Start of MODEL 13 1 H1 MET 1 H1 MET 1 18.451 38.117 53.182 2 H2 MET 1 H2 MET 1 19.332 37.003 54.106 3 H3 MET 1 H3 MET 1 17.771 37.455 54.590 4 HA MET 1 HA MET 1 18.489 35.951 52.144 5 HB2 MET 1 2HB MET 1 17.111 35.107 54.704 6 HB3 MET 1 1HB MET 1 17.166 34.126 53.248 7 HG2 MET 1 2HG MET 1 18.836 33.327 54.727 8 HG3 MET 1 1HG MET 1 19.650 34.157 53.402 9 HE1 MET 1 2HE MET 1 21.892 34.244 54.784 10 HE2 MET 1 3HE MET 1 21.110 33.401 56.120 11 HE3 MET 1 1HE MET 1 22.023 34.880 56.424 12 H GLY 2 HN GLY 2 17.298 37.076 50.682 13 HA2 GLY 2 2HA GLY 2 14.387 37.196 51.205 14 HA3 GLY 2 1HA GLY 2 15.246 38.333 50.172 15 H HIS 3 HN HIS 3 13.964 35.112 50.457 16 HA HIS 3 HA HIS 3 14.542 34.652 47.602 17 HB2 HIS 3 2HB HIS 3 14.825 32.951 49.935 18 HB3 HIS 3 1HB HIS 3 13.797 32.203 48.718 19 HD1 HIS 3 1HD HIS 3 17.292 33.597 49.138 20 HD2 HIS 3 2HD HIS 3 15.117 31.155 46.568 21 HE1 HIS 3 1HE HIS 3 18.976 32.594 47.567 22 HE2 HIS 3 2HE HIS 3 17.666 30.948 46.179 23 H HIS 4 HN HIS 4 12.946 34.088 46.242 24 HA HIS 4 HA HIS 4 10.280 33.475 47.270 25 HB2 HIS 4 2HB HIS 4 10.989 35.888 45.660 26 HB3 HIS 4 1HB HIS 4 9.479 35.065 45.285 27 HD1 HIS 4 1HD HIS 4 7.554 35.346 46.897 28 HD2 HIS 4 2HD HIS 4 11.083 37.076 48.252 29 HE1 HIS 4 1HE HIS 4 6.906 36.726 48.898 30 HE2 HIS 4 2HE HIS 4 9.090 37.578 49.826 31 H HIS 5 HN HIS 5 9.647 31.681 46.293 32 HA HIS 5 HA HIS 5 11.037 30.742 43.940 33 HB2 HIS 5 2HB HIS 5 10.448 29.234 45.826 34 HB3 HIS 5 1HB HIS 5 8.744 29.481 45.463 35 HD1 HIS 5 1HD HIS 5 11.864 28.132 43.748 36 HD2 HIS 5 2HD HIS 5 7.728 27.673 43.711 37 HE1 HIS 5 1HE HIS 5 11.407 26.196 42.202 38 HE2 HIS 5 2HE HIS 5 8.917 25.829 42.336 39 H HIS 6 HN HIS 6 10.372 30.904 41.893 40 HA HIS 6 HA HIS 6 7.609 31.842 41.416 41 HB2 HIS 6 2HB HIS 6 10.118 32.358 39.801 42 HB3 HIS 6 1HB HIS 6 8.500 32.835 39.302 43 HD1 HIS 6 1HD HIS 6 7.397 34.818 40.590 44 HD2 HIS 6 2HD HIS 6 11.308 33.960 41.718 45 HE1 HIS 6 1HE HIS 6 8.171 36.805 41.927 46 HE2 HIS 6 2HE HIS 6 10.621 36.371 42.335 47 H HIS 7 HN HIS 7 6.358 30.348 40.566 48 HA HIS 7 HA HIS 7 7.302 28.712 38.365 49 HB2 HIS 7 2HB HIS 7 7.851 27.396 40.410 50 HB3 HIS 7 1HB HIS 7 6.152 27.437 40.861 51 HD1 HIS 7 1HD HIS 7 8.330 26.164 38.021 52 HD2 HIS 7 2HD HIS 7 4.714 25.343 39.904 53 HE1 HIS 7 1HE HIS 7 7.503 24.019 36.998 54 HE2 HIS 7 2HE HIS 7 5.420 23.440 38.299 55 H HIS 8 HN HIS 8 5.812 29.446 36.958 56 HA HIS 8 HA HIS 8 3.090 28.612 37.280 57 HB2 HIS 8 2HB HIS 8 3.148 30.793 38.542 58 HB3 HIS 8 1HB HIS 8 3.582 31.591 37.036 59 HD1 HIS 8 1HD HIS 8 1.697 32.051 35.358 60 HD2 HIS 8 2HD HIS 8 0.496 29.826 38.667 61 HE1 HIS 8 1HE HIS 8 -0.819 31.988 35.265 62 HE2 HIS 8 2HE HIS 8 -1.526 30.758 37.351 63 H SER 9 HN SER 9 2.288 28.129 35.301 64 HA SER 9 HA SER 9 3.632 29.321 32.963 65 HB2 SER 9 2HB SER 9 2.383 26.570 33.159 66 HB3 SER 9 1HB SER 9 3.259 27.230 31.777 67 HG SER 9 HG SER 9 4.694 27.370 34.098 68 H HIS 10 HN HIS 10 2.314 29.652 31.070 69 HA HIS 10 HA HIS 10 -0.568 29.867 31.687 70 HB2 HIS 10 2HB HIS 10 -0.740 31.801 30.314 71 HB3 HIS 10 1HB HIS 10 0.675 32.059 31.324 72 HD1 HIS 10 1HD HIS 10 -0.439 32.048 27.852 73 HD2 HIS 10 2HD HIS 10 3.190 31.645 29.857 74 HE1 HIS 10 1HE HIS 10 1.346 32.425 26.118 75 HE2 HIS 10 2HE HIS 10 3.526 32.327 27.381 76 H MET 11 HN MET 11 -2.041 29.241 30.075 77 HA MET 11 HA MET 11 -0.840 27.581 27.956 78 HB2 MET 11 2HB MET 11 -3.263 27.068 29.672 79 HB3 MET 11 1HB MET 11 -3.003 26.228 28.153 80 HG2 MET 11 2HG MET 11 -2.243 24.809 29.877 81 HG3 MET 11 1HG MET 11 -0.820 25.434 29.052 82 HE1 MET 11 3HE MET 11 0.708 24.624 31.040 83 HE2 MET 11 1HE MET 11 -0.691 24.001 31.919 84 HE3 MET 11 2HE MET 11 0.457 25.068 32.726 85 H ASP 12 HN ASP 12 -1.124 28.466 26.060 86 HA ASP 12 HA ASP 12 -3.714 29.746 25.448 87 HB2 ASP 12 2HB ASP 12 -1.921 31.385 25.340 88 HB3 ASP 12 1HB ASP 12 -0.979 30.334 24.287 89 H TYR 13 HN TYR 13 -4.892 28.267 24.439 90 HA TYR 13 HA TYR 13 -3.571 26.507 22.477 91 HB2 TYR 13 2HB TYR 13 -4.413 25.360 24.508 92 HB3 TYR 13 1HB TYR 13 -6.031 25.948 24.149 93 HD1 TYR 13 1HD TYR 13 -3.335 23.702 22.976 94 HD2 TYR 13 2HD TYR 13 -7.414 24.836 22.580 95 HE1 TYR 13 1HE TYR 13 -3.760 21.687 21.630 96 HE2 TYR 13 2HE TYR 13 -7.851 22.825 21.238 97 HH TYR 13 HH TYR 13 -6.466 21.257 19.760 98 HA PRO 14 HA PRO 14 -6.600 28.542 19.824 99 HB2 PRO 14 2HB PRO 14 -4.915 28.677 17.668 100 HB3 PRO 14 1HB PRO 14 -4.977 29.885 18.952 101 HG2 PRO 14 2HG PRO 14 -2.862 28.022 18.331 102 HG3 PRO 14 1HG PRO 14 -2.868 29.323 19.529 103 HD2 PRO 14 2HD PRO 14 -3.307 26.442 19.899 104 HD3 PRO 14 1HD PRO 14 -2.892 27.680 21.102 105 H SER 15 HN SER 15 -8.104 27.085 19.233 106 HA SER 15 HA SER 15 -7.352 25.167 17.139 107 HB2 SER 15 2HB SER 15 -9.109 23.616 18.172 108 HB3 SER 15 1HB SER 15 -7.576 23.768 19.031 109 HG SER 15 HG SER 15 -9.209 25.671 19.924 110 H PHE 16 HN PHE 16 -8.190 26.258 15.455 111 HA PHE 16 HA PHE 16 -10.925 27.296 15.666 112 HB2 PHE 16 2HB PHE 16 -8.711 27.803 13.679 113 HB3 PHE 16 1HB PHE 16 -10.353 28.398 13.456 114 HD1 PHE 16 1HD PHE 16 -7.371 28.594 15.633 115 HD2 PHE 16 2HD PHE 16 -11.130 30.306 14.599 116 HE1 PHE 16 1HE PHE 16 -6.849 30.568 17.005 117 HE2 PHE 16 2HE PHE 16 -10.613 32.281 15.971 118 HZ PHE 16 HZ PHE 16 -8.469 32.415 17.176 119 H ASP 17 HN ASP 17 -12.203 27.133 13.554 120 HA ASP 17 HA ASP 17 -11.857 24.539 12.255 121 HB2 ASP 17 2HB ASP 17 -13.286 24.095 14.192 122 HB3 ASP 17 1HB ASP 17 -14.379 25.384 13.699 123 H LYS 18 HN LYS 18 -12.305 24.634 10.155 124 HA LYS 18 HA LYS 18 -13.352 27.114 9.047 125 HB2 LYS 18 2HB LYS 18 -12.675 26.167 6.881 126 HB3 LYS 18 1HB LYS 18 -11.352 26.069 8.040 127 HG2 LYS 18 2HG LYS 18 -11.754 23.734 8.397 128 HG3 LYS 18 1HG LYS 18 -13.223 23.793 7.425 129 HD2 LYS 18 2HD LYS 18 -11.842 24.382 5.455 130 HD3 LYS 18 1HD LYS 18 -10.395 24.195 6.452 131 HE2 LYS 18 2HE LYS 18 -10.972 21.867 6.875 132 HE3 LYS 18 1HE LYS 18 -12.451 22.047 5.935 133 HZ1 LYS 18 3HZ LYS 18 -11.101 22.479 3.973 134 HZ2 LYS 18 1HZ LYS 18 -10.726 20.974 4.653 135 HZ3 LYS 18 2HZ LYS 18 -9.679 22.285 4.881 136 H PHE 19 HN PHE 19 -14.624 26.347 6.776 137 HA PHE 19 HA PHE 19 -16.427 24.164 7.421 138 HB2 PHE 19 2HB PHE 19 -17.606 26.362 7.904 139 HB3 PHE 19 1HB PHE 19 -17.457 26.739 6.194 140 HD1 PHE 19 1HD PHE 19 -18.546 25.119 4.531 141 HD2 PHE 19 2HD PHE 19 -19.396 25.129 8.699 142 HE1 PHE 19 1HE PHE 19 -20.664 23.949 4.097 143 HE2 PHE 19 2HE PHE 19 -21.516 23.957 8.271 144 HZ PHE 19 HZ PHE 19 -22.154 23.365 5.969 145 H LEU 20 HN LEU 20 -15.128 25.362 3.727 146 HA LEU 20 HA LEU 20 -16.840 27.018 5.421 147 HB2 LEU 20 2HB LEU 20 -15.645 28.948 4.357 148 HB3 LEU 20 1HB LEU 20 -14.675 27.986 5.444 149 HG LEU 20 HG LEU 20 -13.770 26.832 3.346 150 HD11 LEU 20 1HD1 LEU 20 -13.856 28.107 1.285 151 HD12 LEU 20 2HD1 LEU 20 -14.927 29.290 2.039 152 HD13 LEU 20 3HD1 LEU 20 -15.480 27.634 1.783 153 HD21 LEU 20 3HD2 LEU 20 -12.472 28.376 4.695 154 HD22 LEU 20 1HD2 LEU 20 -13.187 29.746 3.843 155 HD23 LEU 20 2HD2 LEU 20 -12.139 28.621 2.980 156 H GLY 21 HN GLY 21 -16.770 25.190 2.839 157 HA2 GLY 21 2HA GLY 21 -19.179 26.203 1.716 158 HA3 GLY 21 1HA GLY 21 -17.802 26.436 0.634 159 H THR 22 HN THR 22 -20.151 24.588 0.382 160 HA THR 22 HA THR 22 -19.011 21.994 0.977 161 HB THR 22 HB THR 22 -21.382 22.287 1.409 162 HG1 THR 22 1HG THR 22 -21.208 20.215 0.975 163 HG21 THR 22 3HG2 THR 22 -21.640 22.724 -1.565 164 HG22 THR 22 1HG2 THR 22 -21.957 23.909 -0.298 165 HG23 THR 22 2HG2 THR 22 -22.988 22.487 -0.454 166 H GLU 23 HN GLU 23 -18.027 20.711 -0.337 167 HA GLU 23 HA GLU 23 -18.519 20.382 -3.075 168 HB2 GLU 23 2HB GLU 23 -17.350 22.517 -3.359 169 HB3 GLU 23 1HB GLU 23 -15.989 21.923 -2.416 170 HG2 GLU 23 2HG GLU 23 -15.482 20.280 -4.108 171 HG3 GLU 23 1HG GLU 23 -16.906 20.752 -5.033 172 H ASN 24 HN ASN 24 -18.443 18.235 -2.778 173 HA ASN 24 HA ASN 24 -16.366 17.092 -1.091 174 HB2 ASN 24 2HB ASN 24 -18.820 15.898 -2.388 175 HB3 ASN 24 1HB ASN 24 -17.668 14.959 -1.445 176 HD21 ASN 24 1HD2 ASN 24 -19.223 14.406 0.077 177 HD22 ASN 24 2HD2 ASN 24 -19.842 15.545 1.231 178 H ALA 25 HN ALA 25 -16.098 18.154 -3.967 179 HA ALA 25 HA ALA 25 -15.375 16.044 -5.662 180 HB1 ALA 25 1HB ALA 25 -15.676 18.342 -6.445 181 HB2 ALA 25 2HB ALA 25 -14.099 17.706 -6.912 182 HB3 ALA 25 3HB ALA 25 -14.229 18.833 -5.564 183 H GLU 26 HN GLU 26 -13.757 17.470 -2.947 184 HA GLU 26 HA GLU 26 -11.113 16.766 -3.436 185 HB2 GLU 26 2HB GLU 26 -12.607 16.862 -0.815 186 HB3 GLU 26 1HB GLU 26 -10.861 16.721 -0.951 187 HG2 GLU 26 2HG GLU 26 -10.798 18.871 -2.131 188 HG3 GLU 26 1HG GLU 26 -12.540 19.018 -1.927 189 H LEU 27 HN LEU 27 -13.780 14.834 -2.208 190 HA LEU 27 HA LEU 27 -12.228 12.587 -1.463 191 HB2 LEU 27 2HB LEU 27 -14.425 12.897 -0.531 192 HB3 LEU 27 1HB LEU 27 -15.154 12.895 -2.127 193 HG LEU 27 HG LEU 27 -14.417 10.534 -2.387 194 HD11 LEU 27 1HD1 LEU 27 -13.775 10.762 0.547 195 HD12 LEU 27 2HD1 LEU 27 -12.606 10.540 -0.753 196 HD13 LEU 27 3HD1 LEU 27 -13.781 9.274 -0.397 197 HD21 LEU 27 3HD2 LEU 27 -16.698 11.075 -1.763 198 HD22 LEU 27 1HD2 LEU 27 -16.236 11.125 -0.062 199 HD23 LEU 27 2HD2 LEU 27 -16.169 9.604 -0.951 200 H VAL 28 HN VAL 28 -14.077 13.434 -4.360 201 HA VAL 28 HA VAL 28 -13.624 11.020 -5.759 202 HB VAL 28 HB VAL 28 -14.079 13.732 -7.002 203 HG11 VAL 28 1HG1 VAL 28 -13.442 12.000 -8.574 204 HG12 VAL 28 2HG1 VAL 28 -15.130 12.458 -8.799 205 HG13 VAL 28 3HG1 VAL 28 -14.726 10.953 -7.970 206 HG21 VAL 28 3HG2 VAL 28 -16.477 13.205 -6.907 207 HG22 VAL 28 1HG2 VAL 28 -15.761 13.382 -5.307 208 HG23 VAL 28 2HG2 VAL 28 -16.109 11.774 -5.941 209 H TYR 29 HN TYR 29 -11.827 14.024 -5.498 210 HA TYR 29 HA TYR 29 -9.841 13.448 -7.422 211 HB2 TYR 29 2HB TYR 29 -10.031 15.698 -6.628 212 HB3 TYR 29 1HB TYR 29 -9.838 15.197 -4.951 213 HD1 TYR 29 2HD TYR 29 -7.989 15.076 -8.196 214 HD2 TYR 29 1HD TYR 29 -7.765 15.478 -3.965 215 HE1 TYR 29 2HE TYR 29 -5.562 15.436 -8.362 216 HE2 TYR 29 1HE TYR 29 -5.340 15.837 -4.122 217 HH TYR 29 HH TYR 29 -3.742 16.352 -7.136 218 H VAL 30 HN VAL 30 -10.099 12.742 -3.961 219 HA VAL 30 HA VAL 30 -7.521 11.666 -3.646 220 HB VAL 30 HB VAL 30 -10.055 11.171 -2.074 221 HG11 VAL 30 1HG1 VAL 30 -8.586 9.259 -1.774 222 HG12 VAL 30 2HG1 VAL 30 -8.613 10.246 -0.313 223 HG13 VAL 30 3HG1 VAL 30 -7.234 10.333 -1.408 224 HG21 VAL 30 3HG2 VAL 30 -9.005 12.653 -0.429 225 HG22 VAL 30 1HG2 VAL 30 -9.220 13.456 -1.985 226 HG23 VAL 30 2HG2 VAL 30 -7.629 12.868 -1.511 227 H LEU 31 HN LEU 31 -10.655 10.069 -4.296 228 HA LEU 31 HA LEU 31 -9.452 7.475 -4.287 229 HB2 LEU 31 2HB LEU 31 -11.692 6.683 -5.029 230 HB3 LEU 31 1HB LEU 31 -11.706 7.622 -3.552 231 HG LEU 31 HG LEU 31 -12.336 9.610 -5.115 232 HD11 LEU 31 1HD1 LEU 31 -13.635 8.964 -7.066 233 HD12 LEU 31 2HD1 LEU 31 -13.217 7.270 -6.798 234 HD13 LEU 31 3HD1 LEU 31 -11.961 8.432 -7.227 235 HD21 LEU 31 3HD2 LEU 31 -14.695 9.078 -4.813 236 HD22 LEU 31 1HD2 LEU 31 -13.762 8.654 -3.379 237 HD23 LEU 31 2HD2 LEU 31 -14.281 7.393 -4.496 238 H ARG 32 HN ARG 32 -10.079 5.964 -6.232 239 HA ARG 32 HA ARG 32 -9.722 7.158 -8.820 240 HB2 ARG 32 2HB ARG 32 -7.400 7.164 -7.814 241 HB3 ARG 32 1HB ARG 32 -7.480 5.409 -7.792 242 HG2 ARG 32 2HG ARG 32 -7.761 5.415 -10.237 243 HG3 ARG 32 1HG ARG 32 -7.601 7.173 -10.230 244 HD2 ARG 32 2HD ARG 32 -5.372 6.883 -9.135 245 HD3 ARG 32 1HD ARG 32 -5.538 5.146 -9.392 246 HE ARG 32 HE ARG 32 -5.798 6.840 -11.748 247 HH11 ARG 32 1HH1 ARG 32 -3.707 4.806 -9.810 248 HH12 ARG 32 2HH1 ARG 32 -2.556 4.542 -11.085 249 HH21 ARG 32 1HH2 ARG 32 -4.296 6.495 -13.434 250 HH22 ARG 32 2HH2 ARG 32 -2.873 5.536 -13.140 251 H HIS 33 HN HIS 33 -8.546 4.017 -7.668 252 HA HIS 33 HA HIS 33 -10.815 2.468 -8.175 253 HB2 HIS 33 2HB HIS 33 -10.458 3.241 -10.526 254 HB3 HIS 33 1HB HIS 33 -8.868 2.491 -10.502 255 HD1 HIS 33 1HD HIS 33 -12.535 1.623 -10.537 256 HD2 HIS 33 2HD HIS 33 -8.842 -0.245 -10.961 257 HE1 HIS 33 1HE HIS 33 -13.033 -0.685 -11.413 258 HE2 HIS 33 2HE HIS 33 -10.790 -1.828 -11.586 259 H LYS 34 HN LYS 34 -10.447 0.390 -7.410 260 HA LYS 34 HA LYS 34 -7.721 -0.115 -6.478 261 HB2 LYS 34 2HB LYS 34 -8.659 -1.778 -5.013 262 HB3 LYS 34 1HB LYS 34 -9.608 -0.309 -4.885 263 HG2 LYS 34 2HG LYS 34 -11.306 -1.792 -4.966 264 HG3 LYS 34 1HG LYS 34 -11.086 -1.590 -6.705 265 HD2 LYS 34 2HD LYS 34 -9.751 -3.592 -6.816 266 HD3 LYS 34 1HD LYS 34 -9.779 -3.756 -5.059 267 HE2 LYS 34 2HE LYS 34 -12.195 -3.895 -6.864 268 HE3 LYS 34 1HE LYS 34 -11.352 -5.287 -6.188 269 HZ1 LYS 34 3HZ LYS 34 -11.884 -4.386 -3.950 270 HZ2 LYS 34 1HZ LYS 34 -13.253 -4.822 -4.846 271 HZ3 LYS 34 2HZ LYS 34 -12.831 -3.190 -4.687 272 H HIS 35 HN HIS 35 -6.572 -2.024 -6.912 273 HA HIS 35 HA HIS 35 -7.520 -3.518 -9.268 274 HB2 HIS 35 2HB HIS 35 -4.752 -2.418 -8.739 275 HB3 HIS 35 1HB HIS 35 -5.087 -3.631 -9.965 276 HD1 HIS 35 1HD HIS 35 -5.592 -2.759 -12.227 277 HD2 HIS 35 2HD HIS 35 -6.230 0.102 -9.268 278 HE1 HIS 35 1HE HIS 35 -6.151 -0.629 -13.446 279 HE2 HIS 35 2HE HIS 35 -6.438 1.112 -11.649 280 H GLY 36 HN GLY 36 -7.266 -5.690 -9.190 281 HA2 GLY 36 2HA GLY 36 -6.706 -7.776 -8.434 282 HA3 GLY 36 1HA GLY 36 -5.172 -7.060 -7.967 283 H GLN 37 HN GLN 37 -4.811 -7.943 -6.021 284 HA GLN 37 HA GLN 37 -6.710 -7.244 -3.923 285 HB2 GLN 37 2HB GLN 37 -5.949 -9.515 -2.848 286 HB3 GLN 37 1HB GLN 37 -7.287 -9.455 -3.981 287 HG2 GLN 37 2HG GLN 37 -5.810 -10.191 -5.775 288 HG3 GLN 37 1HG GLN 37 -4.456 -10.243 -4.654 289 HE21 GLN 37 1HE2 GLN 37 -6.238 -11.238 -2.492 290 HE22 GLN 37 2HE2 GLN 37 -6.488 -12.910 -2.851 291 H PHE 38 HN PHE 38 -3.747 -9.150 -3.602 292 HA PHE 38 HA PHE 38 -2.680 -7.386 -1.639 293 HB2 PHE 38 2HB PHE 38 -1.382 -9.685 -3.125 294 HB3 PHE 38 1HB PHE 38 -0.676 -8.847 -1.752 295 HD1 PHE 38 2HD PHE 38 -1.574 -9.150 0.488 296 HD2 PHE 38 1HD PHE 38 -3.133 -11.297 -2.839 297 HE1 PHE 38 2HE PHE 38 -2.650 -10.742 2.023 298 HE2 PHE 38 1HE PHE 38 -4.210 -12.893 -1.308 299 HZ PHE 38 HZ PHE 38 -3.970 -12.615 1.128 300 H ILE 39 HN ILE 39 -2.196 -5.377 -2.404 301 HA ILE 39 HA ILE 39 -0.438 -5.276 -4.765 302 HB ILE 39 HB ILE 39 -2.241 -3.095 -3.694 303 HG12 ILE 39 2HG1 ILE 39 -3.510 -4.883 -4.765 304 HG13 ILE 39 1HG1 ILE 39 -3.500 -3.460 -5.798 305 HG21 ILE 39 1HG2 ILE 39 -0.488 -3.158 -6.147 306 HG22 ILE 39 2HG2 ILE 39 -0.213 -2.189 -4.700 307 HG23 ILE 39 3HG2 ILE 39 -1.615 -1.869 -5.722 308 HD11 ILE 39 3HD1 ILE 39 -1.725 -4.494 -7.158 309 HD12 ILE 39 1HD1 ILE 39 -3.204 -5.455 -7.117 310 HD13 ILE 39 2HD1 ILE 39 -1.815 -5.930 -6.138 311 H TYR 40 HN TYR 40 1.544 -4.775 -4.457 312 HA TYR 40 HA TYR 40 2.361 -3.183 -2.119 313 HB2 TYR 40 2HB TYR 40 2.896 -5.622 -1.930 314 HB3 TYR 40 1HB TYR 40 3.813 -5.507 -3.421 315 HD1 TYR 40 2HD TYR 40 3.754 -4.721 0.149 316 HD2 TYR 40 1HD TYR 40 6.020 -4.480 -3.446 317 HE1 TYR 40 2HE TYR 40 5.773 -4.249 1.462 318 HE2 TYR 40 1HE TYR 40 8.054 -4.023 -2.137 319 HH TYR 40 HH TYR 40 8.180 -4.449 1.243 320 H VAL 41 HN VAL 41 3.576 -1.400 -2.695 321 HA VAL 41 HA VAL 41 4.838 -1.443 -5.346 322 HB VAL 41 HB VAL 41 4.320 1.024 -5.539 323 HG11 VAL 41 1HG1 VAL 41 2.010 -0.918 -5.602 324 HG12 VAL 41 2HG1 VAL 41 3.183 -0.648 -6.892 325 HG13 VAL 41 3HG1 VAL 41 2.067 0.638 -6.434 326 HG21 VAL 41 3HG2 VAL 41 2.381 1.874 -4.331 327 HG22 VAL 41 1HG2 VAL 41 3.672 1.430 -3.217 328 HG23 VAL 41 2HG2 VAL 41 2.278 0.368 -3.418 329 H TRP 42 HN TRP 42 6.926 -1.216 -5.162 330 HA TRP 42 HA TRP 42 8.050 -0.078 -2.754 331 HB2 TRP 42 2HB TRP 42 10.261 -0.714 -3.930 332 HB3 TRP 42 1HB TRP 42 9.218 -1.997 -3.342 333 HD1 TRP 42 1HD TRP 42 9.084 -0.148 -6.767 334 HE1 TRP 42 1HE TRP 42 9.271 -1.896 -8.630 335 HE3 TRP 42 3HE TRP 42 9.658 -4.326 -3.883 336 HZ2 TRP 42 2HZ TRP 42 9.607 -4.689 -8.854 337 HZ3 TRP 42 3HZ TRP 42 9.903 -6.501 -5.004 338 HH2 TRP 42 2HH TRP 42 9.877 -6.677 -7.438 339 H GLY 43 HN GLY 43 7.721 2.082 -2.786 340 HA2 GLY 43 2HA GLY 43 8.194 3.635 -5.180 341 HA3 GLY 43 1HA GLY 43 7.652 4.243 -3.624 342 H GLU 44 HN GLU 44 10.566 2.558 -4.789 343 HA GLU 44 HA GLU 44 12.283 4.077 -3.093 344 HB2 GLU 44 2HB GLU 44 13.024 2.385 -5.488 345 HB3 GLU 44 1HB GLU 44 14.114 2.938 -4.224 346 HG2 GLU 44 2HG GLU 44 12.823 1.624 -2.587 347 HG3 GLU 44 1HG GLU 44 11.834 1.006 -3.909 348 H GLU 45 HN GLU 45 12.020 6.219 -3.525 349 HA GLU 45 HA GLU 45 13.530 7.321 -5.669 350 HB2 GLU 45 2HB GLU 45 11.270 6.677 -6.729 351 HB3 GLU 45 1HB GLU 45 10.580 7.957 -5.747 352 HG2 GLU 45 2HG GLU 45 12.760 8.356 -7.785 353 HG3 GLU 45 1HG GLU 45 11.045 8.628 -8.075 354 H GLY 46 HN GLY 46 10.719 8.181 -3.642 355 HA2 GLY 46 2HA GLY 46 11.524 9.491 -1.569 356 HA3 GLY 46 1HA GLY 46 12.182 10.582 -2.778 357 H ALA 47 HN ALA 47 9.922 10.174 -4.599 358 HA ALA 47 HA ALA 47 8.268 12.272 -3.978 359 HB1 ALA 47 1HB ALA 47 8.364 11.218 -6.182 360 HB2 ALA 47 2HB ALA 47 6.701 11.381 -5.617 361 HB3 ALA 47 3HB ALA 47 7.506 9.813 -5.549 362 H GLY 48 HN GLY 48 7.483 8.826 -3.449 363 HA2 GLY 48 2HA GLY 48 6.112 7.796 -1.924 364 HA3 GLY 48 1HA GLY 48 6.583 9.093 -0.842 365 H LYS 49 HN LYS 49 4.497 8.802 -3.718 366 HA LYS 49 HA LYS 49 2.568 10.581 -2.492 367 HB2 LYS 49 2HB LYS 49 3.149 9.644 -5.201 368 HB3 LYS 49 1HB LYS 49 1.432 9.685 -4.843 369 HG2 LYS 49 2HG LYS 49 2.330 11.752 -5.906 370 HG3 LYS 49 1HG LYS 49 1.485 12.010 -4.381 371 HD2 LYS 49 2HD LYS 49 4.438 11.633 -4.300 372 HD3 LYS 49 1HD LYS 49 3.817 13.165 -4.918 373 HE2 LYS 49 2HE LYS 49 2.541 13.476 -2.852 374 HE3 LYS 49 1HE LYS 49 3.149 11.939 -2.239 375 HZ1 LYS 49 3HZ LYS 49 4.341 13.904 -1.383 376 HZ2 LYS 49 1HZ LYS 49 4.870 14.250 -2.958 377 HZ3 LYS 49 2HZ LYS 49 5.355 12.814 -2.195 378 H SER 50 HN SER 50 1.465 9.611 -0.900 379 HA SER 50 HA SER 50 0.516 6.883 -1.189 380 HB2 SER 50 2HB SER 50 0.109 8.854 1.077 381 HB3 SER 50 1HB SER 50 -0.174 7.112 1.136 382 HG SER 50 HG SER 50 1.827 7.307 1.953 383 H HIS 51 HN HIS 51 -0.480 9.342 -2.706 384 HA HIS 51 HA HIS 51 -3.158 9.852 -2.056 385 HB2 HIS 51 2HB HIS 51 -1.841 11.228 -3.598 386 HB3 HIS 51 1HB HIS 51 -1.751 9.895 -4.738 387 HD1 HIS 51 1HD HIS 51 -2.821 11.408 -6.539 388 HD2 HIS 51 2HD HIS 51 -5.256 10.722 -3.241 389 HE1 HIS 51 1HE HIS 51 -5.126 12.108 -7.246 390 HE2 HIS 51 2HE HIS 51 -6.608 11.525 -5.302 391 H LEU 52 HN LEU 52 -1.629 7.278 -3.892 392 HA LEU 52 HA LEU 52 -4.066 6.165 -4.891 393 HB2 LEU 52 2HB LEU 52 -1.352 4.880 -4.563 394 HB3 LEU 52 1HB LEU 52 -2.682 4.230 -5.500 395 HG LEU 52 HG LEU 52 -1.216 6.802 -6.096 396 HD11 LEU 52 1HD1 LEU 52 -0.336 5.599 -8.031 397 HD12 LEU 52 2HD1 LEU 52 -1.144 4.129 -7.486 398 HD13 LEU 52 3HD1 LEU 52 0.154 4.833 -6.519 399 HD21 LEU 52 3HD2 LEU 52 -3.560 6.891 -6.776 400 HD22 LEU 52 1HD2 LEU 52 -3.371 5.367 -7.643 401 HD23 LEU 52 2HD2 LEU 52 -2.493 6.799 -8.178 402 H LEU 53 HN LEU 53 -2.156 5.805 -2.015 403 HA LEU 53 HA LEU 53 -3.230 3.387 -1.035 404 HB2 LEU 53 2HB LEU 53 -1.166 4.546 -0.213 405 HB3 LEU 53 1HB LEU 53 -2.192 5.749 0.540 406 HG LEU 53 HG LEU 53 -3.232 3.740 1.805 407 HD11 LEU 53 1HD1 LEU 53 -2.162 2.004 0.448 408 HD12 LEU 53 2HD1 LEU 53 -1.715 1.873 2.150 409 HD13 LEU 53 3HD1 LEU 53 -0.580 2.565 0.990 410 HD21 LEU 53 3HD2 LEU 53 -1.916 5.498 2.858 411 HD22 LEU 53 1HD2 LEU 53 -0.428 4.679 2.384 412 HD23 LEU 53 2HD2 LEU 53 -1.522 3.920 3.542 413 H GLN 54 HN GLN 54 -4.130 6.766 -0.627 414 HA GLN 54 HA GLN 54 -6.269 6.301 1.195 415 HB2 GLN 54 2HB GLN 54 -5.703 8.668 -0.603 416 HB3 GLN 54 1HB GLN 54 -6.853 8.652 0.728 417 HG2 GLN 54 2HG GLN 54 -5.117 8.411 2.332 418 HG3 GLN 54 1HG GLN 54 -3.916 8.123 1.073 419 HE21 GLN 54 1HE2 GLN 54 -4.014 10.160 3.180 420 HE22 GLN 54 2HE2 GLN 54 -3.923 11.682 2.370 421 H ALA 55 HN ALA 55 -5.998 6.658 -2.281 422 HA ALA 55 HA ALA 55 -8.699 6.794 -2.977 423 HB1 ALA 55 1HB ALA 55 -7.986 5.961 -5.175 424 HB2 ALA 55 2HB ALA 55 -6.416 5.534 -4.496 425 HB3 ALA 55 3HB ALA 55 -6.916 7.223 -4.569 426 H TRP 56 HN TRP 56 -6.576 4.036 -2.516 427 HA TRP 56 HA TRP 56 -8.268 1.989 -3.365 428 HB2 TRP 56 2HB TRP 56 -5.826 1.840 -2.959 429 HB3 TRP 56 1HB TRP 56 -6.127 1.931 -1.232 430 HD1 TRP 56 1HD TRP 56 -6.767 -0.443 -4.212 431 HE1 TRP 56 1HE TRP 56 -6.856 -2.846 -3.289 432 HE3 TRP 56 3HE TRP 56 -6.460 0.604 0.775 433 HZ2 TRP 56 2HZ TRP 56 -6.806 -4.115 -0.778 434 HZ3 TRP 56 3HZ TRP 56 -6.482 -1.266 2.374 435 HH2 TRP 56 2HH TRP 56 -6.653 -3.576 1.609 436 H VAL 57 HN VAL 57 -7.924 3.516 -0.205 437 HA VAL 57 HA VAL 57 -9.570 1.768 1.262 438 HB VAL 57 HB VAL 57 -9.089 4.718 1.734 439 HG11 VAL 57 1HG1 VAL 57 -9.626 4.229 4.071 440 HG12 VAL 57 2HG1 VAL 57 -10.012 2.566 3.633 441 HG13 VAL 57 3HG1 VAL 57 -10.992 3.892 3.009 442 HG21 VAL 57 3HG2 VAL 57 -6.997 3.500 1.612 443 HG22 VAL 57 1HG2 VAL 57 -7.600 2.309 2.766 444 HG23 VAL 57 2HG2 VAL 57 -7.330 3.975 3.277 445 H ALA 58 HN ALA 58 -10.296 4.785 -0.466 446 HA ALA 58 HA ALA 58 -13.014 4.919 0.309 447 HB1 ALA 58 1HB ALA 58 -13.245 6.585 -1.463 448 HB2 ALA 58 2HB ALA 58 -11.673 6.123 -2.116 449 HB3 ALA 58 3HB ALA 58 -11.784 6.862 -0.518 450 H GLN 59 HN GLN 59 -11.383 3.353 -2.390 451 HA GLN 59 HA GLN 59 -13.672 2.725 -3.909 452 HB2 GLN 59 2HB GLN 59 -11.127 1.105 -3.701 453 HB3 GLN 59 1HB GLN 59 -12.312 1.028 -4.997 454 HG2 GLN 59 2HG GLN 59 -10.537 3.357 -4.317 455 HG3 GLN 59 1HG GLN 59 -10.383 2.279 -5.702 456 HE21 GLN 59 1HE2 GLN 59 -13.262 2.189 -6.165 457 HE22 GLN 59 2HE2 GLN 59 -13.686 3.717 -6.859 458 H ALA 60 HN ALA 60 -12.059 1.083 -1.254 459 HA ALA 60 HA ALA 60 -13.668 -1.257 -1.280 460 HB1 ALA 60 1HB ALA 60 -12.149 -0.011 1.009 461 HB2 ALA 60 2HB ALA 60 -11.488 -1.146 -0.169 462 HB3 ALA 60 3HB ALA 60 -12.756 -1.667 0.940 463 H LEU 61 HN LEU 61 -13.859 1.823 0.401 464 HA LEU 61 HA LEU 61 -15.948 1.242 2.155 465 HB2 LEU 61 2HB LEU 61 -15.121 3.840 0.874 466 HB3 LEU 61 1HB LEU 61 -16.316 3.731 2.147 467 HG LEU 61 HG LEU 61 -13.413 2.943 2.374 468 HD11 LEU 61 1HD1 LEU 61 -13.720 5.346 2.277 469 HD12 LEU 61 2HD1 LEU 61 -13.270 4.845 3.907 470 HD13 LEU 61 3HD1 LEU 61 -14.943 5.260 3.543 471 HD21 LEU 61 3HD2 LEU 61 -13.896 2.642 4.762 472 HD22 LEU 61 1HD2 LEU 61 -14.814 1.516 3.760 473 HD23 LEU 61 2HD2 LEU 61 -15.607 2.931 4.447 474 H GLU 62 HN GLU 62 -16.015 2.335 -1.203 475 HA GLU 62 HA GLU 62 -18.807 2.817 -1.300 476 HB2 GLU 62 2HB GLU 62 -16.857 2.216 -3.517 477 HB3 GLU 62 1HB GLU 62 -18.522 2.722 -3.770 478 HG2 GLU 62 2HG GLU 62 -17.983 4.790 -2.463 479 HG3 GLU 62 1HG GLU 62 -16.294 4.292 -2.515 480 H ALA 63 HN ALA 63 -16.869 -0.041 -1.630 481 HA ALA 63 HA ALA 63 -18.884 -1.619 -2.925 482 HB1 ALA 63 1HB ALA 63 -16.372 -2.456 -1.484 483 HB2 ALA 63 2HB ALA 63 -16.536 -2.165 -3.215 484 HB3 ALA 63 3HB ALA 63 -17.391 -3.513 -2.460 485 H GLY 64 HN GLY 64 -18.643 -0.405 0.149 486 HA2 GLY 64 2HA GLY 64 -19.915 -0.833 2.034 487 HA3 GLY 64 1HA GLY 64 -20.664 -2.172 1.171 488 H LYS 65 HN LYS 65 -17.223 -1.909 1.409 489 HA LYS 65 HA LYS 65 -17.194 -4.183 3.269 490 HB2 LYS 65 2HB LYS 65 -15.177 -3.507 1.115 491 HB3 LYS 65 1HB LYS 65 -15.122 -4.899 2.183 492 HG2 LYS 65 2HG LYS 65 -17.214 -4.353 0.083 493 HG3 LYS 65 1HG LYS 65 -15.917 -5.549 -0.010 494 HD2 LYS 65 2HD LYS 65 -16.859 -6.722 1.917 495 HD3 LYS 65 1HD LYS 65 -18.145 -5.520 2.027 496 HE2 LYS 65 2HE LYS 65 -17.651 -7.306 -0.351 497 HE3 LYS 65 1HE LYS 65 -18.836 -7.619 0.911 498 HZ1 LYS 65 3HZ LYS 65 -18.828 -5.393 -1.049 499 HZ2 LYS 65 1HZ LYS 65 -19.849 -5.425 0.309 500 HZ3 LYS 65 2HZ LYS 65 -19.975 -6.624 -0.874 501 H ASN 66 HN ASN 66 -15.220 -4.260 4.628 502 HA ASN 66 HA ASN 66 -14.948 -1.625 5.785 503 HB2 ASN 66 2HB ASN 66 -15.285 -3.868 7.063 504 HB3 ASN 66 1HB ASN 66 -13.550 -4.043 6.867 505 HD21 ASN 66 1HD2 ASN 66 -13.444 -3.936 9.189 506 HD22 ASN 66 2HD2 ASN 66 -13.455 -2.387 9.967 507 H ALA 67 HN ALA 67 -13.244 -0.361 5.782 508 HA ALA 67 HA ALA 67 -10.668 -1.370 4.825 509 HB1 ALA 67 1HB ALA 67 -11.809 -0.476 2.856 510 HB2 ALA 67 2HB ALA 67 -10.418 0.515 3.288 511 HB3 ALA 67 3HB ALA 67 -12.048 1.063 3.684 512 H ALA 68 HN ALA 68 -9.042 -0.634 6.020 513 HA ALA 68 HA ALA 68 -9.360 1.912 7.456 514 HB1 ALA 68 1HB ALA 68 -8.244 -0.629 8.644 515 HB2 ALA 68 2HB ALA 68 -9.802 0.098 9.040 516 HB3 ALA 68 3HB ALA 68 -8.306 0.944 9.440 517 H TYR 69 HN TYR 69 -7.566 3.172 7.499 518 HA TYR 69 HA TYR 69 -5.161 2.080 6.227 519 HB2 TYR 69 2HB TYR 69 -4.706 4.362 5.380 520 HB3 TYR 69 1HB TYR 69 -6.192 3.684 4.738 521 HD1 TYR 69 1HD TYR 69 -8.387 4.535 5.560 522 HD2 TYR 69 2HD TYR 69 -4.712 6.362 6.677 523 HE1 TYR 69 1HE TYR 69 -9.609 6.548 6.257 524 HE2 TYR 69 2HE TYR 69 -5.924 8.384 7.383 525 HH TYR 69 HH TYR 69 -8.071 9.505 6.914 526 H ILE 70 HN ILE 70 -3.300 2.286 7.243 527 HA ILE 70 HA ILE 70 -3.180 4.014 9.618 528 HB ILE 70 HB ILE 70 -2.036 1.222 9.386 529 HG12 ILE 70 2HG1 ILE 70 -4.194 2.335 11.195 530 HG13 ILE 70 1HG1 ILE 70 -4.475 1.304 9.791 531 HG21 ILE 70 1HG2 ILE 70 -1.867 3.202 11.659 532 HG22 ILE 70 2HG2 ILE 70 -0.535 2.695 10.622 533 HG23 ILE 70 3HG2 ILE 70 -1.298 1.530 11.704 534 HD11 ILE 70 3HD1 ILE 70 -4.607 0.049 11.868 535 HD12 ILE 70 1HD1 ILE 70 -2.963 0.535 12.285 536 HD13 ILE 70 2HD1 ILE 70 -3.251 -0.500 10.886 537 H ASP 71 HN ASP 71 -1.731 5.526 9.304 538 HA ASP 71 HA ASP 71 0.412 5.089 7.373 539 HB2 ASP 71 2HB ASP 71 0.744 7.584 7.600 540 HB3 ASP 71 1HB ASP 71 -0.813 7.100 6.945 541 H ALA 72 HN ALA 72 2.137 4.173 8.223 542 HA ALA 72 HA ALA 72 2.560 4.042 11.015 543 HB1 ALA 72 1HB ALA 72 4.510 2.714 10.490 544 HB2 ALA 72 2HB ALA 72 4.433 3.231 8.807 545 HB3 ALA 72 3HB ALA 72 3.148 2.229 9.480 546 H ALA 73 HN ALA 73 3.529 6.395 8.749 547 HA ALA 73 HA ALA 73 5.719 7.263 10.484 548 HB1 ALA 73 1HB ALA 73 4.902 8.280 7.769 549 HB2 ALA 73 2HB ALA 73 6.214 7.150 8.101 550 HB3 ALA 73 3HB ALA 73 6.311 8.811 8.688 551 H SER 74 HN SER 74 2.815 7.465 11.079 552 HA SER 74 HA SER 74 2.980 10.103 12.214 553 HB2 SER 74 2HB SER 74 2.012 10.549 9.965 554 HB3 SER 74 1HB SER 74 0.687 9.450 10.343 555 HG SER 74 HG SER 74 -0.250 11.023 11.335 556 H MET 75 HN MET 75 1.201 7.140 11.672 557 HA MET 75 HA MET 75 0.206 7.278 14.440 558 HB2 MET 75 2HB MET 75 -1.231 6.350 11.963 559 HB3 MET 75 1HB MET 75 -1.726 5.819 13.561 560 HG2 MET 75 2HG MET 75 -1.843 8.329 14.112 561 HG3 MET 75 1HG MET 75 -1.817 8.558 12.364 562 HE1 MET 75 3HE MET 75 -5.044 6.489 11.331 563 HE2 MET 75 1HE MET 75 -3.422 5.828 11.526 564 HE3 MET 75 2HE MET 75 -3.647 7.384 10.728 565 HA PRO 76 HA PRO 76 2.209 3.340 14.818 566 HB2 PRO 76 2HB PRO 76 0.989 2.433 17.057 567 HB3 PRO 76 1HB PRO 76 2.200 3.719 17.085 568 HG2 PRO 76 2HG PRO 76 -0.778 3.913 17.221 569 HG3 PRO 76 1HG PRO 76 0.446 4.837 18.109 570 HD2 PRO 76 2HD PRO 76 -0.887 5.779 15.911 571 HD3 PRO 76 1HD PRO 76 0.726 6.330 16.402 572 H LEU 77 HN LEU 77 1.831 1.137 14.507 573 HA LEU 77 HA LEU 77 -0.619 0.484 13.149 574 HB2 LEU 77 2HB LEU 77 1.629 -0.431 12.512 575 HB3 LEU 77 1HB LEU 77 1.620 -1.361 13.998 576 HG LEU 77 HG LEU 77 -0.394 -2.560 13.212 577 HD11 LEU 77 1HD1 LEU 77 -1.260 -0.808 11.728 578 HD12 LEU 77 2HD1 LEU 77 -1.109 -2.362 10.909 579 HD13 LEU 77 3HD1 LEU 77 0.083 -1.096 10.621 580 HD21 LEU 77 3HD2 LEU 77 0.743 -3.902 11.508 581 HD22 LEU 77 1HD2 LEU 77 1.813 -3.519 12.856 582 HD23 LEU 77 2HD2 LEU 77 1.965 -2.642 11.333 583 H THR 78 HN THR 78 -2.219 -0.974 13.849 584 HA THR 78 HA THR 78 -2.151 -1.622 16.704 585 HB THR 78 HB THR 78 -4.668 -1.034 16.677 586 HG1 THR 78 1HG THR 78 -3.796 0.637 14.544 587 HG21 THR 78 3HG2 THR 78 -4.198 1.311 17.236 588 HG22 THR 78 1HG2 THR 78 -2.597 1.160 16.515 589 HG23 THR 78 2HG2 THR 78 -3.008 0.228 17.955 590 H ASP 79 HN ASP 79 -3.517 -3.339 17.346 591 HA ASP 79 HA ASP 79 -3.666 -5.443 15.412 592 HB2 ASP 79 2HB ASP 79 -4.396 -6.838 17.252 593 HB3 ASP 79 1HB ASP 79 -3.053 -5.839 17.784 594 H ALA 80 HN ALA 80 -5.783 -3.008 16.462 595 HA ALA 80 HA ALA 80 -8.301 -4.175 16.070 596 HB1 ALA 80 1HB ALA 80 -7.481 -1.310 15.598 597 HB2 ALA 80 2HB ALA 80 -7.973 -2.003 17.145 598 HB3 ALA 80 3HB ALA 80 -9.127 -1.900 15.817 599 H ALA 81 HN ALA 81 -5.878 -3.212 13.827 600 HA ALA 81 HA ALA 81 -7.308 -2.555 11.556 601 HB1 ALA 81 1HB ALA 81 -4.721 -4.091 11.707 602 HB2 ALA 81 2HB ALA 81 -4.892 -2.336 11.730 603 HB3 ALA 81 3HB ALA 81 -5.340 -3.246 10.288 604 H PHE 82 HN PHE 82 -6.985 -5.690 13.035 605 HA PHE 82 HA PHE 82 -7.491 -7.274 10.742 606 HB2 PHE 82 2HB PHE 82 -7.711 -7.784 13.691 607 HB3 PHE 82 1HB PHE 82 -8.221 -8.993 12.518 608 HD1 PHE 82 1HD PHE 82 -6.554 -9.864 10.869 609 HD2 PHE 82 2HD PHE 82 -5.434 -7.486 14.213 610 HE1 PHE 82 1HE PHE 82 -4.238 -10.669 10.659 611 HE2 PHE 82 2HE PHE 82 -3.117 -8.278 14.003 612 HZ PHE 82 HZ PHE 82 -2.514 -9.875 12.224 613 H GLU 83 HN GLU 83 -9.545 -5.236 12.523 614 HA GLU 83 HA GLU 83 -11.991 -6.630 12.161 615 HB2 GLU 83 2HB GLU 83 -11.424 -3.695 12.560 616 HB3 GLU 83 1HB GLU 83 -13.031 -4.399 12.561 617 HG2 GLU 83 2HG GLU 83 -12.297 -5.865 14.434 618 HG3 GLU 83 1HG GLU 83 -10.805 -4.932 14.497 619 H ALA 84 HN ALA 84 -10.003 -4.807 10.081 620 HA ALA 84 HA ALA 84 -12.130 -4.481 8.086 621 HB1 ALA 84 1HB ALA 84 -10.600 -2.951 6.950 622 HB2 ALA 84 2HB ALA 84 -9.359 -3.285 8.158 623 HB3 ALA 84 3HB ALA 84 -10.847 -2.465 8.630 624 H GLU 85 HN GLU 85 -11.944 -5.336 6.045 625 HA GLU 85 HA GLU 85 -10.019 -7.497 5.708 626 HB2 GLU 85 2HB GLU 85 -12.471 -7.582 4.978 627 HB3 GLU 85 1HB GLU 85 -12.001 -6.529 3.652 628 HG2 GLU 85 2HG GLU 85 -10.379 -8.207 2.906 629 HG3 GLU 85 1HG GLU 85 -10.895 -9.275 4.209 630 H TYR 86 HN TYR 86 -10.648 -4.277 4.562 631 HA TYR 86 HA TYR 86 -8.341 -4.381 2.756 632 HB2 TYR 86 2HB TYR 86 -10.557 -2.373 3.142 633 HB3 TYR 86 1HB TYR 86 -9.134 -2.025 2.175 634 HD1 TYR 86 2HD TYR 86 -11.969 -4.456 2.440 635 HD2 TYR 86 1HD TYR 86 -9.102 -2.560 -0.074 636 HE1 TYR 86 2HE TYR 86 -13.073 -5.413 0.458 637 HE2 TYR 86 1HE TYR 86 -10.198 -3.509 -2.056 638 HH TYR 86 HH TYR 86 -13.269 -5.099 -1.877 639 H LEU 87 HN LEU 87 -6.477 -4.076 3.863 640 HA LEU 87 HA LEU 87 -6.383 -1.819 5.747 641 HB2 LEU 87 2HB LEU 87 -4.712 -4.319 5.610 642 HB3 LEU 87 1HB LEU 87 -4.211 -2.912 6.525 643 HG LEU 87 HG LEU 87 -5.172 -4.342 8.099 644 HD11 LEU 87 1HD1 LEU 87 -7.177 -3.183 8.863 645 HD12 LEU 87 2HD1 LEU 87 -7.329 -2.402 7.289 646 HD13 LEU 87 3HD1 LEU 87 -5.942 -2.046 8.318 647 HD21 LEU 87 3HD2 LEU 87 -6.219 -5.917 6.569 648 HD22 LEU 87 1HD2 LEU 87 -7.490 -4.746 6.214 649 HD23 LEU 87 2HD2 LEU 87 -7.347 -5.429 7.833 650 H ALA 88 HN ALA 88 -5.170 -0.124 5.283 651 HA ALA 88 HA ALA 88 -3.252 -0.362 3.052 652 HB1 ALA 88 1HB ALA 88 -5.159 1.047 2.478 653 HB2 ALA 88 2HB ALA 88 -3.682 2.007 2.588 654 HB3 ALA 88 3HB ALA 88 -4.859 2.048 3.901 655 H VAL 89 HN VAL 89 -1.211 -0.276 3.732 656 HA VAL 89 HA VAL 89 -0.617 1.139 6.248 657 HB VAL 89 HB VAL 89 1.068 -0.912 4.795 658 HG11 VAL 89 1HG1 VAL 89 2.395 0.627 6.138 659 HG12 VAL 89 2HG1 VAL 89 2.375 -0.984 6.857 660 HG13 VAL 89 3HG1 VAL 89 1.374 0.299 7.538 661 HG21 VAL 89 3HG2 VAL 89 0.427 -2.435 6.599 662 HG22 VAL 89 1HG2 VAL 89 -0.969 -1.914 5.658 663 HG23 VAL 89 2HG2 VAL 89 -0.661 -1.207 7.246 664 H ASP 90 HN ASP 90 0.461 2.990 6.186 665 HA ASP 90 HA ASP 90 1.773 3.810 3.689 666 HB2 ASP 90 2HB ASP 90 0.144 5.390 4.466 667 HB3 ASP 90 1HB ASP 90 0.802 5.357 6.095 668 H GLN 91 HN GLN 91 3.891 3.621 3.543 669 HA GLN 91 HA GLN 91 6.094 3.558 3.988 670 HB2 GLN 91 2HB GLN 91 5.217 5.347 6.252 671 HB3 GLN 91 1HB GLN 91 6.909 4.998 5.908 672 HG2 GLN 91 2HG GLN 91 6.754 5.995 3.747 673 HG3 GLN 91 1HG GLN 91 5.005 6.150 3.882 674 HE21 GLN 91 1HE2 GLN 91 4.134 7.751 5.196 675 HE22 GLN 91 2HE2 GLN 91 5.081 9.107 5.720 676 H VAL 92 HN VAL 92 6.575 1.499 4.337 677 HA VAL 92 HA VAL 92 5.606 0.156 6.724 678 HB VAL 92 HB VAL 92 7.142 -1.029 4.410 679 HG11 VAL 92 1HG1 VAL 92 6.045 -3.132 5.132 680 HG12 VAL 92 2HG1 VAL 92 5.411 -2.278 6.538 681 HG13 VAL 92 3HG1 VAL 92 7.153 -2.472 6.335 682 HG21 VAL 92 3HG2 VAL 92 5.122 0.061 3.596 683 HG22 VAL 92 1HG2 VAL 92 4.160 -0.807 4.790 684 HG23 VAL 92 2HG2 VAL 92 4.970 -1.694 3.498 685 H GLU 93 HN GLU 93 8.591 1.408 5.469 686 HA GLU 93 HA GLU 93 10.389 -0.223 6.927 687 HB2 GLU 93 2HB GLU 93 11.050 1.191 5.000 688 HB3 GLU 93 1HB GLU 93 10.788 2.624 5.983 689 HG2 GLU 93 2HG GLU 93 12.559 0.841 7.355 690 HG3 GLU 93 1HG GLU 93 13.135 1.105 5.711 691 H LYS 94 HN LYS 94 8.280 2.268 7.929 692 HA LYS 94 HA LYS 94 9.955 3.190 10.078 693 HB2 LYS 94 2HB LYS 94 7.071 3.854 9.556 694 HB3 LYS 94 1HB LYS 94 8.189 4.734 10.581 695 HG2 LYS 94 2HG LYS 94 8.045 4.616 7.603 696 HG3 LYS 94 1HG LYS 94 8.139 6.021 8.664 697 HD2 LYS 94 2HD LYS 94 10.360 4.061 8.098 698 HD3 LYS 94 1HD LYS 94 10.226 5.689 7.451 699 HE2 LYS 94 2HE LYS 94 10.431 6.619 9.685 700 HE3 LYS 94 1HE LYS 94 10.496 4.994 10.368 701 HZ1 LYS 94 3HZ LYS 94 12.710 5.702 10.215 702 HZ2 LYS 94 1HZ LYS 94 12.503 6.328 8.647 703 HZ3 LYS 94 2HZ LYS 94 12.501 4.648 8.896 704 H LEU 95 HN LEU 95 8.305 0.425 9.754 705 HA LEU 95 HA LEU 95 7.077 0.312 12.365 706 HB2 LEU 95 2HB LEU 95 7.668 -1.863 10.352 707 HB3 LEU 95 1HB LEU 95 6.753 -2.085 11.826 708 HG LEU 95 HG LEU 95 5.952 -0.342 9.497 709 HD11 LEU 95 1HD1 LEU 95 5.767 -2.739 9.046 710 HD12 LEU 95 2HD1 LEU 95 4.184 -1.972 9.160 711 HD13 LEU 95 3HD1 LEU 95 4.794 -2.935 10.504 712 HD21 LEU 95 3HD2 LEU 95 4.509 -0.942 12.078 713 HD22 LEU 95 1HD2 LEU 95 3.830 -0.076 10.701 714 HD23 LEU 95 2HD2 LEU 95 5.183 0.615 11.594 715 H GLY 96 HN GLY 96 7.846 -0.812 14.158 716 HA2 GLY 96 2HA GLY 96 10.723 -0.905 14.346 717 HA3 GLY 96 1HA GLY 96 9.579 -1.220 15.640 718 H ASN 97 HN ASN 97 8.570 -3.335 15.724 719 HA ASN 97 HA ASN 97 9.805 -5.442 14.152 720 HB2 ASN 97 2HB ASN 97 11.485 -5.247 15.853 721 HB3 ASN 97 1HB ASN 97 10.271 -5.188 17.128 722 HD21 ASN 97 1HD2 ASN 97 11.898 -7.238 14.813 723 HD22 ASN 97 2HD2 ASN 97 11.454 -8.745 15.548 724 H GLU 98 HN GLU 98 7.930 -4.856 17.111 725 HA GLU 98 HA GLU 98 6.416 -7.215 17.000 726 HB2 GLU 98 2HB GLU 98 6.639 -5.721 18.975 727 HB3 GLU 98 1HB GLU 98 5.609 -4.551 18.171 728 HG2 GLU 98 2HG GLU 98 3.732 -6.007 18.270 729 HG3 GLU 98 1HG GLU 98 4.734 -7.354 18.815 730 H GLU 99 HN GLU 99 5.923 -4.040 15.595 731 HA GLU 99 HA GLU 99 3.306 -4.504 14.608 732 HB2 GLU 99 2HB GLU 99 5.289 -2.659 13.299 733 HB3 GLU 99 1HB GLU 99 3.542 -2.495 13.396 734 HG2 GLU 99 2HG GLU 99 4.107 -0.977 14.967 735 HG3 GLU 99 1HG GLU 99 4.090 -2.410 15.995 736 H GLN 100 HN GLN 100 6.483 -5.319 13.444 737 HA GLN 100 HA GLN 100 5.695 -5.877 10.759 738 HB2 GLN 100 2HB GLN 100 8.088 -6.927 12.282 739 HB3 GLN 100 1HB GLN 100 7.868 -6.974 10.537 740 HG2 GLN 100 2HG GLN 100 7.826 -4.487 10.541 741 HG3 GLN 100 1HG GLN 100 8.218 -4.529 12.260 742 HE21 GLN 100 1HE2 GLN 100 9.741 -3.380 10.092 743 HE22 GLN 100 2HE2 GLN 100 11.276 -4.170 10.096 744 H ALA 101 HN ALA 101 5.975 -7.748 13.731 745 HA ALA 101 HA ALA 101 5.335 -10.270 12.600 746 HB1 ALA 101 1HB ALA 101 6.361 -10.037 14.810 747 HB2 ALA 101 2HB ALA 101 4.864 -10.967 14.895 748 HB3 ALA 101 3HB ALA 101 4.890 -9.280 15.417 749 H LEU 102 HN LEU 102 3.446 -7.603 13.864 750 HA LEU 102 HA LEU 102 0.890 -8.795 13.713 751 HB2 LEU 102 2HB LEU 102 1.664 -6.572 14.801 752 HB3 LEU 102 1HB LEU 102 1.452 -5.880 13.206 753 HG LEU 102 HG LEU 102 -0.456 -5.497 14.764 754 HD11 LEU 102 1HD1 LEU 102 -2.220 -6.025 13.177 755 HD12 LEU 102 2HD1 LEU 102 -1.129 -7.111 12.316 756 HD13 LEU 102 3HD1 LEU 102 -0.798 -5.379 12.357 757 HD21 LEU 102 3HD2 LEU 102 -0.399 -7.607 15.952 758 HD22 LEU 102 1HD2 LEU 102 -0.841 -8.468 14.479 759 HD23 LEU 102 2HD2 LEU 102 -1.987 -7.354 15.223 760 H LEU 103 HN LEU 103 2.690 -6.742 11.457 761 HA LEU 103 HA LEU 103 0.944 -6.779 9.295 762 HB2 LEU 103 2HB LEU 103 3.028 -5.385 9.629 763 HB3 LEU 103 1HB LEU 103 3.961 -6.783 9.142 764 HG LEU 103 HG LEU 103 3.566 -4.981 7.395 765 HD11 LEU 103 1HD1 LEU 103 4.377 -7.189 6.802 766 HD12 LEU 103 2HD1 LEU 103 3.270 -6.574 5.576 767 HD13 LEU 103 3HD1 LEU 103 2.722 -7.794 6.727 768 HD21 LEU 103 3HD2 LEU 103 1.224 -4.547 7.862 769 HD22 LEU 103 1HD2 LEU 103 0.806 -6.196 7.392 770 HD23 LEU 103 2HD2 LEU 103 1.438 -5.069 6.192 771 H PHE 104 HN PHE 104 3.605 -8.990 10.077 772 HA PHE 104 HA PHE 104 3.470 -10.784 7.985 773 HB2 PHE 104 2HB PHE 104 5.175 -10.912 9.720 774 HB3 PHE 104 1HB PHE 104 3.965 -11.325 10.923 775 HD1 PHE 104 2HD PHE 104 5.772 -12.540 7.954 776 HD2 PHE 104 1HD PHE 104 3.211 -13.551 11.196 777 HE1 PHE 104 2HE PHE 104 6.138 -14.933 7.496 778 HE2 PHE 104 1HE PHE 104 3.572 -15.940 10.748 779 HZ PHE 104 HZ PHE 104 5.032 -16.635 8.895 780 H SER 105 HN SER 105 1.585 -10.799 10.978 781 HA SER 105 HA SER 105 0.114 -13.123 10.484 782 HB2 SER 105 2HB SER 105 -0.589 -10.691 12.140 783 HB3 SER 105 1HB SER 105 -1.353 -12.269 12.259 784 HG SER 105 HG SER 105 1.312 -11.559 12.893 785 H ILE 106 HN ILE 106 -0.449 -9.762 9.598 786 HA ILE 106 HA ILE 106 -3.083 -9.986 8.674 787 HB ILE 106 HB ILE 106 -0.884 -8.188 7.638 788 HG12 ILE 106 2HG1 ILE 106 -3.060 -7.686 9.684 789 HG13 ILE 106 1HG1 ILE 106 -1.358 -7.924 10.046 790 HG21 ILE 106 1HG2 ILE 106 -2.729 -6.767 6.816 791 HG22 ILE 106 2HG2 ILE 106 -3.874 -8.028 7.276 792 HG23 ILE 106 3HG2 ILE 106 -2.674 -8.339 6.020 793 HD11 ILE 106 3HD1 ILE 106 -2.530 -5.644 8.475 794 HD12 ILE 106 1HD1 ILE 106 -0.814 -5.885 8.808 795 HD13 ILE 106 2HD1 ILE 106 -1.937 -5.579 10.134 796 H PHE 107 HN PHE 107 -0.015 -10.318 6.904 797 HA PHE 107 HA PHE 107 -1.102 -11.003 4.403 798 HB2 PHE 107 2HB PHE 107 1.538 -11.285 5.724 799 HB3 PHE 107 1HB PHE 107 1.231 -12.374 4.379 800 HD1 PHE 107 2HD PHE 107 0.435 -11.282 2.175 801 HD2 PHE 107 1HD PHE 107 2.342 -9.157 5.330 802 HE1 PHE 107 2HE PHE 107 1.100 -9.525 0.585 803 HE2 PHE 107 1HE PHE 107 3.007 -7.395 3.747 804 HZ PHE 107 HZ PHE 107 2.388 -7.582 1.369 805 H ASN 108 HN ASN 108 -0.111 -13.006 7.138 806 HA ASN 108 HA ASN 108 -0.469 -15.489 5.848 807 HB2 ASN 108 2HB ASN 108 0.834 -15.074 7.968 808 HB3 ASN 108 1HB ASN 108 -0.709 -14.977 8.813 809 HD21 ASN 108 1HD2 ASN 108 -0.393 -16.752 10.071 810 HD22 ASN 108 2HD2 ASN 108 -0.363 -18.371 9.435 811 H ARG 109 HN ARG 109 -2.582 -13.612 7.991 812 HA ARG 109 HA ARG 109 -4.734 -15.369 8.168 813 HB2 ARG 109 2HB ARG 109 -4.539 -13.322 9.504 814 HB3 ARG 109 1HB ARG 109 -4.757 -12.343 8.062 815 HG2 ARG 109 2HG ARG 109 -7.023 -13.412 7.815 816 HG3 ARG 109 1HG ARG 109 -6.782 -14.094 9.426 817 HD2 ARG 109 2HD ARG 109 -6.409 -11.804 10.289 818 HD3 ARG 109 1HD ARG 109 -6.787 -11.174 8.688 819 HE ARG 109 HE ARG 109 -8.821 -12.855 9.903 820 HH11 ARG 109 1HH1 ARG 109 -7.678 -9.617 9.232 821 HH12 ARG 109 2HH1 ARG 109 -9.187 -8.861 9.631 822 HH21 ARG 109 1HH2 ARG 109 -10.801 -11.883 10.412 823 HH22 ARG 109 2HH2 ARG 109 -10.969 -10.153 10.326 824 H PHE 110 HN PHE 110 -4.134 -12.815 5.764 825 HA PHE 110 HA PHE 110 -6.518 -13.175 4.324 826 HB2 PHE 110 2HB PHE 110 -3.842 -12.027 3.545 827 HB3 PHE 110 1HB PHE 110 -5.216 -12.041 2.447 828 HD1 PHE 110 2HD PHE 110 -7.052 -11.648 5.115 829 HD2 PHE 110 1HD PHE 110 -3.882 -9.551 3.202 830 HE1 PHE 110 2HE PHE 110 -7.854 -9.547 6.106 831 HE2 PHE 110 1HE PHE 110 -4.679 -7.443 4.191 832 HZ PHE 110 HZ PHE 110 -6.668 -7.438 5.643 833 H ARG 111 HN ARG 111 -3.283 -14.558 3.853 834 HA ARG 111 HA ARG 111 -3.957 -16.039 1.540 835 HB2 ARG 111 2HB ARG 111 -1.826 -16.850 1.610 836 HB3 ARG 111 1HB ARG 111 -1.626 -15.454 2.651 837 HG2 ARG 111 2HG ARG 111 -0.536 -17.080 3.842 838 HG3 ARG 111 1HG ARG 111 -2.149 -17.166 4.556 839 HD2 ARG 111 2HD ARG 111 -2.704 -18.997 3.013 840 HD3 ARG 111 1HD ARG 111 -1.068 -18.931 2.372 841 HE ARG 111 HE ARG 111 -1.388 -19.411 5.238 842 HH11 ARG 111 1HH1 ARG 111 -0.622 -20.657 2.061 843 HH12 ARG 111 2HH1 ARG 111 -0.039 -22.186 2.661 844 HH21 ARG 111 1HH2 ARG 111 -0.614 -21.430 6.032 845 HH22 ARG 111 2HH2 ARG 111 -0.037 -22.613 4.903 846 H ASN 112 HN ASN 112 -4.273 -16.664 4.963 847 HA ASN 112 HA ASN 112 -4.872 -19.429 4.767 848 HB2 ASN 112 2HB ASN 112 -5.189 -17.337 6.890 849 HB3 ASN 112 1HB ASN 112 -5.917 -18.917 7.107 850 HD21 ASN 112 1HD2 ASN 112 -3.817 -17.669 8.642 851 HD22 ASN 112 2HD2 ASN 112 -2.432 -18.708 8.533 852 H SER 113 HN SER 113 -6.881 -16.513 4.973 853 HA SER 113 HA SER 113 -9.362 -17.880 4.988 854 HB2 SER 113 2HB SER 113 -8.786 -15.067 4.026 855 HB3 SER 113 1HB SER 113 -10.350 -15.704 4.526 856 HG SER 113 HG SER 113 -8.726 -14.460 6.048 857 H GLY 114 HN GLY 114 -7.272 -16.677 2.430 858 HA2 GLY 114 2HA GLY 114 -7.265 -17.657 0.248 859 HA3 GLY 114 1HA GLY 114 -8.958 -18.086 0.470 860 H LYS 115 HN LYS 115 -8.984 -15.198 1.713 861 HA LYS 115 HA LYS 115 -9.008 -13.673 -0.765 862 HB2 LYS 115 2HB LYS 115 -11.294 -14.521 -0.346 863 HB3 LYS 115 1HB LYS 115 -11.281 -13.755 1.234 864 HG2 LYS 115 2HG LYS 115 -11.416 -11.625 0.340 865 HG3 LYS 115 1HG LYS 115 -10.840 -12.152 -1.240 866 HD2 LYS 115 2HD LYS 115 -12.908 -13.239 -1.718 867 HD3 LYS 115 1HD LYS 115 -13.470 -13.024 -0.062 868 HE2 LYS 115 2HE LYS 115 -12.854 -10.724 -1.906 869 HE3 LYS 115 1HE LYS 115 -14.455 -11.451 -1.772 870 HZ1 LYS 115 3HZ LYS 115 -12.926 -10.010 0.327 871 HZ2 LYS 115 1HZ LYS 115 -14.272 -10.981 0.681 872 HZ3 LYS 115 2HZ LYS 115 -14.446 -9.629 -0.315 873 H GLY 116 HN GLY 116 -9.500 -11.254 -0.052 874 HA2 GLY 116 2HA GLY 116 -8.931 -9.689 1.805 875 HA3 GLY 116 1HA GLY 116 -7.562 -10.756 2.115 876 H PHE 117 HN PHE 117 -7.504 -7.922 1.423 877 HA PHE 117 HA PHE 117 -6.281 -8.095 -1.242 878 HB2 PHE 117 2HB PHE 117 -7.776 -5.786 0.001 879 HB3 PHE 117 1HB PHE 117 -6.908 -5.701 -1.529 880 HD1 PHE 117 1HD PHE 117 -9.593 -7.655 0.167 881 HD2 PHE 117 2HD PHE 117 -8.039 -6.140 -3.492 882 HE1 PHE 117 1HE PHE 117 -11.590 -8.469 -1.015 883 HE2 PHE 117 2HE PHE 117 -10.034 -6.950 -4.680 884 HZ PHE 117 HZ PHE 117 -11.811 -8.118 -3.444 885 H LEU 118 HN LEU 118 -6.216 -5.594 1.220 886 HA LEU 118 HA LEU 118 -4.543 -4.596 2.396 887 HB2 LEU 118 2HB LEU 118 -3.813 -6.908 2.937 888 HB3 LEU 118 1HB LEU 118 -2.820 -6.888 1.498 889 HG LEU 118 HG LEU 118 -1.507 -5.017 2.463 890 HD11 LEU 118 1HD1 LEU 118 -3.116 -5.609 4.939 891 HD12 LEU 118 2HD1 LEU 118 -3.179 -4.127 3.985 892 HD13 LEU 118 3HD1 LEU 118 -1.703 -4.557 4.849 893 HD21 LEU 118 3HD2 LEU 118 -0.728 -7.315 2.626 894 HD22 LEU 118 1HD2 LEU 118 -1.647 -7.535 4.114 895 HD23 LEU 118 2HD2 LEU 118 -0.296 -6.402 4.070 896 H LEU 119 HN LEU 119 -3.092 -3.042 2.007 897 HA LEU 119 HA LEU 119 -1.719 -2.937 -0.573 898 HB2 LEU 119 2HB LEU 119 -3.772 -1.686 -0.949 899 HB3 LEU 119 1HB LEU 119 -3.509 -0.753 0.512 900 HG LEU 119 HG LEU 119 -1.488 0.248 -0.517 901 HD11 LEU 119 1HD1 LEU 119 -1.100 -0.017 -2.907 902 HD12 LEU 119 2HD1 LEU 119 -2.395 -1.211 -2.992 903 HD13 LEU 119 3HD1 LEU 119 -0.936 -1.560 -2.064 904 HD21 LEU 119 3HD2 LEU 119 -3.614 1.415 -0.647 905 HD22 LEU 119 1HD2 LEU 119 -4.019 0.541 -2.123 906 HD23 LEU 119 2HD2 LEU 119 -2.670 1.677 -2.114 907 H LEU 120 HN LEU 120 0.331 -2.286 -0.324 908 HA LEU 120 HA LEU 120 1.005 -0.930 2.203 909 HB2 LEU 120 2HB LEU 120 2.758 -2.870 0.690 910 HB3 LEU 120 1HB LEU 120 3.153 -2.073 2.198 911 HG LEU 120 HG LEU 120 0.948 -3.317 3.012 912 HD11 LEU 120 1HD1 LEU 120 0.437 -4.280 0.834 913 HD12 LEU 120 2HD1 LEU 120 0.775 -5.534 2.026 914 HD13 LEU 120 3HD1 LEU 120 1.995 -5.106 0.826 915 HD21 LEU 120 3HD2 LEU 120 3.127 -3.532 4.033 916 HD22 LEU 120 1HD2 LEU 120 3.663 -4.596 2.732 917 HD23 LEU 120 2HD2 LEU 120 2.393 -5.123 3.837 918 H GLY 121 HN GLY 121 1.617 1.071 1.883 919 HA2 GLY 121 2HA GLY 121 2.816 1.899 -0.637 920 HA3 GLY 121 1HA GLY 121 2.401 2.942 0.720 921 H SER 122 HN SER 122 4.629 0.379 -0.229 922 HA SER 122 HA SER 122 6.472 0.963 1.879 923 HB2 SER 122 2HB SER 122 7.898 -0.676 0.393 924 HB3 SER 122 1HB SER 122 6.515 -1.275 1.315 925 HG SER 122 HG SER 122 6.285 -0.381 -1.367 926 H GLU 123 HN GLU 123 8.375 1.988 1.813 927 HA GLU 123 HA GLU 123 8.797 3.805 -0.421 928 HB2 GLU 123 2HB GLU 123 10.461 4.865 1.100 929 HB3 GLU 123 1HB GLU 123 8.839 4.800 1.773 930 HG2 GLU 123 2HG GLU 123 10.865 2.695 2.424 931 HG3 GLU 123 1HG GLU 123 10.839 4.234 3.280 932 H TYR 124 HN TYR 124 9.942 0.817 0.659 933 HA TYR 124 HA TYR 124 12.236 1.002 -1.164 934 HB2 TYR 124 2HB TYR 124 12.240 -0.189 1.612 935 HB3 TYR 124 1HB TYR 124 13.483 -0.528 0.415 936 HD1 TYR 124 2HD TYR 124 14.595 1.652 -0.621 937 HD2 TYR 124 1HD TYR 124 12.630 1.471 3.146 938 HE1 TYR 124 2HE TYR 124 15.854 3.625 0.124 939 HE2 TYR 124 1HE TYR 124 13.887 3.443 3.901 940 HH TYR 124 HH TYR 124 15.985 4.596 3.375 941 H THR 125 HN THR 125 13.029 -1.139 -1.835 942 HA THR 125 HA THR 125 10.940 -3.045 -2.355 943 HB THR 125 HB THR 125 12.875 -4.455 -3.204 944 HG1 THR 125 1HG THR 125 14.402 -2.072 -2.834 945 HG21 THR 125 3HG2 THR 125 11.610 -3.033 -4.727 946 HG22 THR 125 1HG2 THR 125 13.317 -3.054 -5.167 947 HG23 THR 125 2HG2 THR 125 12.642 -1.662 -4.322 948 HA PRO 126 HA PRO 126 11.550 -5.866 1.153 949 HB2 PRO 126 2HB PRO 126 11.862 -7.980 -0.920 950 HB3 PRO 126 1HB PRO 126 10.792 -7.931 0.481 951 HG2 PRO 126 2HG PRO 126 9.829 -7.549 -1.968 952 HG3 PRO 126 1HG PRO 126 9.218 -6.605 -0.595 953 HD2 PRO 126 2HD PRO 126 11.105 -5.802 -2.766 954 HD3 PRO 126 1HD PRO 126 9.831 -4.855 -1.972 955 H GLN 127 HN GLN 127 13.617 -5.518 -1.532 956 HA GLN 127 HA GLN 127 15.787 -7.157 -0.735 957 HB2 GLN 127 2HB GLN 127 15.685 -4.816 -2.614 958 HB3 GLN 127 1HB GLN 127 17.029 -5.943 -2.458 959 HG2 GLN 127 2HG GLN 127 14.233 -6.613 -3.340 960 HG3 GLN 127 1HG GLN 127 15.663 -6.496 -4.348 961 HE21 GLN 127 1HE2 GLN 127 17.197 -8.084 -4.311 962 HE22 GLN 127 2HE2 GLN 127 16.911 -9.634 -3.598 963 H GLN 128 HN GLN 128 14.887 -3.811 -0.135 964 HA GLN 128 HA GLN 128 17.477 -3.342 1.172 965 HB2 GLN 128 2HB GLN 128 15.401 -1.389 0.172 966 HB3 GLN 128 1HB GLN 128 16.856 -0.929 1.047 967 HG2 GLN 128 2HG GLN 128 18.210 -1.961 -0.742 968 HG3 GLN 128 1HG GLN 128 16.725 -2.291 -1.632 969 HE21 GLN 128 1HE2 GLN 128 17.362 -1.020 -3.359 970 HE22 GLN 128 2HE2 GLN 128 17.379 0.708 -3.277 971 H LEU 129 HN LEU 129 14.371 -4.196 1.965 972 HA LEU 129 HA LEU 129 14.159 -2.620 4.366 973 HB2 LEU 129 2HB LEU 129 12.587 -4.975 3.331 974 HB3 LEU 129 1HB LEU 129 12.238 -4.173 4.846 975 HG LEU 129 HG LEU 129 12.117 -2.888 2.120 976 HD11 LEU 129 1HD1 LEU 129 10.330 -4.510 2.496 977 HD12 LEU 129 2HD1 LEU 129 9.712 -2.859 2.460 978 HD13 LEU 129 3HD1 LEU 129 9.905 -3.696 4.001 979 HD21 LEU 129 3HD2 LEU 129 12.768 -1.300 3.848 980 HD22 LEU 129 1HD2 LEU 129 11.393 -1.790 4.835 981 HD23 LEU 129 2HD2 LEU 129 11.125 -0.984 3.289 982 H VAL 130 HN VAL 130 14.877 -3.145 6.344 983 HA VAL 130 HA VAL 130 16.333 -5.649 6.649 984 HB VAL 130 HB VAL 130 16.080 -3.399 8.648 985 HG11 VAL 130 1HG1 VAL 130 18.095 -4.362 9.638 986 HG12 VAL 130 2HG1 VAL 130 18.072 -5.655 8.437 987 HG13 VAL 130 3HG1 VAL 130 16.769 -5.525 9.617 988 HG21 VAL 130 3HG2 VAL 130 18.200 -3.862 6.554 989 HG22 VAL 130 1HG2 VAL 130 18.299 -2.679 7.860 990 HG23 VAL 130 2HG2 VAL 130 17.054 -2.524 6.622 991 H ILE 131 HN ILE 131 14.565 -7.053 6.672 992 HA ILE 131 HA ILE 131 13.036 -7.059 9.188 993 HB ILE 131 HB ILE 131 11.155 -8.106 7.930 994 HG12 ILE 131 2HG1 ILE 131 12.738 -7.237 5.500 995 HG13 ILE 131 1HG1 ILE 131 12.431 -8.901 5.986 996 HG21 ILE 131 1HG2 ILE 131 10.309 -6.026 6.966 997 HG22 ILE 131 2HG2 ILE 131 11.934 -5.341 7.023 998 HG23 ILE 131 3HG2 ILE 131 11.094 -5.747 8.520 999 HD11 ILE 131 3HD1 ILE 131 10.364 -6.890 5.116 1000 HD12 ILE 131 1HD1 ILE 131 10.034 -8.542 5.635 1001 HD13 ILE 131 2HD1 ILE 131 10.974 -8.250 4.172 1002 H ARG 132 HN ARG 132 11.980 -9.378 9.405 1003 HA ARG 132 HA ARG 132 14.140 -11.253 9.447 1004 HB2 ARG 132 2HB ARG 132 11.228 -11.912 9.865 1005 HB3 ARG 132 1HB ARG 132 12.629 -12.766 10.491 1006 HG2 ARG 132 2HG ARG 132 13.137 -10.744 11.871 1007 HG3 ARG 132 1HG ARG 132 11.585 -10.082 11.351 1008 HD2 ARG 132 2HD ARG 132 12.118 -12.528 13.014 1009 HD3 ARG 132 1HD ARG 132 11.163 -11.106 13.427 1010 HE ARG 132 HE ARG 132 10.247 -12.811 11.215 1011 HH11 ARG 132 1HH1 ARG 132 9.794 -11.603 14.482 1012 HH12 ARG 132 2HH1 ARG 132 8.214 -12.315 14.658 1013 HH21 ARG 132 1HH2 ARG 132 8.176 -13.711 11.424 1014 HH22 ARG 132 2HH2 ARG 132 7.289 -13.497 12.907 1015 H GLU 133 HN GLU 133 14.288 -13.215 8.290 1016 HA GLU 133 HA GLU 133 13.707 -12.928 5.555 1017 HB2 GLU 133 2HB GLU 133 14.564 -15.238 5.320 1018 HB3 GLU 133 1HB GLU 133 15.630 -14.195 6.251 1019 HG2 GLU 133 2HG GLU 133 14.892 -15.204 8.309 1020 HG3 GLU 133 1HG GLU 133 13.693 -16.166 7.446 1021 H ASP 134 HN ASP 134 11.898 -14.424 8.127 1022 HA ASP 134 HA ASP 134 10.259 -16.034 6.434 1023 HB2 ASP 134 2HB ASP 134 8.926 -16.481 8.366 1024 HB3 ASP 134 1HB ASP 134 10.597 -16.423 8.904 1025 H LEU 135 HN LEU 135 9.918 -12.833 7.893 1026 HA LEU 135 HA LEU 135 7.405 -12.226 6.711 1027 HB2 LEU 135 2HB LEU 135 8.275 -10.978 8.629 1028 HB3 LEU 135 1HB LEU 135 9.623 -10.404 7.668 1029 HG LEU 135 HG LEU 135 8.009 -9.176 6.220 1030 HD11 LEU 135 1HD1 LEU 135 5.734 -8.834 7.030 1031 HD12 LEU 135 2HD1 LEU 135 6.018 -9.993 8.328 1032 HD13 LEU 135 3HD1 LEU 135 6.030 -10.529 6.646 1033 HD21 LEU 135 3HD2 LEU 135 7.931 -8.511 9.158 1034 HD22 LEU 135 1HD2 LEU 135 7.565 -7.398 7.840 1035 HD23 LEU 135 2HD2 LEU 135 9.195 -8.049 8.019 1036 H ARG 136 HN ARG 136 10.746 -11.825 5.726 1037 HA ARG 136 HA ARG 136 10.326 -10.271 3.412 1038 HB2 ARG 136 2HB ARG 136 12.499 -10.813 4.681 1039 HB3 ARG 136 1HB ARG 136 12.520 -12.313 3.771 1040 HG2 ARG 136 2HG ARG 136 12.302 -9.749 2.279 1041 HG3 ARG 136 1HG ARG 136 13.855 -10.201 2.978 1042 HD2 ARG 136 2HD ARG 136 13.345 -12.501 1.808 1043 HD3 ARG 136 1HD ARG 136 12.300 -11.502 0.795 1044 HE ARG 136 HE ARG 136 14.780 -10.237 0.951 1045 HH11 ARG 136 1HH1 ARG 136 13.393 -13.169 -0.366 1046 HH12 ARG 136 2HH1 ARG 136 14.620 -13.354 -1.579 1047 HH21 ARG 136 1HH2 ARG 136 16.411 -10.481 -0.634 1048 HH22 ARG 136 2HH2 ARG 136 16.351 -11.841 -1.718 1049 H THR 137 HN THR 137 10.183 -13.743 3.999 1050 HA THR 137 HA THR 137 9.944 -14.554 1.300 1051 HB THR 137 HB THR 137 8.806 -15.930 3.728 1052 HG1 THR 137 1HG THR 137 11.165 -15.446 3.726 1053 HG21 THR 137 3HG2 THR 137 7.938 -16.801 1.615 1054 HG22 THR 137 1HG2 THR 137 9.016 -17.972 2.376 1055 HG23 THR 137 2HG2 THR 137 9.582 -17.003 1.014 1056 H ARG 138 HN ARG 138 7.595 -13.562 3.741 1057 HA ARG 138 HA ARG 138 5.274 -14.201 2.242 1058 HB2 ARG 138 2HB ARG 138 5.682 -12.261 4.520 1059 HB3 ARG 138 1HB ARG 138 4.116 -12.785 3.910 1060 HG2 ARG 138 2HG ARG 138 6.184 -14.686 4.965 1061 HG3 ARG 138 1HG ARG 138 4.938 -13.955 5.971 1062 HD2 ARG 138 2HD ARG 138 3.206 -14.956 4.584 1063 HD3 ARG 138 1HD ARG 138 4.435 -15.624 3.511 1064 HE ARG 138 HE ARG 138 5.199 -16.848 5.643 1065 HH11 ARG 138 1HH1 ARG 138 1.873 -16.058 4.889 1066 HH12 ARG 138 2HH1 ARG 138 1.218 -17.399 5.774 1067 HH21 ARG 138 1HH2 ARG 138 4.356 -18.609 6.788 1068 HH22 ARG 138 2HH2 ARG 138 2.642 -18.878 6.832 1069 H MET 139 HN MET 139 7.529 -11.692 1.951 1070 HA MET 139 HA MET 139 5.849 -9.636 0.934 1071 HB2 MET 139 2HB MET 139 8.806 -10.180 0.670 1072 HB3 MET 139 1HB MET 139 8.038 -8.761 -0.017 1073 HG2 MET 139 2HG MET 139 7.979 -9.484 2.897 1074 HG3 MET 139 1HG MET 139 9.119 -8.357 2.163 1075 HE1 MET 139 3HE MET 139 8.357 -6.534 3.981 1076 HE2 MET 139 1HE MET 139 7.188 -7.672 4.656 1077 HE3 MET 139 2HE MET 139 6.678 -6.045 4.210 1078 H ALA 140 HN ALA 140 7.034 -12.562 -0.369 1079 HA ALA 140 HA ALA 140 6.720 -11.754 -3.137 1080 HB1 ALA 140 1HB ALA 140 8.460 -13.361 -2.510 1081 HB2 ALA 140 2HB ALA 140 7.321 -14.047 -3.669 1082 HB3 ALA 140 3HB ALA 140 7.215 -14.486 -1.963 1083 H TYR 141 HN TYR 141 4.542 -12.273 -0.803 1084 HA TYR 141 HA TYR 141 2.716 -13.958 -2.337 1085 HB2 TYR 141 2HB TYR 141 2.722 -12.892 0.471 1086 HB3 TYR 141 1HB TYR 141 1.239 -13.510 -0.245 1087 HD1 TYR 141 1HD TYR 141 4.800 -14.525 0.316 1088 HD2 TYR 141 2HD TYR 141 0.736 -15.745 0.009 1089 HE1 TYR 141 1HE TYR 141 5.442 -16.812 0.963 1090 HE2 TYR 141 2HE TYR 141 1.364 -18.028 0.657 1091 HH TYR 141 HH TYR 141 3.359 -19.477 0.624 1092 H CYS 142 HN CYS 142 3.522 -10.922 -2.715 1093 HA CYS 142 HA CYS 142 0.776 -10.063 -3.224 1094 HB2 CYS 142 2HB CYS 142 1.510 -7.724 -2.556 1095 HB3 CYS 142 1HB CYS 142 1.302 -8.874 -1.240 1096 HG CYS 142 HG CYS 142 4.417 -9.070 -2.165 1097 H LEU 143 HN LEU 143 0.604 -8.381 -4.829 1098 HA LEU 143 HA LEU 143 2.507 -8.776 -6.990 1099 HB2 LEU 143 2HB LEU 143 -0.095 -7.256 -6.845 1100 HB3 LEU 143 1HB LEU 143 0.899 -7.340 -8.281 1101 HG LEU 143 HG LEU 143 0.601 -9.866 -8.094 1102 HD11 LEU 143 1HD1 LEU 143 -0.294 -9.988 -5.854 1103 HD12 LEU 143 2HD1 LEU 143 -1.462 -10.616 -7.015 1104 HD13 LEU 143 3HD1 LEU 143 -1.675 -9.004 -6.334 1105 HD21 LEU 143 3HD2 LEU 143 -1.516 -9.783 -9.312 1106 HD22 LEU 143 1HD2 LEU 143 -0.405 -8.519 -9.841 1107 HD23 LEU 143 2HD2 LEU 143 -1.751 -8.120 -8.772 1108 H VAL 144 HN VAL 144 3.502 -6.964 -8.105 1109 HA VAL 144 HA VAL 144 3.635 -4.515 -6.511 1110 HB VAL 144 HB VAL 144 6.096 -5.842 -7.665 1111 HG11 VAL 144 1HG1 VAL 144 5.725 -3.348 -6.014 1112 HG12 VAL 144 2HG1 VAL 144 6.279 -3.444 -7.685 1113 HG13 VAL 144 3HG1 VAL 144 7.285 -4.080 -6.384 1114 HG21 VAL 144 3HG2 VAL 144 5.369 -7.103 -5.729 1115 HG22 VAL 144 1HG2 VAL 144 5.200 -5.619 -4.790 1116 HG23 VAL 144 2HG2 VAL 144 6.798 -6.156 -5.308 1117 H TYR 145 HN TYR 145 3.350 -2.778 -7.664 1118 HA TYR 145 HA TYR 145 3.714 -2.852 -10.569 1119 HB2 TYR 145 2HB TYR 145 2.427 -0.754 -8.800 1120 HB3 TYR 145 1HB TYR 145 2.544 -0.660 -10.551 1121 HD1 TYR 145 1HD TYR 145 1.528 -2.828 -11.790 1122 HD2 TYR 145 2HD TYR 145 0.442 -1.463 -7.908 1123 HE1 TYR 145 1HE TYR 145 -0.633 -3.986 -11.994 1124 HE2 TYR 145 2HE TYR 145 -1.719 -2.617 -8.099 1125 HH TYR 145 HH TYR 145 -2.390 -4.909 -10.505 1126 H GLU 146 HN GLU 146 5.214 -1.537 -11.585 1127 HA GLU 146 HA GLU 146 7.347 -0.618 -9.851 1128 HB2 GLU 146 2HB GLU 146 7.750 -1.943 -11.974 1129 HB3 GLU 146 1HB GLU 146 7.259 -0.512 -12.872 1130 HG2 GLU 146 2HG GLU 146 9.716 -0.780 -12.643 1131 HG3 GLU 146 1HG GLU 146 9.092 0.745 -12.012 1132 H VAL 147 HN VAL 147 7.619 1.399 -9.222 1133 HA VAL 147 HA VAL 147 6.041 3.478 -10.603 1134 HB VAL 147 HB VAL 147 5.880 4.651 -8.412 1135 HG11 VAL 147 1HG1 VAL 147 4.148 3.174 -7.480 1136 HG12 VAL 147 2HG1 VAL 147 4.725 1.863 -8.508 1137 HG13 VAL 147 3HG1 VAL 147 4.026 3.309 -9.236 1138 HG21 VAL 147 3HG2 VAL 147 6.343 3.409 -6.361 1139 HG22 VAL 147 1HG2 VAL 147 7.812 3.621 -7.312 1140 HG23 VAL 147 2HG2 VAL 147 6.982 2.064 -7.304 1141 H LYS 148 HN LYS 148 9.143 2.480 -10.056 1142 HA LYS 148 HA LYS 148 10.260 5.147 -9.733 1143 HB2 LYS 148 2HB LYS 148 12.437 4.057 -9.704 1144 HB3 LYS 148 1HB LYS 148 11.345 3.271 -8.574 1145 HG2 LYS 148 2HG LYS 148 10.983 1.464 -10.156 1146 HG3 LYS 148 1HG LYS 148 12.030 2.267 -11.327 1147 HD2 LYS 148 2HD LYS 148 13.253 0.513 -10.200 1148 HD3 LYS 148 1HD LYS 148 13.901 2.088 -9.741 1149 HE2 LYS 148 2HE LYS 148 12.691 2.007 -7.641 1150 HE3 LYS 148 1HE LYS 148 11.946 0.475 -8.105 1151 HZ1 LYS 148 3HZ LYS 148 13.836 0.169 -6.602 1152 HZ2 LYS 148 1HZ LYS 148 14.856 0.925 -7.727 1153 HZ3 LYS 148 2HZ LYS 148 14.121 -0.550 -8.114 1154 HA PRO 149 HA PRO 149 10.396 5.678 -14.133 1155 HB2 PRO 149 2HB PRO 149 11.798 8.166 -13.695 1156 HB3 PRO 149 1HB PRO 149 10.116 7.925 -14.163 1157 HG2 PRO 149 2HG PRO 149 10.902 8.936 -11.739 1158 HG3 PRO 149 1HG PRO 149 9.364 8.095 -12.011 1159 HD2 PRO 149 2HD PRO 149 11.911 7.065 -10.821 1160 HD3 PRO 149 1HD PRO 149 10.230 6.747 -10.339 Start of MODEL 14 1 H1 MET 1 H1 MET 1 7.981 75.675 18.827 2 H2 MET 1 H2 MET 1 6.946 75.459 17.498 3 H3 MET 1 H3 MET 1 7.979 74.207 17.983 4 HA MET 1 HA MET 1 6.808 73.933 20.031 5 HB2 MET 1 2HB MET 1 6.202 76.406 20.128 6 HB3 MET 1 1HB MET 1 4.886 76.031 19.023 7 HG2 MET 1 2HG MET 1 4.057 76.096 21.272 8 HG3 MET 1 1HG MET 1 3.989 74.441 20.668 9 HE1 MET 1 2HE MET 1 3.825 75.459 23.767 10 HE2 MET 1 3HE MET 1 4.769 74.203 24.569 11 HE3 MET 1 1HE MET 1 3.612 73.768 23.309 12 H GLY 2 HN GLY 2 5.839 72.035 19.734 13 HA2 GLY 2 2HA GLY 2 3.780 71.831 17.645 14 HA3 GLY 2 1HA GLY 2 5.136 70.715 17.601 15 H HIS 3 HN HIS 3 2.269 71.696 19.354 16 HA HIS 3 HA HIS 3 2.407 69.420 21.141 17 HB2 HIS 3 2HB HIS 3 0.546 71.715 20.779 18 HB3 HIS 3 1HB HIS 3 -0.105 70.248 21.506 19 HD1 HIS 3 1HD HIS 3 0.475 73.124 22.912 20 HD2 HIS 3 2HD HIS 3 2.639 69.594 23.321 21 HE1 HIS 3 1HE HIS 3 1.627 73.287 25.138 22 HE2 HIS 3 2HE HIS 3 2.771 71.058 25.450 23 H HIS 4 HN HIS 4 2.552 67.769 19.560 24 HA HIS 4 HA HIS 4 0.034 67.252 18.132 25 HB2 HIS 4 2HB HIS 4 2.810 66.205 17.543 26 HB3 HIS 4 1HB HIS 4 1.352 65.747 16.667 27 HD1 HIS 4 1HD HIS 4 0.017 68.296 16.001 28 HD2 HIS 4 2HD HIS 4 4.162 67.925 15.969 29 HE1 HIS 4 1HE HIS 4 0.853 70.142 14.508 30 HE2 HIS 4 2HE HIS 4 3.359 69.873 14.456 31 H HIS 5 HN HIS 5 -1.192 66.059 19.382 32 HA HIS 5 HA HIS 5 -0.003 63.710 20.717 33 HB2 HIS 5 2HB HIS 5 -1.022 65.547 22.163 34 HB3 HIS 5 1HB HIS 5 -2.579 65.104 21.478 35 HD1 HIS 5 1HD HIS 5 -3.759 63.109 22.472 36 HD2 HIS 5 2HD HIS 5 0.144 63.532 23.845 37 HE1 HIS 5 1HE HIS 5 -3.527 61.481 24.374 38 HE2 HIS 5 2HE HIS 5 -1.264 61.977 25.362 39 H HIS 6 HN HIS 6 -0.681 61.761 19.987 40 HA HIS 6 HA HIS 6 -2.967 61.788 18.125 41 HB2 HIS 6 2HB HIS 6 -1.816 60.276 16.654 42 HB3 HIS 6 1HB HIS 6 -0.736 61.623 16.986 43 HD1 HIS 6 1HD HIS 6 -0.998 57.970 17.190 44 HD2 HIS 6 2HD HIS 6 1.417 60.949 18.806 45 HE1 HIS 6 1HE HIS 6 1.017 56.783 18.119 46 HE2 HIS 6 2HE HIS 6 2.357 58.582 19.274 47 H HIS 7 HN HIS 7 -4.196 59.878 17.935 48 HA HIS 7 HA HIS 7 -3.554 57.513 19.387 49 HB2 HIS 7 2HB HIS 7 -5.514 57.490 20.890 50 HB3 HIS 7 1HB HIS 7 -4.387 58.775 21.295 51 HD1 HIS 7 1HD HIS 7 -5.465 60.949 21.769 52 HD2 HIS 7 2HD HIS 7 -7.816 58.590 19.280 53 HE1 HIS 7 1HE HIS 7 -7.580 62.250 21.405 54 HE2 HIS 7 2HE HIS 7 -8.964 60.841 19.841 55 H HIS 8 HN HIS 8 -4.766 55.753 18.679 56 HA HIS 8 HA HIS 8 -7.198 56.060 17.221 57 HB2 HIS 8 2HB HIS 8 -5.383 56.837 15.582 58 HB3 HIS 8 1HB HIS 8 -4.847 55.161 15.556 59 HD1 HIS 8 1HD HIS 8 -5.660 56.145 12.923 60 HD2 HIS 8 2HD HIS 8 -8.460 54.653 15.617 61 HE1 HIS 8 1HE HIS 8 -7.663 55.493 11.539 62 HE2 HIS 8 2HE HIS 8 -9.394 54.714 13.204 63 H SER 9 HN SER 9 -8.281 54.276 17.697 64 HA SER 9 HA SER 9 -6.789 51.755 17.983 65 HB2 SER 9 2HB SER 9 -9.301 52.547 19.477 66 HB3 SER 9 1HB SER 9 -8.323 51.100 19.737 67 HG SER 9 HG SER 9 -6.573 52.585 20.288 68 H HIS 10 HN HIS 10 -7.965 49.828 17.408 69 HA HIS 10 HA HIS 10 -9.864 50.215 15.236 70 HB2 HIS 10 2HB HIS 10 -8.733 47.674 16.454 71 HB3 HIS 10 1HB HIS 10 -9.746 47.742 15.015 72 HD1 HIS 10 1HD HIS 10 -6.286 47.723 16.070 73 HD2 HIS 10 2HD HIS 10 -8.415 49.256 12.834 74 HE1 HIS 10 1HE HIS 10 -4.579 48.156 14.272 75 HE2 HIS 10 2HE HIS 10 -5.899 48.959 12.279 76 H MET 11 HN MET 11 -11.801 50.876 16.043 77 HA MET 11 HA MET 11 -12.741 49.600 18.516 78 HB2 MET 11 2HB MET 11 -13.387 52.255 17.256 79 HB3 MET 11 1HB MET 11 -14.302 51.596 18.604 80 HG2 MET 11 2HG MET 11 -12.295 51.563 19.973 81 HG3 MET 11 1HG MET 11 -11.349 52.180 18.620 82 HE1 MET 11 3HE MET 11 -14.775 54.631 20.509 83 HE2 MET 11 1HE MET 11 -14.414 52.973 20.992 84 HE3 MET 11 2HE MET 11 -15.019 53.307 19.369 85 H ASP 12 HN ASP 12 -13.202 47.915 16.536 86 HA ASP 12 HA ASP 12 -15.948 47.476 16.893 87 HB2 ASP 12 2HB ASP 12 -16.118 49.220 15.092 88 HB3 ASP 12 1HB ASP 12 -15.257 48.119 14.020 89 H TYR 13 HN TYR 13 -15.640 45.428 17.398 90 HA TYR 13 HA TYR 13 -14.219 43.712 15.473 91 HB2 TYR 13 2HB TYR 13 -14.839 43.262 18.398 92 HB3 TYR 13 1HB TYR 13 -14.084 42.070 17.346 93 HD1 TYR 13 1HD TYR 13 -13.629 45.315 19.021 94 HD2 TYR 13 2HD TYR 13 -11.763 42.231 16.766 95 HE1 TYR 13 1HE TYR 13 -11.429 46.265 19.557 96 HE2 TYR 13 2HE TYR 13 -9.552 43.172 17.293 97 HH TYR 13 HH TYR 13 -8.557 45.277 17.966 98 HA PRO 14 HA PRO 14 -18.568 42.585 14.828 99 HB2 PRO 14 2HB PRO 14 -17.895 41.983 12.104 100 HB3 PRO 14 1HB PRO 14 -18.840 43.339 12.718 101 HG2 PRO 14 2HG PRO 14 -16.361 43.571 11.545 102 HG3 PRO 14 1HG PRO 14 -17.064 44.763 12.649 103 HD2 PRO 14 2HD PRO 14 -15.035 42.638 13.192 104 HD3 PRO 14 1HD PRO 14 -15.141 44.292 13.835 105 H SER 15 HN SER 15 -18.875 40.648 15.767 106 HA SER 15 HA SER 15 -17.430 38.300 14.962 107 HB2 SER 15 2HB SER 15 -19.269 37.233 16.492 108 HB3 SER 15 1HB SER 15 -18.013 38.240 17.217 109 HG SER 15 HG SER 15 -20.503 39.310 16.371 110 H PHE 16 HN PHE 16 -17.889 37.146 13.214 111 HA PHE 16 HA PHE 16 -20.676 36.982 12.312 112 HB2 PHE 16 2HB PHE 16 -19.995 37.258 9.987 113 HB3 PHE 16 1HB PHE 16 -19.493 38.660 10.922 114 HD1 PHE 16 2HD PHE 16 -17.090 38.919 11.548 115 HD2 PHE 16 1HD PHE 16 -18.425 35.900 8.856 116 HE1 PHE 16 2HE PHE 16 -14.787 38.630 10.729 117 HE2 PHE 16 1HE PHE 16 -16.126 35.605 8.039 118 HZ PHE 16 HZ PHE 16 -14.303 36.969 8.973 119 H ASP 17 HN ASP 17 -21.056 35.131 10.858 120 HA ASP 17 HA ASP 17 -19.017 33.055 10.912 121 HB2 ASP 17 2HB ASP 17 -20.313 31.407 11.963 122 HB3 ASP 17 1HB ASP 17 -20.621 32.836 12.940 123 H LYS 18 HN LYS 18 -19.094 31.718 9.172 124 HA LYS 18 HA LYS 18 -21.398 31.422 7.514 125 HB2 LYS 18 2HB LYS 18 -20.298 33.733 6.955 126 HB3 LYS 18 1HB LYS 18 -19.097 32.757 6.122 127 HG2 LYS 18 2HG LYS 18 -20.795 31.810 4.696 128 HG3 LYS 18 1HG LYS 18 -22.055 32.668 5.583 129 HD2 LYS 18 2HD LYS 18 -21.076 34.809 4.893 130 HD3 LYS 18 1HD LYS 18 -19.835 33.940 3.988 131 HE2 LYS 18 2HE LYS 18 -21.589 34.683 2.494 132 HE3 LYS 18 1HE LYS 18 -21.583 32.925 2.595 133 HZ1 LYS 18 3HZ LYS 18 -23.426 33.063 4.177 134 HZ2 LYS 18 1HZ LYS 18 -23.826 33.772 2.689 135 HZ3 LYS 18 2HZ LYS 18 -23.445 34.751 4.019 136 H PHE 19 HN PHE 19 -21.273 29.390 6.778 137 HA PHE 19 HA PHE 19 -19.106 27.965 5.857 138 HB2 PHE 19 2HB PHE 19 -18.104 28.430 8.091 139 HB3 PHE 19 1HB PHE 19 -19.485 27.676 8.858 140 HD1 PHE 19 2HD PHE 19 -16.487 27.075 6.811 141 HD2 PHE 19 1HD PHE 19 -19.653 25.310 9.040 142 HE1 PHE 19 2HE PHE 19 -15.327 24.907 6.740 143 HE2 PHE 19 1HE PHE 19 -18.496 23.143 8.975 144 HZ PHE 19 HZ PHE 19 -16.331 22.939 7.823 145 H LEU 20 HN LEU 20 -22.203 26.436 5.364 146 HA LEU 20 HA LEU 20 -21.177 26.388 3.432 147 HB2 LEU 20 2HB LEU 20 -19.959 28.847 4.619 148 HB3 LEU 20 1HB LEU 20 -19.695 28.332 2.976 149 HG LEU 20 HG LEU 20 -22.303 29.168 4.202 150 HD11 LEU 20 1HD1 LEU 20 -20.683 30.267 1.915 151 HD12 LEU 20 2HD1 LEU 20 -20.828 30.980 3.522 152 HD13 LEU 20 3HD1 LEU 20 -22.239 30.881 2.469 153 HD21 LEU 20 3HD2 LEU 20 -21.793 28.035 1.452 154 HD22 LEU 20 1HD2 LEU 20 -23.319 28.716 2.024 155 HD23 LEU 20 2HD2 LEU 20 -22.681 27.240 2.750 156 H GLY 21 HN GLY 21 -20.231 24.429 3.818 157 HA2 GLY 21 2HA GLY 21 -17.466 24.454 3.092 158 HA3 GLY 21 1HA GLY 21 -17.721 23.798 4.711 159 H THR 22 HN THR 22 -19.001 23.547 1.410 160 HA THR 22 HA THR 22 -19.610 20.713 1.920 161 HB THR 22 HB THR 22 -21.445 22.408 0.247 162 HG1 THR 22 1HG THR 22 -21.354 22.211 3.090 163 HG21 THR 22 3HG2 THR 22 -21.862 19.969 1.989 164 HG22 THR 22 1HG2 THR 22 -21.724 19.967 0.232 165 HG23 THR 22 2HG2 THR 22 -23.100 20.756 1.007 166 H GLU 23 HN GLU 23 -17.433 22.203 0.325 167 HA GLU 23 HA GLU 23 -18.006 21.461 -2.390 168 HB2 GLU 23 2HB GLU 23 -15.488 22.338 -0.997 169 HB3 GLU 23 1HB GLU 23 -15.477 21.797 -2.669 170 HG2 GLU 23 2HG GLU 23 -17.169 23.550 -3.180 171 HG3 GLU 23 1HG GLU 23 -16.977 24.144 -1.531 172 H ASN 24 HN ASN 24 -18.112 19.480 -3.071 173 HA ASN 24 HA ASN 24 -16.763 17.369 -1.525 174 HB2 ASN 24 2HB ASN 24 -19.150 17.177 -3.383 175 HB3 ASN 24 1HB ASN 24 -18.457 15.842 -2.471 176 HD21 ASN 24 1HD2 ASN 24 -21.140 16.999 -2.446 177 HD22 ASN 24 2HD2 ASN 24 -21.445 17.456 -0.803 178 H ALA 25 HN ALA 25 -16.294 19.143 -4.183 179 HA ALA 25 HA ALA 25 -15.844 17.331 -6.270 180 HB1 ALA 25 1HB ALA 25 -15.996 19.757 -6.584 181 HB2 ALA 25 2HB ALA 25 -14.528 19.096 -7.305 182 HB3 ALA 25 3HB ALA 25 -14.446 19.956 -5.768 183 H GLU 26 HN GLU 26 -13.848 18.240 -3.546 184 HA GLU 26 HA GLU 26 -11.413 17.205 -4.578 185 HB2 GLU 26 2HB GLU 26 -12.186 17.632 -1.690 186 HB3 GLU 26 1HB GLU 26 -10.555 17.448 -2.318 187 HG2 GLU 26 2HG GLU 26 -10.864 19.525 -3.616 188 HG3 GLU 26 1HG GLU 26 -12.447 19.718 -2.866 189 H LEU 27 HN LEU 27 -14.000 15.916 -2.599 190 HA LEU 27 HA LEU 27 -12.712 13.510 -1.876 191 HB2 LEU 27 2HB LEU 27 -14.518 14.355 -0.544 192 HB3 LEU 27 1HB LEU 27 -15.608 14.349 -1.916 193 HG LEU 27 HG LEU 27 -15.439 11.876 -1.968 194 HD11 LEU 27 1HD1 LEU 27 -13.308 11.594 -0.840 195 HD12 LEU 27 2HD1 LEU 27 -14.575 10.721 0.022 196 HD13 LEU 27 3HD1 LEU 27 -13.988 12.263 0.645 197 HD21 LEU 27 3HD2 LEU 27 -16.422 13.065 0.618 198 HD22 LEU 27 1HD2 LEU 27 -16.913 11.513 -0.060 199 HD23 LEU 27 2HD2 LEU 27 -17.317 13.011 -0.901 200 H VAL 28 HN VAL 28 -14.906 14.392 -4.510 201 HA VAL 28 HA VAL 28 -15.316 11.774 -5.493 202 HB VAL 28 HB VAL 28 -15.400 14.369 -7.046 203 HG11 VAL 28 1HG1 VAL 28 -16.893 13.166 -8.569 204 HG12 VAL 28 2HG1 VAL 28 -16.684 11.696 -7.618 205 HG13 VAL 28 3HG1 VAL 28 -15.313 12.385 -8.486 206 HG21 VAL 28 3HG2 VAL 28 -16.867 14.433 -5.093 207 HG22 VAL 28 1HG2 VAL 28 -17.604 12.911 -5.592 208 HG23 VAL 28 2HG2 VAL 28 -17.801 14.353 -6.587 209 H TYR 29 HN TYR 29 -12.825 14.167 -6.033 210 HA TYR 29 HA TYR 29 -11.557 12.938 -8.233 211 HB2 TYR 29 2HB TYR 29 -11.073 15.228 -7.761 212 HB3 TYR 29 1HB TYR 29 -10.583 14.857 -6.114 213 HD1 TYR 29 1HD TYR 29 -9.607 14.242 -9.667 214 HD2 TYR 29 2HD TYR 29 -8.334 14.537 -5.615 215 HE1 TYR 29 1HE TYR 29 -7.260 14.073 -10.391 216 HE2 TYR 29 2HE TYR 29 -5.992 14.374 -6.333 217 HH TYR 29 HH TYR 29 -4.720 13.483 -8.230 218 H VAL 30 HN VAL 30 -11.435 12.352 -4.810 219 HA VAL 30 HA VAL 30 -8.950 11.006 -4.701 220 HB VAL 30 HB VAL 30 -11.317 10.804 -2.828 221 HG11 VAL 30 1HG1 VAL 30 -9.663 10.048 -1.163 222 HG12 VAL 30 2HG1 VAL 30 -8.429 10.029 -2.422 223 HG13 VAL 30 3HG1 VAL 30 -9.800 8.928 -2.519 224 HG21 VAL 30 3HG2 VAL 30 -10.522 13.088 -3.029 225 HG22 VAL 30 1HG2 VAL 30 -8.864 12.561 -2.745 226 HG23 VAL 30 2HG2 VAL 30 -10.065 12.429 -1.461 227 H LEU 31 HN LEU 31 -12.208 9.921 -5.401 228 HA LEU 31 HA LEU 31 -11.970 7.199 -4.912 229 HB2 LEU 31 2HB LEU 31 -13.535 8.552 -7.111 230 HB3 LEU 31 1HB LEU 31 -13.786 6.910 -6.550 231 HG LEU 31 HG LEU 31 -14.209 9.414 -4.912 232 HD11 LEU 31 1HD1 LEU 31 -16.575 8.813 -5.038 233 HD12 LEU 31 2HD1 LEU 31 -16.179 7.469 -6.108 234 HD13 LEU 31 3HD1 LEU 31 -15.903 9.130 -6.636 235 HD21 LEU 31 3HD2 LEU 31 -15.163 7.901 -3.242 236 HD22 LEU 31 1HD2 LEU 31 -13.463 7.539 -3.539 237 HD23 LEU 31 2HD2 LEU 31 -14.718 6.516 -4.239 238 H ARG 32 HN ARG 32 -10.441 5.869 -5.633 239 HA ARG 32 HA ARG 32 -9.370 6.254 -8.352 240 HB2 ARG 32 2HB ARG 32 -7.993 6.467 -6.052 241 HB3 ARG 32 1HB ARG 32 -7.836 4.738 -6.307 242 HG2 ARG 32 2HG ARG 32 -6.708 5.055 -8.371 243 HG3 ARG 32 1HG ARG 32 -7.088 6.779 -8.387 244 HD2 ARG 32 2HD ARG 32 -5.736 7.023 -6.306 245 HD3 ARG 32 1HD ARG 32 -5.266 5.332 -6.467 246 HE ARG 32 HE ARG 32 -4.386 6.120 -8.758 247 HH11 ARG 32 1HH1 ARG 32 -4.389 8.057 -5.834 248 HH12 ARG 32 2HH1 ARG 32 -2.989 8.975 -6.287 249 HH21 ARG 32 1HH2 ARG 32 -2.513 7.318 -9.337 250 HH22 ARG 32 2HH2 ARG 32 -1.893 8.524 -8.244 251 H HIS 33 HN HIS 33 -7.990 3.859 -8.608 252 HA HIS 33 HA HIS 33 -10.194 1.907 -8.624 253 HB2 HIS 33 2HB HIS 33 -8.055 2.422 -10.684 254 HB3 HIS 33 1HB HIS 33 -8.985 0.927 -10.651 255 HD1 HIS 33 1HD HIS 33 -11.795 1.825 -10.244 256 HD2 HIS 33 2HD HIS 33 -9.136 3.941 -12.646 257 HE1 HIS 33 1HE HIS 33 -13.224 3.161 -11.824 258 HE2 HIS 33 2HE HIS 33 -11.604 4.502 -13.208 259 H LYS 34 HN LYS 34 -9.123 -0.432 -9.102 260 HA LYS 34 HA LYS 34 -7.200 -0.750 -6.891 261 HB2 LYS 34 2HB LYS 34 -9.404 -1.432 -6.178 262 HB3 LYS 34 1HB LYS 34 -9.583 -2.468 -7.583 263 HG2 LYS 34 2HG LYS 34 -7.856 -3.944 -6.772 264 HG3 LYS 34 1HG LYS 34 -7.537 -2.866 -5.413 265 HD2 LYS 34 2HD LYS 34 -8.926 -4.830 -4.805 266 HD3 LYS 34 1HD LYS 34 -9.726 -3.287 -4.496 267 HE2 LYS 34 2HE LYS 34 -11.044 -3.515 -6.501 268 HE3 LYS 34 1HE LYS 34 -10.158 -4.968 -6.964 269 HZ1 LYS 34 3HZ LYS 34 -11.694 -4.810 -4.434 270 HZ2 LYS 34 1HZ LYS 34 -11.130 -6.190 -5.243 271 HZ3 LYS 34 2HZ LYS 34 -12.410 -5.290 -5.892 272 H HIS 35 HN HIS 35 -8.564 -3.050 -9.260 273 HA HIS 35 HA HIS 35 -7.612 -4.548 -10.665 274 HB2 HIS 35 2HB HIS 35 -5.418 -2.499 -10.588 275 HB3 HIS 35 1HB HIS 35 -5.200 -4.014 -11.453 276 HD1 HIS 35 1HD HIS 35 -6.555 -0.653 -11.817 277 HD2 HIS 35 2HD HIS 35 -7.106 -4.359 -13.624 278 HE1 HIS 35 1HE HIS 35 -7.677 -0.179 -14.016 279 HE2 HIS 35 2HE HIS 35 -7.776 -2.411 -15.182 280 H GLY 36 HN GLY 36 -7.733 -5.858 -8.554 281 HA2 GLY 36 2HA GLY 36 -6.141 -7.874 -8.366 282 HA3 GLY 36 1HA GLY 36 -5.013 -6.679 -7.745 283 H GLN 37 HN GLN 37 -5.061 -8.312 -5.934 284 HA GLN 37 HA GLN 37 -7.047 -7.420 -3.950 285 HB2 GLN 37 2HB GLN 37 -7.471 -9.787 -4.829 286 HB3 GLN 37 1HB GLN 37 -5.964 -10.239 -4.039 287 HG2 GLN 37 2HG GLN 37 -6.919 -9.382 -1.900 288 HG3 GLN 37 1HG GLN 37 -8.451 -9.161 -2.740 289 HE21 GLN 37 1HE2 GLN 37 -6.249 -11.408 -1.351 290 HE22 GLN 37 2HE2 GLN 37 -7.256 -12.812 -1.475 291 H PHE 38 HN PHE 38 -3.998 -9.226 -4.340 292 HA PHE 38 HA PHE 38 -2.896 -7.789 -2.009 293 HB2 PHE 38 2HB PHE 38 -2.026 -10.355 -3.360 294 HB3 PHE 38 1HB PHE 38 -1.054 -9.525 -2.153 295 HD1 PHE 38 2HD PHE 38 -2.217 -9.084 0.131 296 HD2 PHE 38 1HD PHE 38 -3.516 -11.978 -2.703 297 HE1 PHE 38 2HE PHE 38 -3.391 -10.303 1.917 298 HE2 PHE 38 1HE PHE 38 -4.684 -13.206 -0.921 299 HZ PHE 38 HZ PHE 38 -4.621 -12.371 1.392 300 H ILE 39 HN ILE 39 -1.879 -5.972 -2.656 301 HA ILE 39 HA ILE 39 -0.220 -6.143 -5.087 302 HB ILE 39 HB ILE 39 -2.010 -3.835 -4.323 303 HG12 ILE 39 2HG1 ILE 39 -2.145 -5.748 -6.662 304 HG13 ILE 39 1HG1 ILE 39 -3.208 -5.784 -5.261 305 HG21 ILE 39 1HG2 ILE 39 0.061 -3.063 -5.337 306 HG22 ILE 39 2HG2 ILE 39 -1.292 -2.841 -6.446 307 HG23 ILE 39 3HG2 ILE 39 -0.165 -4.177 -6.686 308 HD11 ILE 39 3HD1 ILE 39 -4.010 -3.536 -5.854 309 HD12 ILE 39 1HD1 ILE 39 -4.319 -4.738 -7.109 310 HD13 ILE 39 2HD1 ILE 39 -2.997 -3.588 -7.296 311 H TYR 40 HN TYR 40 1.825 -5.767 -4.588 312 HA TYR 40 HA TYR 40 2.469 -3.706 -2.592 313 HB2 TYR 40 2HB TYR 40 3.556 -5.927 -2.297 314 HB3 TYR 40 1HB TYR 40 4.277 -5.764 -3.891 315 HD1 TYR 40 2HD TYR 40 5.991 -3.960 -4.278 316 HD2 TYR 40 1HD TYR 40 4.550 -4.926 -0.395 317 HE1 TYR 40 2HE TYR 40 7.940 -2.839 -3.280 318 HE2 TYR 40 1HE TYR 40 6.497 -3.814 0.608 319 HH TYR 40 HH TYR 40 8.678 -1.874 -1.224 320 H VAL 41 HN VAL 41 2.957 -1.772 -3.338 321 HA VAL 41 HA VAL 41 3.970 -1.541 -6.092 322 HB VAL 41 HB VAL 41 2.942 0.775 -6.087 323 HG11 VAL 41 1HG1 VAL 41 0.723 -0.038 -6.699 324 HG12 VAL 41 2HG1 VAL 41 1.053 -1.573 -5.896 325 HG13 VAL 41 3HG1 VAL 41 1.981 -1.106 -7.320 326 HG21 VAL 41 3HG2 VAL 41 1.097 1.203 -4.549 327 HG22 VAL 41 1HG2 VAL 41 2.603 0.973 -3.660 328 HG23 VAL 41 2HG2 VAL 41 1.409 -0.325 -3.723 329 H TRP 42 HN TRP 42 5.870 -0.586 -6.331 330 HA TRP 42 HA TRP 42 6.870 1.019 -4.084 331 HB2 TRP 42 2HB TRP 42 9.130 0.247 -4.561 332 HB3 TRP 42 1HB TRP 42 8.075 -1.128 -4.266 333 HD1 TRP 42 1HD TRP 42 7.502 -2.709 -6.389 334 HE1 TRP 42 1HE TRP 42 8.758 -3.083 -8.611 335 HE3 TRP 42 3HE TRP 42 10.528 1.405 -6.305 336 HZ2 TRP 42 2HZ TRP 42 10.770 -1.792 -10.118 337 HZ3 TRP 42 3HZ TRP 42 12.094 1.762 -8.172 338 HH2 TRP 42 2HH TRP 42 12.210 0.195 -10.039 339 H GLY 43 HN GLY 43 7.951 2.903 -4.553 340 HA2 GLY 43 2HA GLY 43 9.094 4.004 -6.623 341 HA3 GLY 43 1HA GLY 43 7.456 3.916 -7.257 342 H GLU 44 HN GLU 44 7.267 6.163 -7.400 343 HA GLU 44 HA GLU 44 6.953 7.508 -4.813 344 HB2 GLU 44 2HB GLU 44 8.366 8.594 -7.252 345 HB3 GLU 44 1HB GLU 44 7.897 9.577 -5.872 346 HG2 GLU 44 2HG GLU 44 9.345 8.294 -4.424 347 HG3 GLU 44 1HG GLU 44 9.761 7.219 -5.758 348 H GLU 45 HN GLU 45 4.897 8.015 -4.635 349 HA GLU 45 HA GLU 45 3.654 9.550 -6.788 350 HB2 GLU 45 2HB GLU 45 2.981 6.919 -6.541 351 HB3 GLU 45 1HB GLU 45 1.811 7.659 -5.458 352 HG2 GLU 45 2HG GLU 45 2.225 8.395 -8.349 353 HG3 GLU 45 1HG GLU 45 0.947 7.354 -7.731 354 H GLY 46 HN GLY 46 3.779 11.391 -5.588 355 HA2 GLY 46 2HA GLY 46 2.810 12.896 -4.062 356 HA3 GLY 46 1HA GLY 46 2.115 11.535 -3.193 357 H ALA 47 HN ALA 47 5.382 11.253 -4.044 358 HA ALA 47 HA ALA 47 7.348 11.294 -2.950 359 HB1 ALA 47 1HB ALA 47 7.832 13.099 -1.437 360 HB2 ALA 47 2HB ALA 47 6.112 13.416 -1.212 361 HB3 ALA 47 3HB ALA 47 6.865 13.705 -2.781 362 H GLY 48 HN GLY 48 5.494 12.128 -0.059 363 HA2 GLY 48 2HA GLY 48 6.230 9.483 1.038 364 HA3 GLY 48 1HA GLY 48 6.363 10.965 1.970 365 H LYS 49 HN LYS 49 3.659 11.143 0.024 366 HA LYS 49 HA LYS 49 1.952 10.255 2.245 367 HB2 LYS 49 2HB LYS 49 1.345 12.141 -0.039 368 HB3 LYS 49 1HB LYS 49 0.156 11.596 1.136 369 HG2 LYS 49 2HG LYS 49 1.770 12.558 2.894 370 HG3 LYS 49 1HG LYS 49 2.498 13.414 1.533 371 HD2 LYS 49 2HD LYS 49 0.281 14.352 0.980 372 HD3 LYS 49 1HD LYS 49 -0.389 13.552 2.401 373 HE2 LYS 49 2HE LYS 49 0.021 15.740 3.107 374 HE3 LYS 49 1HE LYS 49 1.388 14.816 3.730 375 HZ1 LYS 49 3HZ LYS 49 2.604 15.547 1.666 376 HZ2 LYS 49 1HZ LYS 49 2.261 16.772 2.792 377 HZ3 LYS 49 2HZ LYS 49 1.324 16.626 1.388 378 H SER 50 HN SER 50 0.464 8.711 1.985 379 HA SER 50 HA SER 50 0.728 6.906 -0.181 380 HB2 SER 50 2HB SER 50 -1.519 6.929 1.822 381 HB3 SER 50 1HB SER 50 -0.794 5.542 1.007 382 HG SER 50 HG SER 50 1.109 5.897 2.209 383 H HIS 51 HN HIS 51 0.214 8.548 -1.886 384 HA HIS 51 HA HIS 51 -2.368 9.595 -2.243 385 HB2 HIS 51 2HB HIS 51 -0.104 9.006 -4.126 386 HB3 HIS 51 1HB HIS 51 -1.661 9.528 -4.756 387 HD1 HIS 51 1HD HIS 51 -0.793 11.772 -5.604 388 HD2 HIS 51 2HD HIS 51 -0.169 11.190 -1.536 389 HE1 HIS 51 1HE HIS 51 -0.082 14.009 -4.703 390 HE2 HIS 51 2HE HIS 51 0.483 13.580 -2.282 391 H LEU 52 HN LEU 52 -0.957 6.513 -3.183 392 HA LEU 52 HA LEU 52 -3.254 5.632 -4.642 393 HB2 LEU 52 2HB LEU 52 -0.947 4.064 -3.478 394 HB3 LEU 52 1HB LEU 52 -2.132 3.428 -4.604 395 HG LEU 52 HG LEU 52 -0.243 5.695 -5.249 396 HD11 LEU 52 1HD1 LEU 52 1.010 4.055 -6.550 397 HD12 LEU 52 2HD1 LEU 52 -0.047 2.772 -5.962 398 HD13 LEU 52 3HD1 LEU 52 1.000 3.635 -4.837 399 HD21 LEU 52 3HD2 LEU 52 -2.012 3.989 -6.998 400 HD22 LEU 52 1HD2 LEU 52 -0.909 5.250 -7.550 401 HD23 LEU 52 2HD2 LEU 52 -2.307 5.673 -6.562 402 H LEU 53 HN LEU 53 -1.924 4.916 -1.439 403 HA LEU 53 HA LEU 53 -3.762 2.883 -0.826 404 HB2 LEU 53 2HB LEU 53 -2.009 4.565 0.949 405 HB3 LEU 53 1HB LEU 53 -2.990 3.244 1.549 406 HG LEU 53 HG LEU 53 -1.723 1.723 -0.025 407 HD11 LEU 53 1HD1 LEU 53 0.118 4.104 -0.229 408 HD12 LEU 53 2HD1 LEU 53 -0.851 3.435 -1.542 409 HD13 LEU 53 3HD1 LEU 53 0.450 2.479 -0.831 410 HD21 LEU 53 3HD2 LEU 53 -0.169 3.161 2.119 411 HD22 LEU 53 1HD2 LEU 53 0.227 1.579 1.448 412 HD23 LEU 53 2HD2 LEU 53 -1.267 1.800 2.360 413 H GLN 54 HN GLN 54 -3.752 6.331 0.035 414 HA GLN 54 HA GLN 54 -5.990 6.178 1.757 415 HB2 GLN 54 2HB GLN 54 -4.338 8.042 1.704 416 HB3 GLN 54 1HB GLN 54 -5.030 8.566 0.177 417 HG2 GLN 54 2HG GLN 54 -7.133 9.039 1.234 418 HG3 GLN 54 1HG GLN 54 -6.562 8.361 2.759 419 HE21 GLN 54 1HE2 GLN 54 -7.575 11.038 2.197 420 HE22 GLN 54 2HE2 GLN 54 -6.302 12.125 2.646 421 H ALA 55 HN ALA 55 -5.655 6.900 -1.680 422 HA ALA 55 HA ALA 55 -8.361 7.575 -2.155 423 HB1 ALA 55 1HB ALA 55 -7.804 7.318 -4.511 424 HB2 ALA 55 2HB ALA 55 -6.314 6.476 -4.084 425 HB3 ALA 55 3HB ALA 55 -6.520 8.177 -3.663 426 H TRP 56 HN TRP 56 -6.546 4.602 -2.332 427 HA TRP 56 HA TRP 56 -8.460 2.898 -3.459 428 HB2 TRP 56 2HB TRP 56 -6.043 2.432 -3.218 429 HB3 TRP 56 1HB TRP 56 -6.248 2.302 -1.479 430 HD1 TRP 56 1HD TRP 56 -7.704 0.521 -4.620 431 HE1 TRP 56 1HE TRP 56 -7.828 -1.994 -4.085 432 HE3 TRP 56 3HE TRP 56 -6.047 0.636 0.214 433 HZ2 TRP 56 2HZ TRP 56 -7.273 -3.707 -1.904 434 HZ3 TRP 56 3HZ TRP 56 -5.865 -1.479 1.453 435 HH2 TRP 56 2HH TRP 56 -6.467 -3.604 0.417 436 H VAL 57 HN VAL 57 -7.774 3.749 -0.095 437 HA VAL 57 HA VAL 57 -9.610 1.938 1.060 438 HB VAL 57 HB VAL 57 -8.248 4.405 2.120 439 HG11 VAL 57 1HG1 VAL 57 -9.017 3.780 4.361 440 HG12 VAL 57 2HG1 VAL 57 -10.035 2.520 3.659 441 HG13 VAL 57 3HG1 VAL 57 -10.369 4.218 3.317 442 HG21 VAL 57 3HG2 VAL 57 -7.910 1.446 2.545 443 HG22 VAL 57 1HG2 VAL 57 -7.092 2.673 3.508 444 HG23 VAL 57 2HG2 VAL 57 -6.779 2.562 1.777 445 H ALA 58 HN ALA 58 -9.883 5.410 0.294 446 HA ALA 58 HA ALA 58 -12.473 5.761 1.359 447 HB1 ALA 58 1HB ALA 58 -10.960 7.634 0.768 448 HB2 ALA 58 2HB ALA 58 -12.568 7.805 0.064 449 HB3 ALA 58 3HB ALA 58 -11.221 7.271 -0.941 450 H GLN 59 HN GLN 59 -11.390 4.638 -1.792 451 HA GLN 59 HA GLN 59 -13.942 4.632 -3.018 452 HB2 GLN 59 2HB GLN 59 -11.843 4.518 -4.290 453 HB3 GLN 59 1HB GLN 59 -11.514 2.931 -3.614 454 HG2 GLN 59 2HG GLN 59 -12.360 2.705 -5.851 455 HG3 GLN 59 1HG GLN 59 -13.534 2.057 -4.707 456 HE21 GLN 59 1HE2 GLN 59 -15.480 3.163 -4.381 457 HE22 GLN 59 2HE2 GLN 59 -16.039 4.379 -5.485 458 H ALA 60 HN ALA 60 -12.148 2.275 -1.130 459 HA ALA 60 HA ALA 60 -14.007 0.136 -1.496 460 HB1 ALA 60 1HB ALA 60 -11.900 0.504 0.633 461 HB2 ALA 60 2HB ALA 60 -11.656 -0.264 -0.936 462 HB3 ALA 60 3HB ALA 60 -12.739 -0.999 0.243 463 H LEU 61 HN LEU 61 -13.624 2.728 0.816 464 HA LEU 61 HA LEU 61 -15.325 1.832 2.839 465 HB2 LEU 61 2HB LEU 61 -14.652 4.602 1.871 466 HB3 LEU 61 1HB LEU 61 -15.665 4.323 3.270 467 HG LEU 61 HG LEU 61 -12.790 3.445 2.980 468 HD11 LEU 61 1HD1 LEU 61 -13.042 5.862 3.237 469 HD12 LEU 61 2HD1 LEU 61 -12.338 5.132 4.680 470 HD13 LEU 61 3HD1 LEU 61 -14.036 5.607 4.671 471 HD21 LEU 61 3HD2 LEU 61 -12.969 2.835 5.343 472 HD22 LEU 61 1HD2 LEU 61 -14.083 1.896 4.347 473 HD23 LEU 61 2HD2 LEU 61 -14.686 3.241 5.317 474 H GLU 62 HN GLU 62 -16.085 3.808 -0.025 475 HA GLU 62 HA GLU 62 -18.885 3.839 0.588 476 HB2 GLU 62 2HB GLU 62 -17.404 4.556 -1.940 477 HB3 GLU 62 1HB GLU 62 -19.142 4.757 -1.725 478 HG2 GLU 62 2HG GLU 62 -18.633 6.166 0.274 479 HG3 GLU 62 1HG GLU 62 -16.937 6.095 -0.205 480 H ALA 63 HN ALA 63 -16.845 1.546 -0.790 481 HA ALA 63 HA ALA 63 -18.851 0.168 -2.329 482 HB1 ALA 63 1HB ALA 63 -17.210 -1.651 -2.469 483 HB2 ALA 63 2HB ALA 63 -16.181 -0.807 -1.314 484 HB3 ALA 63 3HB ALA 63 -16.493 -0.095 -2.897 485 H GLY 64 HN GLY 64 -18.435 0.617 0.927 486 HA2 GLY 64 2HA GLY 64 -19.782 -0.226 2.619 487 HA3 GLY 64 1HA GLY 64 -20.397 -1.429 1.496 488 H LYS 65 HN LYS 65 -16.995 -1.115 1.742 489 HA LYS 65 HA LYS 65 -16.894 -3.615 3.287 490 HB2 LYS 65 2HB LYS 65 -14.801 -2.579 1.375 491 HB3 LYS 65 1HB LYS 65 -14.884 -4.172 2.101 492 HG2 LYS 65 2HG LYS 65 -16.945 -3.120 0.181 493 HG3 LYS 65 1HG LYS 65 -15.539 -4.067 -0.310 494 HD2 LYS 65 2HD LYS 65 -16.277 -5.940 1.009 495 HD3 LYS 65 1HD LYS 65 -17.608 -4.993 1.679 496 HE2 LYS 65 2HE LYS 65 -17.306 -5.490 -1.267 497 HE3 LYS 65 1HE LYS 65 -18.170 -6.599 -0.210 498 HZ1 LYS 65 3HZ LYS 65 -19.679 -5.055 -1.266 499 HZ2 LYS 65 1HZ LYS 65 -18.835 -3.731 -0.624 500 HZ3 LYS 65 2HZ LYS 65 -19.659 -4.797 0.407 501 H ASN 66 HN ASN 66 -15.123 -3.795 4.780 502 HA ASN 66 HA ASN 66 -14.598 -1.291 6.107 503 HB2 ASN 66 2HB ASN 66 -14.954 -3.609 7.226 504 HB3 ASN 66 1HB ASN 66 -13.266 -3.889 6.835 505 HD21 ASN 66 1HD2 ASN 66 -12.855 -4.013 9.099 506 HD22 ASN 66 2HD2 ASN 66 -12.701 -2.567 10.049 507 H ALA 67 HN ALA 67 -12.750 -0.140 6.069 508 HA ALA 67 HA ALA 67 -10.431 -1.190 4.657 509 HB1 ALA 67 1HB ALA 67 -11.901 1.262 3.687 510 HB2 ALA 67 2HB ALA 67 -11.874 -0.308 2.881 511 HB3 ALA 67 3HB ALA 67 -10.389 0.627 3.042 512 H ALA 68 HN ALA 68 -8.574 -0.358 5.366 513 HA ALA 68 HA ALA 68 -8.534 2.248 6.668 514 HB1 ALA 68 1HB ALA 68 -9.062 0.734 8.518 515 HB2 ALA 68 2HB ALA 68 -7.447 1.422 8.698 516 HB3 ALA 68 3HB ALA 68 -7.643 -0.238 8.132 517 H TYR 69 HN TYR 69 -6.648 3.299 6.252 518 HA TYR 69 HA TYR 69 -4.423 1.683 5.228 519 HB2 TYR 69 2HB TYR 69 -3.694 3.539 3.914 520 HB3 TYR 69 1HB TYR 69 -5.406 3.349 3.614 521 HD1 TYR 69 2HD TYR 69 -7.005 4.930 4.877 522 HD2 TYR 69 1HD TYR 69 -2.815 5.581 4.574 523 HE1 TYR 69 2HE TYR 69 -7.341 7.312 5.407 524 HE2 TYR 69 1HE TYR 69 -3.137 7.957 5.099 525 HH TYR 69 HH TYR 69 -4.941 9.648 4.934 526 H ILE 70 HN ILE 70 -2.649 1.607 6.397 527 HA ILE 70 HA ILE 70 -2.281 3.627 8.511 528 HB ILE 70 HB ILE 70 -1.598 0.682 8.638 529 HG12 ILE 70 2HG1 ILE 70 -3.608 2.313 10.211 530 HG13 ILE 70 1HG1 ILE 70 -4.007 1.200 8.909 531 HG21 ILE 70 1HG2 ILE 70 0.072 2.078 9.774 532 HG22 ILE 70 2HG2 ILE 70 -0.860 1.110 10.915 533 HG23 ILE 70 3HG2 ILE 70 -1.214 2.827 10.724 534 HD11 ILE 70 3HD1 ILE 70 -4.409 0.205 11.083 535 HD12 ILE 70 1HD1 ILE 70 -2.720 0.459 11.521 536 HD13 ILE 70 2HD1 ILE 70 -3.133 -0.656 10.219 537 H ASP 71 HN ASP 71 -0.559 4.827 8.125 538 HA ASP 71 HA ASP 71 1.583 3.832 6.451 539 HB2 ASP 71 2HB ASP 71 2.436 6.107 6.466 540 HB3 ASP 71 1HB ASP 71 0.717 6.142 6.093 541 H ALA 72 HN ALA 72 3.280 2.918 7.273 542 HA ALA 72 HA ALA 72 3.548 2.593 10.099 543 HB1 ALA 72 1HB ALA 72 5.401 1.740 7.877 544 HB2 ALA 72 2HB ALA 72 4.077 0.788 8.548 545 HB3 ALA 72 3HB ALA 72 5.468 1.194 9.551 546 H ALA 73 HN ALA 73 4.373 5.105 8.169 547 HA ALA 73 HA ALA 73 6.967 5.664 9.294 548 HB1 ALA 73 1HB ALA 73 6.459 6.280 6.981 549 HB2 ALA 73 2HB ALA 73 6.920 7.682 7.947 550 HB3 ALA 73 3HB ALA 73 5.223 7.397 7.556 551 H SER 74 HN SER 74 3.680 6.947 9.616 552 HA SER 74 HA SER 74 4.647 8.474 11.944 553 HB2 SER 74 2HB SER 74 3.761 9.851 10.061 554 HB3 SER 74 1HB SER 74 2.204 9.043 10.245 555 HG SER 74 HG SER 74 2.712 9.842 12.625 556 H MET 75 HN MET 75 2.620 5.903 10.926 557 HA MET 75 HA MET 75 1.216 6.013 13.518 558 HB2 MET 75 2HB MET 75 0.119 5.133 10.847 559 HB3 MET 75 1HB MET 75 -0.687 4.805 12.371 560 HG2 MET 75 2HG MET 75 -0.589 7.341 12.739 561 HG3 MET 75 1HG MET 75 -0.223 7.436 11.019 562 HE1 MET 75 3HE MET 75 -3.449 5.714 9.497 563 HE2 MET 75 1HE MET 75 -1.937 4.933 9.958 564 HE3 MET 75 2HE MET 75 -1.909 6.480 9.110 565 HA PRO 76 HA PRO 76 2.640 1.808 13.974 566 HB2 PRO 76 2HB PRO 76 1.412 1.214 16.269 567 HB3 PRO 76 1HB PRO 76 2.720 2.400 16.218 568 HG2 PRO 76 2HG PRO 76 -0.223 2.832 16.393 569 HG3 PRO 76 1HG PRO 76 1.091 3.734 17.167 570 HD2 PRO 76 2HD PRO 76 -0.269 4.490 14.842 571 HD3 PRO 76 1HD PRO 76 1.289 5.140 15.389 572 H LEU 77 HN LEU 77 1.738 -0.375 14.110 573 HA LEU 77 HA LEU 77 -0.764 -0.552 12.641 574 HB2 LEU 77 2HB LEU 77 1.262 -1.836 11.954 575 HB3 LEU 77 1HB LEU 77 1.151 -2.745 13.448 576 HG LEU 77 HG LEU 77 -1.049 -3.617 12.734 577 HD11 LEU 77 1HD1 LEU 77 -1.807 -3.292 10.455 578 HD12 LEU 77 2HD1 LEU 77 -0.446 -2.217 10.133 579 HD13 LEU 77 3HD1 LEU 77 -1.692 -1.743 11.288 580 HD21 LEU 77 3HD2 LEU 77 -0.194 -5.114 11.007 581 HD22 LEU 77 1HD2 LEU 77 0.991 -4.877 12.290 582 HD23 LEU 77 2HD2 LEU 77 1.181 -4.040 10.749 583 H THR 78 HN THR 78 -2.582 -1.676 13.373 584 HA THR 78 HA THR 78 -2.615 -2.261 16.249 585 HB THR 78 HB THR 78 -5.032 -1.491 16.175 586 HG1 THR 78 1HG THR 78 -5.004 0.229 14.263 587 HG21 THR 78 3HG2 THR 78 -4.468 0.877 16.385 588 HG22 THR 78 1HG2 THR 78 -2.924 0.592 15.581 589 HG23 THR 78 2HG2 THR 78 -3.240 -0.124 17.162 590 H ASP 79 HN ASP 79 -4.223 -3.821 16.911 591 HA ASP 79 HA ASP 79 -4.374 -6.055 15.152 592 HB2 ASP 79 2HB ASP 79 -5.499 -7.195 16.968 593 HB3 ASP 79 1HB ASP 79 -4.153 -6.273 17.620 594 H ALA 80 HN ALA 80 -6.322 -3.326 15.663 595 HA ALA 80 HA ALA 80 -8.864 -4.251 14.956 596 HB1 ALA 80 1HB ALA 80 -9.339 -1.951 14.303 597 HB2 ALA 80 2HB ALA 80 -7.615 -1.580 14.317 598 HB3 ALA 80 3HB ALA 80 -8.440 -2.000 15.818 599 H ALA 81 HN ALA 81 -6.003 -3.830 13.073 600 HA ALA 81 HA ALA 81 -7.083 -3.439 10.519 601 HB1 ALA 81 1HB ALA 81 -4.713 -3.124 11.098 602 HB2 ALA 81 2HB ALA 81 -4.934 -4.148 9.680 603 HB3 ALA 81 3HB ALA 81 -4.534 -4.873 11.236 604 H PHE 82 HN PHE 82 -7.043 -6.266 12.504 605 HA PHE 82 HA PHE 82 -7.238 -8.219 10.454 606 HB2 PHE 82 2HB PHE 82 -7.986 -8.199 13.367 607 HB3 PHE 82 1HB PHE 82 -8.366 -9.574 12.340 608 HD1 PHE 82 1HD PHE 82 -6.529 -10.845 11.264 609 HD2 PHE 82 2HD PHE 82 -5.794 -7.850 14.190 610 HE1 PHE 82 1HE PHE 82 -4.282 -11.773 11.643 611 HE2 PHE 82 2HE PHE 82 -3.544 -8.767 14.572 612 HZ PHE 82 HZ PHE 82 -2.784 -10.734 13.299 613 H GLU 83 HN GLU 83 -9.467 -5.942 11.749 614 HA GLU 83 HA GLU 83 -11.822 -7.373 10.877 615 HB2 GLU 83 2HB GLU 83 -11.536 -4.554 11.894 616 HB3 GLU 83 1HB GLU 83 -13.038 -5.434 11.684 617 HG2 GLU 83 2HG GLU 83 -12.273 -7.067 13.358 618 HG3 GLU 83 1HG GLU 83 -10.836 -6.082 13.612 619 H ALA 84 HN ALA 84 -9.628 -5.022 9.677 620 HA ALA 84 HA ALA 84 -11.436 -4.027 7.647 621 HB1 ALA 84 1HB ALA 84 -9.850 -2.494 8.722 622 HB2 ALA 84 2HB ALA 84 -9.588 -2.585 6.980 623 HB3 ALA 84 3HB ALA 84 -8.507 -3.443 8.079 624 H GLU 85 HN GLU 85 -11.844 -5.288 5.947 625 HA GLU 85 HA GLU 85 -9.996 -7.303 5.097 626 HB2 GLU 85 2HB GLU 85 -12.506 -7.435 4.884 627 HB3 GLU 85 1HB GLU 85 -12.378 -6.309 3.545 628 HG2 GLU 85 2HG GLU 85 -11.104 -7.838 2.255 629 HG3 GLU 85 1HG GLU 85 -10.897 -8.921 3.628 630 H TYR 86 HN TYR 86 -10.777 -4.058 4.111 631 HA TYR 86 HA TYR 86 -8.753 -4.190 1.997 632 HB2 TYR 86 2HB TYR 86 -10.936 -2.255 2.669 633 HB3 TYR 86 1HB TYR 86 -9.526 -1.668 1.799 634 HD1 TYR 86 1HD TYR 86 -12.419 -3.968 1.617 635 HD2 TYR 86 2HD TYR 86 -9.182 -2.183 -0.484 636 HE1 TYR 86 1HE TYR 86 -13.388 -4.726 -0.518 637 HE2 TYR 86 2HE TYR 86 -10.141 -2.923 -2.616 638 HH TYR 86 HH TYR 86 -13.282 -4.008 -2.954 639 H LEU 87 HN LEU 87 -6.854 -4.282 3.119 640 HA LEU 87 HA LEU 87 -6.373 -2.108 5.046 641 HB2 LEU 87 2HB LEU 87 -6.316 -4.408 5.984 642 HB3 LEU 87 1HB LEU 87 -5.006 -4.789 4.885 643 HG LEU 87 HG LEU 87 -3.615 -3.053 5.979 644 HD11 LEU 87 1HD1 LEU 87 -4.333 -2.120 8.117 645 HD12 LEU 87 2HD1 LEU 87 -5.906 -2.897 7.934 646 HD13 LEU 87 3HD1 LEU 87 -5.413 -1.629 6.811 647 HD21 LEU 87 3HD2 LEU 87 -3.418 -5.382 6.643 648 HD22 LEU 87 1HD2 LEU 87 -4.730 -5.179 7.806 649 HD23 LEU 87 2HD2 LEU 87 -3.206 -4.321 8.036 650 H ALA 88 HN ALA 88 -4.743 -0.758 4.701 651 HA ALA 88 HA ALA 88 -2.842 -1.386 2.545 652 HB1 ALA 88 1HB ALA 88 -4.450 0.272 1.765 653 HB2 ALA 88 2HB ALA 88 -2.843 0.983 1.918 654 HB3 ALA 88 3HB ALA 88 -4.071 1.303 3.143 655 H VAL 89 HN VAL 89 -0.773 -1.282 3.132 656 HA VAL 89 HA VAL 89 -0.115 0.144 5.627 657 HB VAL 89 HB VAL 89 1.169 -2.412 4.636 658 HG11 VAL 89 1HG1 VAL 89 2.312 -2.407 6.821 659 HG12 VAL 89 2HG1 VAL 89 1.622 -0.819 7.158 660 HG13 VAL 89 3HG1 VAL 89 2.756 -1.021 5.823 661 HG21 VAL 89 3HG2 VAL 89 -1.074 -2.846 5.466 662 HG22 VAL 89 1HG2 VAL 89 -0.718 -1.962 6.949 663 HG23 VAL 89 2HG2 VAL 89 0.126 -3.470 6.598 664 H ASP 90 HN ASP 90 1.171 1.782 5.281 665 HA ASP 90 HA ASP 90 2.714 1.891 2.785 666 HB2 ASP 90 2HB ASP 90 1.030 3.696 3.371 667 HB3 ASP 90 1HB ASP 90 2.101 4.159 4.688 668 H GLN 91 HN GLN 91 4.876 1.847 2.803 669 HA GLN 91 HA GLN 91 7.024 1.697 3.520 670 HB2 GLN 91 2HB GLN 91 5.928 3.777 5.401 671 HB3 GLN 91 1HB GLN 91 7.620 3.305 5.427 672 HG2 GLN 91 2HG GLN 91 7.984 4.111 3.245 673 HG3 GLN 91 1HG GLN 91 6.256 4.273 2.933 674 HE21 GLN 91 1HE2 GLN 91 5.143 6.007 3.754 675 HE22 GLN 91 2HE2 GLN 91 5.944 7.404 4.410 676 H VAL 92 HN VAL 92 5.878 -0.481 4.193 677 HA VAL 92 HA VAL 92 5.328 -1.096 6.845 678 HB VAL 92 HB VAL 92 4.684 -2.516 4.946 679 HG11 VAL 92 1HG1 VAL 92 6.286 -4.069 3.951 680 HG12 VAL 92 2HG1 VAL 92 7.587 -3.304 4.862 681 HG13 VAL 92 3HG1 VAL 92 6.716 -2.390 3.629 682 HG21 VAL 92 3HG2 VAL 92 6.319 -3.948 7.038 683 HG22 VAL 92 1HG2 VAL 92 5.102 -4.701 6.008 684 HG23 VAL 92 2HG2 VAL 92 4.627 -3.471 7.181 685 H GLU 93 HN GLU 93 8.415 -0.713 5.313 686 HA GLU 93 HA GLU 93 9.883 -2.371 7.112 687 HB2 GLU 93 2HB GLU 93 11.880 -1.303 6.102 688 HB3 GLU 93 1HB GLU 93 10.769 -1.978 4.918 689 HG2 GLU 93 2HG GLU 93 10.193 0.053 4.085 690 HG3 GLU 93 1HG GLU 93 10.443 0.880 5.622 691 H LYS 94 HN LYS 94 8.476 0.669 7.543 692 HA LYS 94 HA LYS 94 10.587 1.722 9.222 693 HB2 LYS 94 2HB LYS 94 7.837 2.885 8.994 694 HB3 LYS 94 1HB LYS 94 9.336 3.694 9.373 695 HG2 LYS 94 2HG LYS 94 8.572 2.543 6.732 696 HG3 LYS 94 1HG LYS 94 8.475 4.241 7.191 697 HD2 LYS 94 2HD LYS 94 10.939 4.166 7.622 698 HD3 LYS 94 1HD LYS 94 10.939 2.554 6.877 699 HE2 LYS 94 2HE LYS 94 9.719 3.578 4.967 700 HE3 LYS 94 1HE LYS 94 10.066 5.142 5.679 701 HZ1 LYS 94 3HZ LYS 94 12.114 3.161 4.824 702 HZ2 LYS 94 1HZ LYS 94 12.425 4.713 5.440 703 HZ3 LYS 94 2HZ LYS 94 11.656 4.534 3.935 704 H LEU 95 HN LEU 95 8.041 -0.430 9.603 705 HA LEU 95 HA LEU 95 7.087 0.181 12.175 706 HB2 LEU 95 2HB LEU 95 7.333 -2.461 10.739 707 HB3 LEU 95 1HB LEU 95 6.514 -2.265 12.275 708 HG LEU 95 HG LEU 95 5.717 -0.910 9.698 709 HD11 LEU 95 1HD1 LEU 95 4.471 -3.226 11.173 710 HD12 LEU 95 2HD1 LEU 95 5.304 -3.304 9.621 711 HD13 LEU 95 3HD1 LEU 95 3.787 -2.417 9.763 712 HD21 LEU 95 3HD2 LEU 95 5.169 0.413 11.677 713 HD22 LEU 95 1HD2 LEU 95 4.356 -0.980 12.390 714 HD23 LEU 95 2HD2 LEU 95 3.717 -0.241 10.921 715 H GLY 96 HN GLY 96 7.740 -0.397 14.207 716 HA2 GLY 96 2HA GLY 96 10.532 -0.518 14.611 717 HA3 GLY 96 1HA GLY 96 9.305 -0.687 15.854 718 H ASN 97 HN ASN 97 8.274 -2.856 16.029 719 HA ASN 97 HA ASN 97 9.878 -5.082 15.091 720 HB2 ASN 97 2HB ASN 97 11.174 -4.303 17.035 721 HB3 ASN 97 1HB ASN 97 9.738 -4.435 18.046 722 HD21 ASN 97 1HD2 ASN 97 9.061 -6.443 18.738 723 HD22 ASN 97 2HD2 ASN 97 10.008 -7.873 18.531 724 H GLU 98 HN GLU 98 7.569 -4.260 17.684 725 HA GLU 98 HA GLU 98 6.235 -6.737 17.649 726 HB2 GLU 98 2HB GLU 98 5.225 -4.029 18.535 727 HB3 GLU 98 1HB GLU 98 4.478 -5.569 18.934 728 HG2 GLU 98 2HG GLU 98 6.435 -6.232 20.194 729 HG3 GLU 98 1HG GLU 98 7.265 -4.749 19.727 730 H GLU 99 HN GLU 99 5.743 -3.761 15.872 731 HA GLU 99 HA GLU 99 3.193 -4.392 14.820 732 HB2 GLU 99 2HB GLU 99 5.220 -2.644 13.445 733 HB3 GLU 99 1HB GLU 99 3.470 -2.529 13.384 734 HG2 GLU 99 2HG GLU 99 3.844 -0.831 14.814 735 HG3 GLU 99 1HG GLU 99 3.818 -2.138 15.996 736 H GLN 100 HN GLN 100 6.467 -5.150 13.823 737 HA GLN 100 HA GLN 100 5.824 -6.077 11.220 738 HB2 GLN 100 2HB GLN 100 8.155 -6.755 13.025 739 HB3 GLN 100 1HB GLN 100 8.019 -7.274 11.350 740 HG2 GLN 100 2HG GLN 100 7.887 -4.857 10.710 741 HG3 GLN 100 1HG GLN 100 8.275 -4.459 12.383 742 HE21 GLN 100 1HE2 GLN 100 10.203 -3.450 11.826 743 HE22 GLN 100 2HE2 GLN 100 11.591 -4.334 11.282 744 H ALA 101 HN ALA 101 5.999 -7.617 14.386 745 HA ALA 101 HA ALA 101 5.475 -10.262 13.478 746 HB1 ALA 101 1HB ALA 101 5.024 -10.769 15.827 747 HB2 ALA 101 2HB ALA 101 4.996 -9.045 16.200 748 HB3 ALA 101 3HB ALA 101 6.493 -9.806 15.661 749 H LEU 102 HN LEU 102 3.473 -7.570 14.501 750 HA LEU 102 HA LEU 102 0.994 -8.934 14.510 751 HB2 LEU 102 2HB LEU 102 1.393 -6.736 15.576 752 HB3 LEU 102 1HB LEU 102 1.554 -6.011 13.992 753 HG LEU 102 HG LEU 102 -0.781 -6.513 13.489 754 HD11 LEU 102 1HD1 LEU 102 -0.897 -7.634 16.287 755 HD12 LEU 102 2HD1 LEU 102 -1.000 -8.570 14.796 756 HD13 LEU 102 3HD1 LEU 102 -2.268 -7.410 15.200 757 HD21 LEU 102 3HD2 LEU 102 -0.367 -5.134 16.138 758 HD22 LEU 102 1HD2 LEU 102 -1.813 -5.000 15.135 759 HD23 LEU 102 2HD2 LEU 102 -0.268 -4.394 14.541 760 H LEU 103 HN LEU 103 2.615 -6.932 12.067 761 HA LEU 103 HA LEU 103 0.753 -7.209 10.000 762 HB2 LEU 103 2HB LEU 103 2.784 -5.688 10.107 763 HB3 LEU 103 1HB LEU 103 3.751 -7.071 9.656 764 HG LEU 103 HG LEU 103 3.160 -5.437 7.815 765 HD11 LEU 103 1HD1 LEU 103 4.015 -7.659 7.324 766 HD12 LEU 103 2HD1 LEU 103 2.806 -7.165 6.138 767 HD13 LEU 103 3HD1 LEU 103 2.380 -8.316 7.405 768 HD21 LEU 103 3HD2 LEU 103 0.460 -6.733 8.127 769 HD22 LEU 103 1HD2 LEU 103 0.959 -5.740 6.756 770 HD23 LEU 103 2HD2 LEU 103 0.849 -5.028 8.368 771 H PHE 104 HN PHE 104 3.551 -9.205 10.840 772 HA PHE 104 HA PHE 104 3.417 -11.149 8.887 773 HB2 PHE 104 2HB PHE 104 5.200 -11.061 10.550 774 HB3 PHE 104 1HB PHE 104 4.064 -11.466 11.828 775 HD1 PHE 104 2HD PHE 104 5.545 -12.797 8.688 776 HD2 PHE 104 1HD PHE 104 3.707 -13.671 12.425 777 HE1 PHE 104 2HE PHE 104 6.018 -15.186 8.358 778 HE2 PHE 104 1HE PHE 104 4.176 -16.066 12.101 779 HZ PHE 104 HZ PHE 104 5.335 -16.828 10.064 780 H SER 105 HN SER 105 1.637 -10.995 11.935 781 HA SER 105 HA SER 105 0.257 -13.422 11.656 782 HB2 SER 105 2HB SER 105 -0.566 -10.938 13.175 783 HB3 SER 105 1HB SER 105 -1.131 -12.579 13.463 784 HG SER 105 HG SER 105 1.497 -11.564 13.824 785 H ILE 106 HN ILE 106 -0.564 -10.096 10.745 786 HA ILE 106 HA ILE 106 -3.187 -10.630 9.839 787 HB ILE 106 HB ILE 106 -1.291 -8.450 8.938 788 HG12 ILE 106 2HG1 ILE 106 -3.439 -8.406 11.071 789 HG13 ILE 106 1HG1 ILE 106 -1.711 -8.480 11.383 790 HG21 ILE 106 1HG2 ILE 106 -3.336 -7.243 8.286 791 HG22 ILE 106 2HG2 ILE 106 -4.290 -8.670 8.692 792 HG23 ILE 106 3HG2 ILE 106 -3.123 -8.737 7.373 793 HD11 ILE 106 3HD1 ILE 106 -1.433 -6.298 10.315 794 HD12 ILE 106 1HD1 ILE 106 -2.544 -6.234 11.683 795 HD13 ILE 106 2HD1 ILE 106 -3.173 -6.228 10.036 796 H PHE 107 HN PHE 107 -0.061 -10.511 8.188 797 HA PHE 107 HA PHE 107 -0.998 -10.955 5.575 798 HB2 PHE 107 2HB PHE 107 1.432 -10.414 6.681 799 HB3 PHE 107 1HB PHE 107 1.633 -12.110 6.256 800 HD1 PHE 107 2HD PHE 107 0.616 -12.631 3.781 801 HD2 PHE 107 1HD PHE 107 2.173 -8.916 5.144 802 HE1 PHE 107 2HE PHE 107 1.066 -11.974 1.455 803 HE2 PHE 107 1HE PHE 107 2.623 -8.250 2.819 804 HZ PHE 107 HZ PHE 107 2.069 -9.778 0.974 805 H ASN 108 HN ASN 108 0.051 -13.171 8.124 806 HA ASN 108 HA ASN 108 -0.191 -15.579 6.711 807 HB2 ASN 108 2HB ASN 108 0.828 -15.360 8.979 808 HB3 ASN 108 1HB ASN 108 -0.784 -15.128 9.647 809 HD21 ASN 108 1HD2 ASN 108 -0.793 -16.941 10.907 810 HD22 ASN 108 2HD2 ASN 108 -0.816 -18.549 10.260 811 H ARG 109 HN ARG 109 -2.567 -13.896 8.768 812 HA ARG 109 HA ARG 109 -4.697 -15.651 8.449 813 HB2 ARG 109 2HB ARG 109 -4.699 -13.858 10.108 814 HB3 ARG 109 1HB ARG 109 -4.745 -12.647 8.838 815 HG2 ARG 109 2HG ARG 109 -6.939 -14.667 9.045 816 HG3 ARG 109 1HG ARG 109 -6.912 -13.273 10.125 817 HD2 ARG 109 2HD ARG 109 -6.937 -11.761 8.250 818 HD3 ARG 109 1HD ARG 109 -6.794 -13.103 7.117 819 HE ARG 109 HE ARG 109 -9.124 -13.203 8.835 820 HH11 ARG 109 1HH1 ARG 109 -7.790 -12.131 5.779 821 HH12 ARG 109 2HH1 ARG 109 -9.334 -11.966 5.011 822 HH21 ARG 109 1HH2 ARG 109 -11.173 -12.992 7.820 823 HH22 ARG 109 2HH2 ARG 109 -11.262 -12.439 6.169 824 H PHE 110 HN PHE 110 -3.829 -12.828 6.471 825 HA PHE 110 HA PHE 110 -6.052 -12.899 4.767 826 HB2 PHE 110 2HB PHE 110 -3.286 -11.784 4.529 827 HB3 PHE 110 1HB PHE 110 -4.333 -11.802 3.112 828 HD1 PHE 110 2HD PHE 110 -5.649 -11.336 6.519 829 HD2 PHE 110 1HD PHE 110 -4.433 -9.416 2.913 830 HE1 PHE 110 2HE PHE 110 -6.720 -9.251 7.267 831 HE2 PHE 110 1HE PHE 110 -5.504 -7.333 3.659 832 HZ PHE 110 HZ PHE 110 -6.651 -7.248 5.838 833 H ARG 111 HN ARG 111 -2.797 -14.297 4.224 834 HA ARG 111 HA ARG 111 -3.624 -15.461 1.750 835 HB2 ARG 111 2HB ARG 111 -1.257 -14.825 2.300 836 HB3 ARG 111 1HB ARG 111 -1.194 -16.211 3.382 837 HG2 ARG 111 2HG ARG 111 -0.189 -16.656 1.172 838 HG3 ARG 111 1HG ARG 111 -1.543 -17.727 1.540 839 HD2 ARG 111 2HD ARG 111 -3.018 -16.200 0.231 840 HD3 ARG 111 1HD ARG 111 -1.581 -15.297 -0.241 841 HE ARG 111 HE ARG 111 -0.936 -17.058 -1.624 842 HH11 ARG 111 1HH1 ARG 111 -3.788 -17.925 0.222 843 HH12 ARG 111 2HH1 ARG 111 -4.295 -19.154 -0.897 844 HH21 ARG 111 1HH2 ARG 111 -1.597 -18.690 -3.096 845 HH22 ARG 111 2HH2 ARG 111 -3.041 -19.597 -2.763 846 H ASN 112 HN ASN 112 -3.574 -16.519 5.061 847 HA ASN 112 HA ASN 112 -3.833 -19.301 4.668 848 HB2 ASN 112 2HB ASN 112 -3.661 -17.623 6.852 849 HB3 ASN 112 1HB ASN 112 -5.315 -18.210 6.955 850 HD21 ASN 112 1HD2 ASN 112 -1.984 -18.982 7.274 851 HD22 ASN 112 2HD2 ASN 112 -2.197 -20.590 7.875 852 H SER 113 HN SER 113 -6.211 -16.712 5.026 853 HA SER 113 HA SER 113 -8.468 -18.457 4.682 854 HB2 SER 113 2HB SER 113 -8.517 -16.344 6.031 855 HB3 SER 113 1HB SER 113 -8.358 -15.432 4.533 856 HG SER 113 HG SER 113 -10.348 -17.102 4.160 857 H GLY 114 HN GLY 114 -6.569 -16.280 2.671 858 HA2 GLY 114 2HA GLY 114 -6.280 -16.797 0.331 859 HA3 GLY 114 1HA GLY 114 -7.928 -17.413 0.309 860 H LYS 115 HN LYS 115 -8.851 -15.121 1.933 861 HA LYS 115 HA LYS 115 -9.026 -13.201 -0.267 862 HB2 LYS 115 2HB LYS 115 -11.111 -14.349 0.628 863 HB3 LYS 115 1HB LYS 115 -10.869 -13.462 2.121 864 HG2 LYS 115 2HG LYS 115 -11.148 -11.363 0.949 865 HG3 LYS 115 1HG LYS 115 -11.299 -12.221 -0.587 866 HD2 LYS 115 2HD LYS 115 -13.333 -13.307 0.228 867 HD3 LYS 115 1HD LYS 115 -13.170 -12.469 1.775 868 HE2 LYS 115 2HE LYS 115 -13.258 -10.312 0.489 869 HE3 LYS 115 1HE LYS 115 -13.684 -11.261 -0.935 870 HZ1 LYS 115 3HZ LYS 115 -15.653 -12.043 0.195 871 HZ2 LYS 115 1HZ LYS 115 -15.627 -10.348 0.197 872 HZ3 LYS 115 2HZ LYS 115 -15.226 -11.198 1.602 873 H GLY 116 HN GLY 116 -9.467 -10.926 0.637 874 HA2 GLY 116 2HA GLY 116 -8.939 -9.425 2.545 875 HA3 GLY 116 1HA GLY 116 -7.485 -10.395 2.758 876 H PHE 117 HN PHE 117 -8.471 -7.533 1.714 877 HA PHE 117 HA PHE 117 -6.817 -7.452 -0.700 878 HB2 PHE 117 2HB PHE 117 -8.711 -5.381 0.431 879 HB3 PHE 117 1HB PHE 117 -7.881 -5.284 -1.119 880 HD1 PHE 117 2HD PHE 117 -10.517 -7.013 0.775 881 HD2 PHE 117 1HD PHE 117 -8.688 -6.474 -3.031 882 HE1 PHE 117 2HE PHE 117 -12.398 -8.184 -0.291 883 HE2 PHE 117 1HE PHE 117 -10.572 -7.640 -4.102 884 HZ PHE 117 HZ PHE 117 -12.428 -8.496 -2.732 885 H LEU 118 HN LEU 118 -4.800 -6.811 -0.489 886 HA LEU 118 HA LEU 118 -4.143 -4.996 1.733 887 HB2 LEU 118 2HB LEU 118 -3.437 -7.452 1.998 888 HB3 LEU 118 1HB LEU 118 -2.299 -7.115 0.711 889 HG LEU 118 HG LEU 118 -1.246 -5.369 2.088 890 HD11 LEU 118 1HD1 LEU 118 -3.132 -6.334 4.233 891 HD12 LEU 118 2HD1 LEU 118 -3.149 -4.748 3.464 892 HD13 LEU 118 3HD1 LEU 118 -1.782 -5.226 4.472 893 HD21 LEU 118 3HD2 LEU 118 -1.432 -8.093 3.365 894 HD22 LEU 118 1HD2 LEU 118 -0.182 -6.894 3.691 895 HD23 LEU 118 2HD2 LEU 118 -0.323 -7.603 2.083 896 H LEU 119 HN LEU 119 -3.029 -3.296 1.202 897 HA LEU 119 HA LEU 119 -1.683 -3.194 -1.412 898 HB2 LEU 119 2HB LEU 119 -3.765 -1.856 -1.414 899 HB3 LEU 119 1HB LEU 119 -3.157 -0.933 -0.053 900 HG LEU 119 HG LEU 119 -1.326 -0.074 -1.441 901 HD11 LEU 119 1HD1 LEU 119 -2.656 -1.571 -3.695 902 HD12 LEU 119 2HD1 LEU 119 -1.119 -2.003 -2.945 903 HD13 LEU 119 3HD1 LEU 119 -1.272 -0.484 -3.827 904 HD21 LEU 119 3HD2 LEU 119 -4.042 0.277 -2.701 905 HD22 LEU 119 1HD2 LEU 119 -2.663 1.362 -2.885 906 HD23 LEU 119 2HD2 LEU 119 -3.427 1.165 -1.306 907 H LEU 120 HN LEU 120 0.396 -3.197 -1.030 908 HA LEU 120 HA LEU 120 1.405 -1.838 1.376 909 HB2 LEU 120 2HB LEU 120 2.697 -4.006 -0.281 910 HB3 LEU 120 1HB LEU 120 3.370 -3.287 1.170 911 HG LEU 120 HG LEU 120 0.815 -4.890 1.070 912 HD11 LEU 120 1HD1 LEU 120 2.754 -6.280 0.597 913 HD12 LEU 120 2HD1 LEU 120 2.103 -6.630 2.199 914 HD13 LEU 120 3HD1 LEU 120 3.565 -5.657 2.034 915 HD21 LEU 120 3HD2 LEU 120 2.412 -3.811 3.391 916 HD22 LEU 120 1HD2 LEU 120 1.011 -4.878 3.517 917 HD23 LEU 120 2HD2 LEU 120 0.826 -3.250 2.863 918 H GLY 121 HN GLY 121 2.321 0.051 1.022 919 HA2 GLY 121 2HA GLY 121 3.646 0.496 -1.581 920 HA3 GLY 121 1HA GLY 121 2.922 1.769 -0.605 921 H SER 122 HN SER 122 5.697 1.404 -1.633 922 HA SER 122 HA SER 122 7.010 2.358 0.706 923 HB2 SER 122 2HB SER 122 7.101 -0.080 1.167 924 HB3 SER 122 1HB SER 122 7.939 -0.324 -0.362 925 HG SER 122 HG SER 122 9.015 1.515 1.475 926 H GLU 123 HN GLU 123 9.268 2.946 0.260 927 HA GLU 123 HA GLU 123 9.539 3.874 -2.465 928 HB2 GLU 123 2HB GLU 123 11.463 5.127 -1.628 929 HB3 GLU 123 1HB GLU 123 10.063 5.384 -0.598 930 HG2 GLU 123 2HG GLU 123 12.098 3.307 0.094 931 HG3 GLU 123 1HG GLU 123 12.384 5.002 0.463 932 H TYR 124 HN TYR 124 10.654 1.275 -0.515 933 HA TYR 124 HA TYR 124 12.783 0.654 -2.450 934 HB2 TYR 124 2HB TYR 124 12.377 -0.360 0.372 935 HB3 TYR 124 1HB TYR 124 13.644 -0.910 -0.717 936 HD1 TYR 124 1HD TYR 124 15.237 0.942 -1.639 937 HD2 TYR 124 2HD TYR 124 12.803 1.396 1.820 938 HE1 TYR 124 1HE TYR 124 16.718 2.741 -0.845 939 HE2 TYR 124 2HE TYR 124 14.273 3.192 2.628 940 HH TYR 124 HH TYR 124 16.530 4.000 2.354 941 H THR 125 HN THR 125 13.121 -1.878 -2.477 942 HA THR 125 HA THR 125 10.545 -3.025 -3.267 943 HB THR 125 HB THR 125 12.043 -4.756 -4.394 944 HG1 THR 125 1HG THR 125 14.217 -3.469 -4.771 945 HG21 THR 125 3HG2 THR 125 10.968 -2.968 -5.661 946 HG22 THR 125 1HG2 THR 125 12.589 -3.276 -6.280 947 HG23 THR 125 2HG2 THR 125 12.290 -1.871 -5.259 948 HA PRO 126 HA PRO 126 10.490 -5.827 0.116 949 HB2 PRO 126 2HB PRO 126 9.292 -8.005 -0.949 950 HB3 PRO 126 1HB PRO 126 8.431 -6.492 -0.664 951 HG2 PRO 126 2HG PRO 126 9.589 -7.553 -3.207 952 HG3 PRO 126 1HG PRO 126 8.021 -6.770 -2.934 953 HD2 PRO 126 2HD PRO 126 10.163 -5.457 -3.959 954 HD3 PRO 126 1HD PRO 126 8.932 -4.657 -2.962 955 H GLN 127 HN GLN 127 12.186 -6.557 -2.690 956 HA GLN 127 HA GLN 127 13.166 -9.155 -2.004 957 HB2 GLN 127 2HB GLN 127 14.130 -7.167 -4.072 958 HB3 GLN 127 1HB GLN 127 14.585 -8.864 -3.991 959 HG2 GLN 127 2HG GLN 127 12.382 -9.569 -4.521 960 HG3 GLN 127 1HG GLN 127 11.751 -7.935 -4.328 961 HE21 GLN 127 1HE2 GLN 127 13.612 -10.066 -6.354 962 HE22 GLN 127 2HE2 GLN 127 13.554 -9.082 -7.783 963 H GLN 128 HN GLN 128 13.953 -6.002 -1.047 964 HA GLN 128 HA GLN 128 16.392 -6.975 0.208 965 HB2 GLN 128 2HB GLN 128 17.637 -4.928 -0.520 966 HB3 GLN 128 1HB GLN 128 17.280 -6.064 -1.814 967 HG2 GLN 128 2HG GLN 128 15.324 -4.645 -2.413 968 HG3 GLN 128 1HG GLN 128 15.886 -3.467 -1.228 969 HE21 GLN 128 1HE2 GLN 128 16.219 -1.895 -2.798 970 HE22 GLN 128 2HE2 GLN 128 17.530 -1.974 -3.918 971 H LEU 129 HN LEU 129 13.615 -6.012 0.961 972 HA LEU 129 HA LEU 129 13.946 -3.640 2.488 973 HB2 LEU 129 2HB LEU 129 12.020 -5.949 2.719 974 HB3 LEU 129 1HB LEU 129 11.968 -4.569 3.791 975 HG LEU 129 HG LEU 129 11.558 -4.501 0.804 976 HD11 LEU 129 1HD1 LEU 129 9.623 -4.125 3.086 977 HD12 LEU 129 2HD1 LEU 129 9.698 -5.517 2.007 978 HD13 LEU 129 3HD1 LEU 129 9.253 -3.933 1.372 979 HD21 LEU 129 3HD2 LEU 129 11.400 -2.297 2.859 980 HD22 LEU 129 1HD2 LEU 129 10.928 -2.153 1.164 981 HD23 LEU 129 2HD2 LEU 129 12.613 -2.455 1.590 982 H VAL 130 HN VAL 130 14.800 -3.330 4.477 983 HA VAL 130 HA VAL 130 16.105 -5.608 5.729 984 HB VAL 130 HB VAL 130 16.168 -2.745 6.680 985 HG11 VAL 130 1HG1 VAL 130 18.281 -3.430 7.739 986 HG12 VAL 130 2HG1 VAL 130 18.037 -5.072 7.144 987 HG13 VAL 130 3HG1 VAL 130 16.916 -4.385 8.316 988 HG21 VAL 130 3HG2 VAL 130 16.909 -2.833 4.359 989 HG22 VAL 130 1HG2 VAL 130 18.048 -4.117 4.759 990 HG23 VAL 130 2HG2 VAL 130 18.264 -2.505 5.439 991 H ILE 131 HN ILE 131 14.113 -6.632 6.281 992 HA ILE 131 HA ILE 131 13.060 -5.754 8.871 993 HB ILE 131 HB ILE 131 10.765 -6.461 8.195 994 HG12 ILE 131 2HG1 ILE 131 11.895 -6.357 5.388 995 HG13 ILE 131 1HG1 ILE 131 11.423 -7.825 6.243 996 HG21 ILE 131 1HG2 ILE 131 11.914 -4.159 6.629 997 HG22 ILE 131 2HG2 ILE 131 11.369 -4.103 8.304 998 HG23 ILE 131 3HG2 ILE 131 10.210 -4.399 7.007 999 HD11 ILE 131 3HD1 ILE 131 9.580 -5.562 5.490 1000 HD12 ILE 131 1HD1 ILE 131 9.118 -7.059 6.300 1001 HD13 ILE 131 2HD1 ILE 131 9.728 -7.104 4.646 1002 H ARG 132 HN ARG 132 11.403 -7.721 9.515 1003 HA ARG 132 HA ARG 132 12.923 -10.041 9.870 1004 HB2 ARG 132 2HB ARG 132 9.924 -9.689 9.839 1005 HB3 ARG 132 1HB ARG 132 10.746 -11.133 10.410 1006 HG2 ARG 132 2HG ARG 132 11.123 -8.386 11.583 1007 HG3 ARG 132 1HG ARG 132 10.024 -9.611 12.220 1008 HD2 ARG 132 2HD ARG 132 11.879 -11.115 12.629 1009 HD3 ARG 132 1HD ARG 132 13.002 -9.970 11.897 1010 HE ARG 132 HE ARG 132 12.492 -8.461 13.766 1011 HH11 ARG 132 1HH1 ARG 132 11.707 -11.869 14.120 1012 HH12 ARG 132 2HH1 ARG 132 11.805 -11.825 15.857 1013 HH21 ARG 132 1HH2 ARG 132 12.679 -8.438 16.039 1014 HH22 ARG 132 2HH2 ARG 132 12.395 -9.898 16.939 1015 H GLU 133 HN GLU 133 13.378 -11.726 8.587 1016 HA GLU 133 HA GLU 133 12.648 -11.643 5.835 1017 HB2 GLU 133 2HB GLU 133 13.834 -13.859 5.721 1018 HB3 GLU 133 1HB GLU 133 14.797 -12.524 6.338 1019 HG2 GLU 133 2HG GLU 133 14.452 -13.315 8.614 1020 HG3 GLU 133 1HG GLU 133 13.458 -14.639 8.009 1021 H ASP 134 HN ASP 134 11.343 -13.096 8.646 1022 HA ASP 134 HA ASP 134 9.677 -15.049 7.546 1023 HB2 ASP 134 2HB ASP 134 9.198 -13.165 9.867 1024 HB3 ASP 134 1HB ASP 134 8.158 -14.532 9.480 1025 H LEU 135 HN LEU 135 9.430 -11.559 7.624 1026 HA LEU 135 HA LEU 135 6.794 -11.515 6.465 1027 HB2 LEU 135 2HB LEU 135 8.815 -9.444 7.208 1028 HB3 LEU 135 1HB LEU 135 7.490 -9.014 6.143 1029 HG LEU 135 HG LEU 135 7.186 -10.152 8.918 1030 HD11 LEU 135 1HD1 LEU 135 6.345 -7.921 9.486 1031 HD12 LEU 135 2HD1 LEU 135 6.764 -7.359 7.866 1032 HD13 LEU 135 3HD1 LEU 135 8.035 -7.876 8.976 1033 HD21 LEU 135 3HD2 LEU 135 5.173 -9.149 6.917 1034 HD22 LEU 135 1HD2 LEU 135 4.816 -9.588 8.589 1035 HD23 LEU 135 2HD2 LEU 135 5.379 -10.815 7.454 1036 H ARG 136 HN ARG 136 10.101 -10.921 5.383 1037 HA ARG 136 HA ARG 136 9.667 -10.094 2.790 1038 HB2 ARG 136 2HB ARG 136 11.875 -10.130 3.775 1039 HB3 ARG 136 1HB ARG 136 11.842 -11.884 3.879 1040 HG2 ARG 136 2HG ARG 136 11.797 -12.011 1.425 1041 HG3 ARG 136 1HG ARG 136 11.901 -10.251 1.350 1042 HD2 ARG 136 2HD ARG 136 14.052 -10.276 2.415 1043 HD3 ARG 136 1HD ARG 136 13.932 -12.009 2.711 1044 HE ARG 136 HE ARG 136 13.706 -11.660 -0.031 1045 HH11 ARG 136 1HH1 ARG 136 16.088 -11.102 2.479 1046 HH12 ARG 136 2HH1 ARG 136 17.443 -11.276 1.405 1047 HH21 ARG 136 1HH2 ARG 136 15.500 -11.906 -1.445 1048 HH22 ARG 136 2HH2 ARG 136 17.114 -11.753 -0.815 1049 H THR 137 HN THR 137 9.736 -13.413 4.031 1050 HA THR 137 HA THR 137 9.496 -14.672 1.514 1051 HB THR 137 HB THR 137 8.672 -16.645 2.907 1052 HG1 THR 137 1HG THR 137 9.619 -15.360 5.185 1053 HG21 THR 137 3HG2 THR 137 10.893 -17.039 3.882 1054 HG22 THR 137 1HG2 THR 137 11.298 -15.341 3.629 1055 HG23 THR 137 2HG2 THR 137 11.006 -16.394 2.245 1056 H ARG 138 HN ARG 138 7.111 -13.400 3.773 1057 HA ARG 138 HA ARG 138 4.864 -14.628 2.491 1058 HB2 ARG 138 2HB ARG 138 4.823 -12.196 4.273 1059 HB3 ARG 138 1HB ARG 138 3.520 -13.343 3.986 1060 HG2 ARG 138 2HG ARG 138 6.112 -13.967 5.374 1061 HG3 ARG 138 1HG ARG 138 4.579 -13.640 6.171 1062 HD2 ARG 138 2HD ARG 138 3.594 -15.610 5.247 1063 HD3 ARG 138 1HD ARG 138 4.985 -15.872 4.194 1064 HE ARG 138 HE ARG 138 6.179 -16.008 6.537 1065 HH11 ARG 138 1HH1 ARG 138 3.100 -17.373 5.594 1066 HH12 ARG 138 2HH1 ARG 138 3.204 -18.713 6.689 1067 HH21 ARG 138 1HH2 ARG 138 6.342 -17.778 7.977 1068 HH22 ARG 138 2HH2 ARG 138 5.055 -18.950 8.037 1069 H MET 139 HN MET 139 6.720 -11.763 2.010 1070 HA MET 139 HA MET 139 4.816 -10.208 0.628 1071 HB2 MET 139 2HB MET 139 7.832 -10.207 0.440 1072 HB3 MET 139 1HB MET 139 6.783 -8.962 -0.221 1073 HG2 MET 139 2HG MET 139 6.957 -9.696 2.693 1074 HG3 MET 139 1HG MET 139 7.787 -8.336 1.946 1075 HE1 MET 139 3HE MET 139 4.976 -6.636 4.098 1076 HE2 MET 139 1HE MET 139 6.710 -6.722 3.775 1077 HE3 MET 139 2HE MET 139 5.878 -8.098 4.498 1078 H ALA 140 HN ALA 140 6.582 -12.991 -0.252 1079 HA ALA 140 HA ALA 140 6.487 -12.612 -3.092 1080 HB1 ALA 140 1HB ALA 140 8.182 -14.030 -2.042 1081 HB2 ALA 140 2HB ALA 140 7.228 -14.925 -3.225 1082 HB3 ALA 140 3HB ALA 140 6.919 -15.137 -1.500 1083 H TYR 141 HN TYR 141 4.125 -13.247 -0.832 1084 HA TYR 141 HA TYR 141 2.460 -14.814 -2.656 1085 HB2 TYR 141 2HB TYR 141 2.016 -13.928 0.206 1086 HB3 TYR 141 1HB TYR 141 0.885 -14.892 -0.729 1087 HD1 TYR 141 2HD TYR 141 4.214 -14.885 0.853 1088 HD2 TYR 141 1HD TYR 141 1.205 -17.245 -1.002 1089 HE1 TYR 141 2HE TYR 141 5.363 -16.919 1.604 1090 HE2 TYR 141 1HE TYR 141 2.350 -19.290 -0.255 1091 HH TYR 141 HH TYR 141 4.983 -19.200 2.005 1092 H CYS 142 HN CYS 142 3.321 -11.821 -2.621 1093 HA CYS 142 HA CYS 142 0.645 -10.705 -3.068 1094 HB2 CYS 142 2HB CYS 142 1.719 -9.849 -0.979 1095 HB3 CYS 142 1HB CYS 142 3.072 -9.276 -1.942 1096 HG CYS 142 HG CYS 142 1.987 -6.931 -1.811 1097 H LEU 143 HN LEU 143 0.551 -9.128 -4.758 1098 HA LEU 143 HA LEU 143 2.338 -9.715 -6.925 1099 HB2 LEU 143 2HB LEU 143 -0.140 -8.120 -6.605 1100 HB3 LEU 143 1HB LEU 143 0.924 -7.697 -7.932 1101 HG LEU 143 HG LEU 143 -0.109 -10.477 -7.491 1102 HD11 LEU 143 1HD1 LEU 143 -1.207 -8.325 -9.291 1103 HD12 LEU 143 2HD1 LEU 143 -2.000 -8.978 -7.858 1104 HD13 LEU 143 3HD1 LEU 143 -1.734 -10.008 -9.263 1105 HD21 LEU 143 3HD2 LEU 143 1.161 -9.128 -9.860 1106 HD22 LEU 143 1HD2 LEU 143 0.526 -10.774 -9.842 1107 HD23 LEU 143 2HD2 LEU 143 1.906 -10.350 -8.829 1108 H VAL 144 HN VAL 144 3.329 -8.038 -8.218 1109 HA VAL 144 HA VAL 144 4.363 -5.823 -6.574 1110 HB VAL 144 HB VAL 144 6.053 -7.578 -8.369 1111 HG11 VAL 144 1HG1 VAL 144 6.803 -5.257 -8.383 1112 HG12 VAL 144 2HG1 VAL 144 7.947 -6.270 -7.503 1113 HG13 VAL 144 3HG1 VAL 144 6.823 -5.239 -6.618 1114 HG21 VAL 144 3HG2 VAL 144 5.458 -8.703 -6.275 1115 HG22 VAL 144 1HG2 VAL 144 6.055 -7.318 -5.360 1116 HG23 VAL 144 2HG2 VAL 144 7.172 -8.293 -6.316 1117 H TYR 145 HN TYR 145 3.820 -3.992 -7.521 1118 HA TYR 145 HA TYR 145 4.011 -3.841 -10.459 1119 HB2 TYR 145 2HB TYR 145 2.136 -2.394 -8.585 1120 HB3 TYR 145 1HB TYR 145 2.350 -1.948 -10.271 1121 HD1 TYR 145 1HD TYR 145 1.052 -4.500 -7.977 1122 HD2 TYR 145 2HD TYR 145 1.364 -3.257 -12.028 1123 HE1 TYR 145 1HE TYR 145 -0.699 -6.108 -8.598 1124 HE2 TYR 145 2HE TYR 145 -0.383 -4.865 -12.665 1125 HH TYR 145 HH TYR 145 -2.323 -6.477 -10.358 1126 H GLU 146 HN GLU 146 5.606 -2.592 -11.164 1127 HA GLU 146 HA GLU 146 6.945 -0.782 -9.361 1128 HB2 GLU 146 2HB GLU 146 8.400 -0.294 -11.363 1129 HB3 GLU 146 1HB GLU 146 8.390 -1.967 -10.832 1130 HG2 GLU 146 2HG GLU 146 6.846 -2.537 -12.637 1131 HG3 GLU 146 1HG GLU 146 6.853 -0.855 -13.169 1132 H VAL 147 HN VAL 147 6.174 1.147 -8.950 1133 HA VAL 147 HA VAL 147 4.361 2.459 -10.790 1134 HB VAL 147 HB VAL 147 5.431 3.422 -8.128 1135 HG11 VAL 147 1HG1 VAL 147 3.528 4.958 -8.137 1136 HG12 VAL 147 2HG1 VAL 147 3.066 4.384 -9.738 1137 HG13 VAL 147 3HG1 VAL 147 4.589 5.244 -9.516 1138 HG21 VAL 147 3HG2 VAL 147 2.827 2.024 -8.748 1139 HG22 VAL 147 1HG2 VAL 147 3.314 2.660 -7.177 1140 HG23 VAL 147 2HG2 VAL 147 4.203 1.318 -7.900 1141 H LYS 148 HN LYS 148 7.642 2.759 -9.627 1142 HA LYS 148 HA LYS 148 8.062 5.017 -11.463 1143 HB2 LYS 148 2HB LYS 148 8.469 5.684 -9.154 1144 HB3 LYS 148 1HB LYS 148 9.550 4.315 -8.923 1145 HG2 LYS 148 2HG LYS 148 10.983 5.292 -10.750 1146 HG3 LYS 148 1HG LYS 148 9.980 6.739 -10.640 1147 HD2 LYS 148 2HD LYS 148 10.598 7.041 -8.328 1148 HD3 LYS 148 1HD LYS 148 11.497 5.520 -8.338 1149 HE2 LYS 148 2HE LYS 148 12.124 8.006 -9.925 1150 HE3 LYS 148 1HE LYS 148 13.037 7.361 -8.561 1151 HZ1 LYS 148 3HZ LYS 148 14.125 6.757 -10.592 1152 HZ2 LYS 148 1HZ LYS 148 12.703 6.089 -11.224 1153 HZ3 LYS 148 2HZ LYS 148 13.466 5.353 -9.907 1154 HA PRO 149 HA PRO 149 10.867 2.236 -13.592 1155 HB2 PRO 149 2HB PRO 149 11.776 4.641 -14.989 1156 HB3 PRO 149 1HB PRO 149 10.947 3.224 -15.638 1157 HG2 PRO 149 2HG PRO 149 9.756 5.641 -15.454 1158 HG3 PRO 149 1HG PRO 149 8.859 4.120 -15.284 1159 HD2 PRO 149 2HD PRO 149 9.849 5.986 -13.157 1160 HD3 PRO 149 1HD PRO 149 8.291 5.140 -13.276 Start of MODEL 15 1 H1 MET 1 H1 MET 1 -48.386 -5.535 12.303 2 H2 MET 1 H2 MET 1 -47.712 -3.984 12.170 3 H3 MET 1 H3 MET 1 -49.296 -4.171 12.747 4 HA MET 1 HA MET 1 -47.759 -3.704 14.545 5 HB2 MET 1 2HB MET 1 -48.921 -6.495 14.473 6 HB3 MET 1 1HB MET 1 -48.250 -5.764 15.925 7 HG2 MET 1 2HG MET 1 -49.914 -3.972 15.783 8 HG3 MET 1 1HG MET 1 -50.591 -4.728 14.342 9 HE1 MET 1 2HE MET 1 -52.985 -4.692 15.457 10 HE2 MET 1 3HE MET 1 -52.337 -3.965 16.927 11 HE3 MET 1 1HE MET 1 -53.356 -5.401 17.029 12 H GLY 2 HN GLY 2 -45.997 -4.468 15.878 13 HA2 GLY 2 2HA GLY 2 -44.061 -5.731 16.281 14 HA3 GLY 2 1HA GLY 2 -44.290 -6.545 14.739 15 H HIS 3 HN HIS 3 -42.346 -6.257 13.809 16 HA HIS 3 HA HIS 3 -40.672 -5.262 12.662 17 HB2 HIS 3 2HB HIS 3 -42.545 -2.899 12.744 18 HB3 HIS 3 1HB HIS 3 -40.991 -2.856 11.919 19 HD1 HIS 3 1HD HIS 3 -41.432 -3.021 9.497 20 HD2 HIS 3 2HD HIS 3 -43.888 -5.556 11.704 21 HE1 HIS 3 1HE HIS 3 -42.775 -4.315 7.804 22 HE2 HIS 3 2HE HIS 3 -44.155 -5.937 9.162 23 H HIS 4 HN HIS 4 -38.986 -5.338 13.997 24 HA HIS 4 HA HIS 4 -38.665 -3.137 15.924 25 HB2 HIS 4 2HB HIS 4 -37.497 -5.918 15.875 26 HB3 HIS 4 1HB HIS 4 -36.888 -4.650 16.936 27 HD1 HIS 4 1HD HIS 4 -39.873 -6.860 16.384 28 HD2 HIS 4 2HD HIS 4 -38.493 -4.041 19.120 29 HE1 HIS 4 1HE HIS 4 -41.437 -6.998 18.355 30 HE2 HIS 4 2HE HIS 4 -40.504 -5.381 20.051 31 H HIS 5 HN HIS 5 -37.156 -1.682 15.620 32 HA HIS 5 HA HIS 5 -35.368 -2.089 13.321 33 HB2 HIS 5 2HB HIS 5 -37.074 -0.331 13.015 34 HB3 HIS 5 1HB HIS 5 -36.469 0.496 14.445 35 HD1 HIS 5 1HD HIS 5 -35.597 -0.249 10.868 36 HD2 HIS 5 2HD HIS 5 -34.169 2.015 14.058 37 HE1 HIS 5 1HE HIS 5 -33.830 1.264 9.899 38 HE2 HIS 5 2HE HIS 5 -33.119 2.749 11.811 39 H HIS 6 HN HIS 6 -33.533 -2.816 14.248 40 HA HIS 6 HA HIS 6 -32.233 -0.965 16.123 41 HB2 HIS 6 2HB HIS 6 -30.775 -2.974 16.756 42 HB3 HIS 6 1HB HIS 6 -32.426 -2.962 17.357 43 HD1 HIS 6 1HD HIS 6 -30.074 -4.890 15.233 44 HD2 HIS 6 2HD HIS 6 -34.142 -4.872 16.132 45 HE1 HIS 6 1HE HIS 6 -30.962 -7.111 14.448 46 HE2 HIS 6 2HE HIS 6 -33.403 -7.114 15.078 47 H HIS 7 HN HIS 7 -30.614 0.105 15.341 48 HA HIS 7 HA HIS 7 -29.658 -0.563 12.661 49 HB2 HIS 7 2HB HIS 7 -30.551 1.721 13.337 50 HB3 HIS 7 1HB HIS 7 -29.085 1.915 14.288 51 HD1 HIS 7 1HD HIS 7 -27.157 2.933 13.106 52 HD2 HIS 7 2HD HIS 7 -29.971 1.364 10.475 53 HE1 HIS 7 1HE HIS 7 -26.406 3.628 10.805 54 HE2 HIS 7 2HE HIS 7 -28.230 2.840 9.257 55 H HIS 8 HN HIS 8 -27.553 -1.050 12.188 56 HA HIS 8 HA HIS 8 -25.911 -1.952 14.367 57 HB2 HIS 8 2HB HIS 8 -26.158 -2.849 11.863 58 HB3 HIS 8 1HB HIS 8 -24.811 -1.749 11.599 59 HD1 HIS 8 1HD HIS 8 -24.937 -5.036 11.641 60 HD2 HIS 8 2HD HIS 8 -23.168 -2.470 14.398 61 HE1 HIS 8 1HE HIS 8 -23.214 -6.412 12.843 62 HE2 HIS 8 2HE HIS 8 -22.329 -4.903 14.657 63 H SER 9 HN SER 9 -25.695 0.573 11.906 64 HA SER 9 HA SER 9 -24.914 2.692 12.019 65 HB2 SER 9 2HB SER 9 -24.232 2.034 14.891 66 HB3 SER 9 1HB SER 9 -24.113 3.639 14.167 67 HG SER 9 HG SER 9 -26.096 3.465 15.204 68 H HIS 10 HN HIS 10 -22.991 3.880 11.828 69 HA HIS 10 HA HIS 10 -20.504 2.327 11.978 70 HB2 HIS 10 2HB HIS 10 -21.335 2.236 9.650 71 HB3 HIS 10 1HB HIS 10 -21.409 3.991 9.608 72 HD1 HIS 10 1HD HIS 10 -19.008 1.120 9.423 73 HD2 HIS 10 2HD HIS 10 -18.972 5.274 9.166 74 HE1 HIS 10 1HE HIS 10 -16.747 1.729 8.510 75 HE2 HIS 10 2HE HIS 10 -16.853 4.220 8.129 76 H MET 11 HN MET 11 -20.366 3.638 13.960 77 HA MET 11 HA MET 11 -20.021 6.503 13.568 78 HB2 MET 11 2HB MET 11 -20.129 4.763 16.026 79 HB3 MET 11 1HB MET 11 -19.626 6.444 16.103 80 HG2 MET 11 2HG MET 11 -21.792 7.102 15.115 81 HG3 MET 11 1HG MET 11 -22.287 5.410 15.164 82 HE1 MET 11 3HE MET 11 -24.377 7.138 18.031 83 HE2 MET 11 1HE MET 11 -24.473 6.155 16.569 84 HE3 MET 11 2HE MET 11 -23.909 7.822 16.476 85 H ASP 12 HN ASP 12 -18.149 6.244 12.234 86 HA ASP 12 HA ASP 12 -15.799 6.799 13.742 87 HB2 ASP 12 2HB ASP 12 -15.803 4.252 13.678 88 HB3 ASP 12 1HB ASP 12 -15.616 4.378 11.932 89 H TYR 13 HN TYR 13 -15.013 8.481 12.652 90 HA TYR 13 HA TYR 13 -14.999 8.461 9.751 91 HB2 TYR 13 2HB TYR 13 -16.129 10.781 9.775 92 HB3 TYR 13 1HB TYR 13 -17.146 9.357 9.941 93 HD1 TYR 13 2HD TYR 13 -18.127 8.785 12.142 94 HD2 TYR 13 1HD TYR 13 -15.961 12.400 11.545 95 HE1 TYR 13 2HE TYR 13 -19.106 9.705 14.198 96 HE2 TYR 13 1HE TYR 13 -16.934 13.328 13.605 97 HH TYR 13 HH TYR 13 -19.064 12.925 14.984 98 HA PRO 14 HA PRO 14 -11.364 10.797 10.692 99 HB2 PRO 14 2HB PRO 14 -10.556 10.799 8.005 100 HB3 PRO 14 1HB PRO 14 -10.143 9.591 9.221 101 HG2 PRO 14 2HG PRO 14 -11.761 9.217 6.936 102 HG3 PRO 14 1HG PRO 14 -11.532 8.078 8.272 103 HD2 PRO 14 2HD PRO 14 -13.766 9.962 7.746 104 HD3 PRO 14 1HD PRO 14 -13.777 8.400 8.592 105 H SER 15 HN SER 15 -12.295 12.801 11.189 106 HA SER 15 HA SER 15 -12.289 14.704 8.949 107 HB2 SER 15 2HB SER 15 -14.007 15.985 10.402 108 HB3 SER 15 1HB SER 15 -14.576 14.572 9.518 109 HG SER 15 HG SER 15 -14.746 15.009 12.103 110 H PHE 16 HN PHE 16 -10.268 15.547 9.255 111 HA PHE 16 HA PHE 16 -9.786 16.905 11.793 112 HB2 PHE 16 2HB PHE 16 -8.740 14.728 12.075 113 HB3 PHE 16 1HB PHE 16 -7.873 14.919 10.557 114 HD1 PHE 16 1HD PHE 16 -8.278 16.514 13.890 115 HD2 PHE 16 2HD PHE 16 -5.731 15.773 10.569 116 HE1 PHE 16 1HE PHE 16 -6.400 17.542 15.103 117 HE2 PHE 16 2HE PHE 16 -3.850 16.799 11.772 118 HZ PHE 16 HZ PHE 16 -4.182 17.687 14.046 119 H ASP 17 HN ASP 17 -9.699 18.930 11.075 120 HA ASP 17 HA ASP 17 -8.516 20.802 10.575 121 HB2 ASP 17 2HB ASP 17 -6.501 19.453 11.143 122 HB3 ASP 17 1HB ASP 17 -6.377 18.994 9.448 123 H LYS 18 HN LYS 18 -7.700 18.603 7.901 124 HA LYS 18 HA LYS 18 -7.808 20.558 5.887 125 HB2 LYS 18 2HB LYS 18 -6.635 18.393 5.708 126 HB3 LYS 18 1HB LYS 18 -8.180 17.561 5.681 127 HG2 LYS 18 2HG LYS 18 -8.730 18.637 3.559 128 HG3 LYS 18 1HG LYS 18 -7.179 19.482 3.590 129 HD2 LYS 18 2HD LYS 18 -5.993 17.358 3.528 130 HD3 LYS 18 1HD LYS 18 -7.522 16.482 3.574 131 HE2 LYS 18 2HE LYS 18 -6.698 16.521 1.314 132 HE3 LYS 18 1HE LYS 18 -8.141 17.526 1.420 133 HZ1 LYS 18 3HZ LYS 18 -6.331 18.531 0.109 134 HZ2 LYS 18 1HZ LYS 18 -5.359 18.576 1.502 135 HZ3 LYS 18 2HZ LYS 18 -6.788 19.480 1.434 136 H PHE 19 HN PHE 19 -9.397 20.795 4.133 137 HA PHE 19 HA PHE 19 -12.072 19.914 4.856 138 HB2 PHE 19 2HB PHE 19 -11.411 22.401 5.534 139 HB3 PHE 19 1HB PHE 19 -11.760 22.709 3.838 140 HD1 PHE 19 1HD PHE 19 -13.441 20.368 6.181 141 HD2 PHE 19 2HD PHE 19 -13.720 23.937 3.883 142 HE1 PHE 19 1HE PHE 19 -15.831 20.537 6.738 143 HE2 PHE 19 2HE PHE 19 -16.110 24.101 4.424 144 HZ PHE 19 HZ PHE 19 -17.168 22.403 5.854 145 H LEU 20 HN LEU 20 -10.713 20.683 1.064 146 HA LEU 20 HA LEU 20 -10.505 22.664 3.203 147 HB2 LEU 20 2HB LEU 20 -9.024 22.312 0.590 148 HB3 LEU 20 1HB LEU 20 -8.819 23.694 1.641 149 HG LEU 20 HG LEU 20 -8.223 20.864 2.494 150 HD11 LEU 20 1HD1 LEU 20 -6.798 21.526 0.607 151 HD12 LEU 20 2HD1 LEU 20 -5.883 21.399 2.110 152 HD13 LEU 20 3HD1 LEU 20 -6.332 22.985 1.480 153 HD21 LEU 20 3HD2 LEU 20 -7.451 23.544 3.648 154 HD22 LEU 20 1HD2 LEU 20 -6.962 21.968 4.269 155 HD23 LEU 20 2HD2 LEU 20 -8.658 22.445 4.312 156 H GLY 21 HN GLY 21 -12.202 24.074 3.101 157 HA2 GLY 21 2HA GLY 21 -13.782 25.517 2.244 158 HA3 GLY 21 1HA GLY 21 -12.757 25.648 0.818 159 H THR 22 HN THR 22 -14.010 25.278 -0.925 160 HA THR 22 HA THR 22 -15.406 22.696 -0.968 161 HB THR 22 HB THR 22 -17.093 23.733 -2.537 162 HG1 THR 22 1HG THR 22 -15.572 25.919 -2.021 163 HG21 THR 22 3HG2 THR 22 -18.511 24.574 -0.737 164 HG22 THR 22 1HG2 THR 22 -17.102 24.723 0.314 165 HG23 THR 22 2HG2 THR 22 -17.637 23.130 -0.219 166 H GLU 23 HN GLU 23 -13.368 22.051 -1.904 167 HA GLU 23 HA GLU 23 -13.432 22.418 -4.806 168 HB2 GLU 23 2HB GLU 23 -11.608 23.840 -3.759 169 HB3 GLU 23 1HB GLU 23 -10.845 22.342 -3.244 170 HG2 GLU 23 2HG GLU 23 -10.464 21.664 -5.486 171 HG3 GLU 23 1HG GLU 23 -11.484 22.957 -6.115 172 H ASN 24 HN ASN 24 -14.109 20.466 -5.393 173 HA ASN 24 HA ASN 24 -13.517 18.147 -3.751 174 HB2 ASN 24 2HB ASN 24 -15.275 18.481 -6.190 175 HB3 ASN 24 1HB ASN 24 -15.147 17.002 -5.245 176 HD21 ASN 24 1HD2 ASN 24 -16.357 20.262 -5.331 177 HD22 ASN 24 2HD2 ASN 24 -17.387 20.123 -3.946 178 H ALA 25 HN ALA 25 -11.649 19.538 -5.882 179 HA ALA 25 HA ALA 25 -11.157 17.700 -7.929 180 HB1 ALA 25 1HB ALA 25 -9.163 19.535 -6.604 181 HB2 ALA 25 2HB ALA 25 -10.262 19.984 -7.908 182 HB3 ALA 25 3HB ALA 25 -9.002 18.786 -8.192 183 H GLU 26 HN GLU 26 -9.811 17.878 -4.658 184 HA GLU 26 HA GLU 26 -8.045 15.665 -5.009 185 HB2 GLU 26 2HB GLU 26 -9.165 16.890 -2.480 186 HB3 GLU 26 1HB GLU 26 -7.856 15.718 -2.541 187 HG2 GLU 26 2HG GLU 26 -6.518 17.320 -3.840 188 HG3 GLU 26 1HG GLU 26 -7.822 18.495 -3.697 189 H LEU 27 HN LEU 27 -11.378 16.030 -4.131 190 HA LEU 27 HA LEU 27 -11.658 13.478 -2.894 191 HB2 LEU 27 2HB LEU 27 -13.093 15.283 -2.221 192 HB3 LEU 27 1HB LEU 27 -13.669 15.500 -3.864 193 HG LEU 27 HG LEU 27 -14.685 13.253 -3.761 194 HD11 LEU 27 1HD1 LEU 27 -14.981 12.197 -1.553 195 HD12 LEU 27 2HD1 LEU 27 -13.866 13.377 -0.862 196 HD13 LEU 27 3HD1 LEU 27 -13.297 12.226 -2.072 197 HD21 LEU 27 3HD2 LEU 27 -16.034 15.214 -3.347 198 HD22 LEU 27 1HD2 LEU 27 -15.565 15.207 -1.645 199 HD23 LEU 27 2HD2 LEU 27 -16.549 13.896 -2.295 200 H VAL 28 HN VAL 28 -12.446 14.813 -6.092 201 HA VAL 28 HA VAL 28 -13.720 12.514 -7.098 202 HB VAL 28 HB VAL 28 -12.139 14.577 -8.649 203 HG11 VAL 28 1HG1 VAL 28 -14.271 12.651 -9.573 204 HG12 VAL 28 2HG1 VAL 28 -12.548 12.535 -9.934 205 HG13 VAL 28 3HG1 VAL 28 -13.491 13.885 -10.563 206 HG21 VAL 28 3HG2 VAL 28 -14.319 15.644 -9.037 207 HG22 VAL 28 1HG2 VAL 28 -13.903 15.604 -7.323 208 HG23 VAL 28 2HG2 VAL 28 -15.077 14.459 -7.973 209 H TYR 29 HN TYR 29 -10.350 13.429 -6.859 210 HA TYR 29 HA TYR 29 -9.174 11.392 -8.386 211 HB2 TYR 29 2HB TYR 29 -7.852 13.245 -7.608 212 HB3 TYR 29 1HB TYR 29 -8.204 12.862 -5.930 213 HD1 TYR 29 1HD TYR 29 -6.560 11.377 -8.948 214 HD2 TYR 29 2HD TYR 29 -6.670 11.652 -4.702 215 HE1 TYR 29 1HE TYR 29 -4.507 10.029 -8.808 216 HE2 TYR 29 2HE TYR 29 -4.618 10.309 -4.553 217 HH TYR 29 HH TYR 29 -2.678 9.601 -7.285 218 H VAL 30 HN VAL 30 -10.736 11.281 -5.318 219 HA VAL 30 HA VAL 30 -9.481 8.908 -4.338 220 HB VAL 30 HB VAL 30 -12.044 10.288 -3.520 221 HG11 VAL 30 1HG1 VAL 30 -11.950 8.966 -1.474 222 HG12 VAL 30 2HG1 VAL 30 -10.567 8.073 -2.106 223 HG13 VAL 30 3HG1 VAL 30 -12.141 7.937 -2.893 224 HG21 VAL 30 3HG2 VAL 30 -10.725 11.099 -1.629 225 HG22 VAL 30 1HG2 VAL 30 -10.030 11.615 -3.167 226 HG23 VAL 30 2HG2 VAL 30 -9.299 10.284 -2.271 227 H LEU 31 HN LEU 31 -12.310 9.578 -6.295 228 HA LEU 31 HA LEU 31 -13.592 7.077 -5.835 229 HB2 LEU 31 2HB LEU 31 -14.005 9.306 -7.793 230 HB3 LEU 31 1HB LEU 31 -14.874 7.797 -7.980 231 HG LEU 31 HG LEU 31 -15.803 8.119 -5.676 232 HD11 LEU 31 1HD1 LEU 31 -15.706 10.353 -4.688 233 HD12 LEU 31 2HD1 LEU 31 -14.575 10.859 -5.943 234 HD13 LEU 31 3HD1 LEU 31 -14.105 9.619 -4.782 235 HD21 LEU 31 3HD2 LEU 31 -16.372 10.303 -7.672 236 HD22 LEU 31 1HD2 LEU 31 -17.433 9.805 -6.356 237 HD23 LEU 31 2HD2 LEU 31 -17.079 8.688 -7.676 238 H ARG 32 HN ARG 32 -13.908 5.357 -7.242 239 HA ARG 32 HA ARG 32 -13.428 3.777 -8.781 240 HB2 ARG 32 2HB ARG 32 -12.007 6.047 -10.148 241 HB3 ARG 32 1HB ARG 32 -11.948 4.408 -10.776 242 HG2 ARG 32 2HG ARG 32 -13.674 5.370 -11.976 243 HG3 ARG 32 1HG ARG 32 -14.520 4.510 -10.690 244 HD2 ARG 32 2HD ARG 32 -15.523 6.663 -10.909 245 HD3 ARG 32 1HD ARG 32 -14.591 6.655 -9.412 246 HE ARG 32 HE ARG 32 -12.830 7.689 -11.143 247 HH11 ARG 32 1HH1 ARG 32 -16.184 8.475 -10.485 248 HH12 ARG 32 2HH1 ARG 32 -16.020 10.128 -10.987 249 HH21 ARG 32 1HH2 ARG 32 -12.616 9.876 -11.789 250 HH22 ARG 32 2HH2 ARG 32 -14.005 10.925 -11.738 251 H HIS 33 HN HIS 33 -12.167 2.086 -8.451 252 HA HIS 33 HA HIS 33 -9.333 2.371 -7.980 253 HB2 HIS 33 2HB HIS 33 -9.360 1.435 -5.708 254 HB3 HIS 33 1HB HIS 33 -10.214 2.971 -5.775 255 HD1 HIS 33 1HD HIS 33 -10.515 0.125 -3.948 256 HD2 HIS 33 2HD HIS 33 -13.221 2.021 -6.471 257 HE1 HIS 33 1HE HIS 33 -12.788 -0.622 -3.183 258 HE2 HIS 33 2HE HIS 33 -14.410 0.438 -4.796 259 H LYS 34 HN LYS 34 -8.282 0.583 -8.627 260 HA LYS 34 HA LYS 34 -9.442 -2.035 -8.318 261 HB2 LYS 34 2HB LYS 34 -9.328 -2.621 -10.723 262 HB3 LYS 34 1HB LYS 34 -10.566 -1.426 -10.364 263 HG2 LYS 34 2HG LYS 34 -9.485 0.239 -11.492 264 HG3 LYS 34 1HG LYS 34 -7.886 -0.457 -11.210 265 HD2 LYS 34 2HD LYS 34 -8.604 -0.600 -13.575 266 HD3 LYS 34 1HD LYS 34 -8.299 -2.180 -12.848 267 HE2 LYS 34 2HE LYS 34 -10.787 -2.282 -12.381 268 HE3 LYS 34 1HE LYS 34 -10.945 -0.880 -13.441 269 HZ1 LYS 34 3HZ LYS 34 -9.720 -3.465 -14.229 270 HZ2 LYS 34 1HZ LYS 34 -10.004 -2.133 -15.240 271 HZ3 LYS 34 2HZ LYS 34 -11.312 -2.999 -14.590 272 H HIS 35 HN HIS 35 -7.970 -3.672 -8.445 273 HA HIS 35 HA HIS 35 -5.567 -3.758 -9.781 274 HB2 HIS 35 2HB HIS 35 -3.902 -3.448 -7.952 275 HB3 HIS 35 1HB HIS 35 -4.691 -1.953 -8.429 276 HD1 HIS 35 1HD HIS 35 -4.698 -4.496 -5.615 277 HD2 HIS 35 2HD HIS 35 -6.000 -0.625 -6.412 278 HE1 HIS 35 1HE HIS 35 -5.391 -3.546 -3.397 279 HE2 HIS 35 2HE HIS 35 -6.366 -1.289 -3.940 280 H GLY 36 HN GLY 36 -4.122 -5.561 -8.937 281 HA2 GLY 36 2HA GLY 36 -5.668 -7.796 -8.103 282 HA3 GLY 36 1HA GLY 36 -3.914 -7.747 -8.231 283 H GLN 37 HN GLN 37 -4.485 -9.201 -6.208 284 HA GLN 37 HA GLN 37 -5.417 -8.025 -3.851 285 HB2 GLN 37 2HB GLN 37 -3.582 -10.375 -4.274 286 HB3 GLN 37 1HB GLN 37 -4.167 -9.896 -2.687 287 HG2 GLN 37 2HG GLN 37 -6.482 -10.202 -3.494 288 HG3 GLN 37 1HG GLN 37 -5.838 -10.784 -5.027 289 HE21 GLN 37 1HE2 GLN 37 -6.278 -11.480 -1.641 290 HE22 GLN 37 2HE2 GLN 37 -5.886 -13.168 -1.742 291 H PHE 38 HN PHE 38 -2.056 -9.121 -3.965 292 HA PHE 38 HA PHE 38 -1.363 -6.960 -2.160 293 HB2 PHE 38 2HB PHE 38 0.331 -9.243 -3.199 294 HB3 PHE 38 1HB PHE 38 0.770 -8.140 -1.902 295 HD1 PHE 38 1HD PHE 38 -0.332 -8.293 0.282 296 HD2 PHE 38 2HD PHE 38 -1.175 -11.062 -2.837 297 HE1 PHE 38 1HE PHE 38 -1.349 -9.824 1.920 298 HE2 PHE 38 2HE PHE 38 -2.194 -12.597 -1.205 299 HZ PHE 38 HZ PHE 38 -2.282 -11.976 1.176 300 H ILE 39 HN ILE 39 -0.696 -5.062 -2.936 301 HA ILE 39 HA ILE 39 0.921 -5.048 -5.406 302 HB ILE 39 HB ILE 39 -1.203 -3.033 -4.647 303 HG12 ILE 39 2HG1 ILE 39 -2.165 -5.139 -5.460 304 HG13 ILE 39 1HG1 ILE 39 -2.414 -3.842 -6.622 305 HG21 ILE 39 1HG2 ILE 39 0.588 -3.164 -7.069 306 HG22 ILE 39 2HG2 ILE 39 0.651 -1.965 -5.777 307 HG23 ILE 39 3HG2 ILE 39 -0.750 -2.035 -6.849 308 HD11 ILE 39 3HD1 ILE 39 -0.528 -4.703 -7.945 309 HD12 ILE 39 1HD1 ILE 39 -1.824 -5.884 -7.759 310 HD13 ILE 39 2HD1 ILE 39 -0.354 -6.028 -6.797 311 H TYR 40 HN TYR 40 2.811 -4.008 -5.238 312 HA TYR 40 HA TYR 40 3.152 -2.029 -3.073 313 HB2 TYR 40 2HB TYR 40 4.494 -4.249 -2.986 314 HB3 TYR 40 1HB TYR 40 5.416 -3.579 -4.326 315 HD1 TYR 40 1HD TYR 40 6.476 -1.217 -3.914 316 HD2 TYR 40 2HD TYR 40 5.129 -3.795 -0.816 317 HE1 TYR 40 1HE TYR 40 7.900 -0.021 -2.304 318 HE2 TYR 40 2HE TYR 40 6.544 -2.605 0.801 319 HH TYR 40 HH TYR 40 8.588 -1.199 0.801 320 H VAL 41 HN VAL 41 3.613 -0.007 -3.736 321 HA VAL 41 HA VAL 41 4.734 0.352 -6.433 322 HB VAL 41 HB VAL 41 3.367 2.468 -6.612 323 HG11 VAL 41 1HG1 VAL 41 2.783 0.479 -7.871 324 HG12 VAL 41 2HG1 VAL 41 1.321 1.294 -7.316 325 HG13 VAL 41 3HG1 VAL 41 1.889 -0.158 -6.492 326 HG21 VAL 41 3HG2 VAL 41 1.851 1.213 -4.322 327 HG22 VAL 41 1HG2 VAL 41 1.309 2.597 -5.270 328 HG23 VAL 41 2HG2 VAL 41 2.754 2.726 -4.268 329 H TRP 42 HN TRP 42 6.686 1.215 -6.247 330 HA TRP 42 HA TRP 42 7.172 3.157 -4.081 331 HB2 TRP 42 2HB TRP 42 9.496 2.329 -4.021 332 HB3 TRP 42 1HB TRP 42 8.333 1.058 -3.662 333 HD1 TRP 42 1HD TRP 42 7.919 -0.803 -5.627 334 HE1 TRP 42 1HE TRP 42 9.502 -1.651 -7.475 335 HE3 TRP 42 3HE TRP 42 11.374 2.973 -5.553 336 HZ2 TRP 42 2HZ TRP 42 11.898 -0.833 -8.730 337 HZ3 TRP 42 3HZ TRP 42 13.278 2.860 -7.104 338 HH2 TRP 42 2HH TRP 42 13.534 0.995 -8.657 339 H GLY 43 HN GLY 43 6.558 3.267 -7.153 340 HA2 GLY 43 2HA GLY 43 8.893 4.252 -8.419 341 HA3 GLY 43 1HA GLY 43 7.251 4.430 -9.013 342 H GLU 44 HN GLU 44 6.594 5.781 -6.367 343 HA GLU 44 HA GLU 44 6.276 7.900 -5.640 344 HB2 GLU 44 2HB GLU 44 9.022 8.364 -6.808 345 HB3 GLU 44 1HB GLU 44 8.151 9.530 -5.828 346 HG2 GLU 44 2HG GLU 44 8.154 7.895 -3.969 347 HG3 GLU 44 1HG GLU 44 9.156 6.832 -4.959 348 H GLU 45 HN GLU 45 4.535 8.203 -7.105 349 HA GLU 45 HA GLU 45 5.117 9.720 -9.520 350 HB2 GLU 45 2HB GLU 45 3.377 7.953 -9.582 351 HB3 GLU 45 1HB GLU 45 2.443 8.850 -8.393 352 HG2 GLU 45 2HG GLU 45 1.996 10.595 -9.917 353 HG3 GLU 45 1HG GLU 45 3.233 10.030 -11.037 354 H GLY 46 HN GLY 46 4.506 11.854 -9.830 355 HA2 GLY 46 2HA GLY 46 4.956 13.567 -7.695 356 HA3 GLY 46 1HA GLY 46 4.222 14.048 -9.215 357 H ALA 47 HN ALA 47 1.803 12.893 -9.222 358 HA ALA 47 HA ALA 47 0.478 14.311 -7.042 359 HB1 ALA 47 1HB ALA 47 -0.710 13.008 -9.487 360 HB2 ALA 47 2HB ALA 47 -0.224 14.698 -9.374 361 HB3 ALA 47 3HB ALA 47 -1.542 14.088 -8.369 362 H GLY 48 HN GLY 48 1.758 11.434 -7.043 363 HA2 GLY 48 2HA GLY 48 -0.529 10.172 -5.685 364 HA3 GLY 48 1HA GLY 48 0.361 9.282 -6.909 365 H LYS 49 HN LYS 49 1.625 11.433 -4.379 366 HA LYS 49 HA LYS 49 3.416 9.320 -3.532 367 HB2 LYS 49 2HB LYS 49 3.273 12.233 -3.167 368 HB3 LYS 49 1HB LYS 49 3.822 11.359 -1.742 369 HG2 LYS 49 2HG LYS 49 5.569 10.285 -3.083 370 HG3 LYS 49 1HG LYS 49 5.028 11.192 -4.496 371 HD2 LYS 49 2HD LYS 49 5.658 13.263 -3.515 372 HD3 LYS 49 1HD LYS 49 5.922 12.508 -1.940 373 HE2 LYS 49 2HE LYS 49 7.496 11.827 -4.416 374 HE3 LYS 49 1HE LYS 49 8.008 13.026 -3.231 375 HZ1 LYS 49 3HZ LYS 49 7.392 10.232 -2.454 376 HZ2 LYS 49 1HZ LYS 49 8.280 11.393 -1.599 377 HZ3 LYS 49 2HZ LYS 49 8.934 10.685 -2.993 378 H SER 50 HN SER 50 1.920 7.838 -2.748 379 HA SER 50 HA SER 50 0.994 6.660 -1.059 380 HB2 SER 50 2HB SER 50 1.856 8.973 0.692 381 HB3 SER 50 1HB SER 50 1.345 7.383 1.260 382 HG SER 50 HG SER 50 3.288 6.677 0.897 383 H HIS 51 HN HIS 51 -0.217 9.508 -2.163 384 HA HIS 51 HA HIS 51 -2.407 9.908 -0.383 385 HB2 HIS 51 2HB HIS 51 -1.401 11.626 -1.975 386 HB3 HIS 51 1HB HIS 51 -2.276 10.807 -3.262 387 HD1 HIS 51 1HD HIS 51 -3.509 13.144 -3.580 388 HD2 HIS 51 2HD HIS 51 -4.289 11.174 0.005 389 HE1 HIS 51 1HE HIS 51 -5.559 14.249 -2.624 390 HE2 HIS 51 2HE HIS 51 -5.832 13.221 -0.341 391 H LEU 52 HN LEU 52 -1.885 7.996 -3.262 392 HA LEU 52 HA LEU 52 -4.582 7.511 -3.907 393 HB2 LEU 52 2HB LEU 52 -3.733 5.660 -5.281 394 HB3 LEU 52 1HB LEU 52 -2.856 7.153 -5.539 395 HG LEU 52 HG LEU 52 -1.232 6.037 -3.728 396 HD11 LEU 52 1HD1 LEU 52 -2.579 4.025 -3.455 397 HD12 LEU 52 2HD1 LEU 52 -1.008 3.645 -4.161 398 HD13 LEU 52 3HD1 LEU 52 -2.446 3.692 -5.181 399 HD21 LEU 52 3HD2 LEU 52 -0.614 6.856 -5.947 400 HD22 LEU 52 1HD2 LEU 52 -1.243 5.377 -6.668 401 HD23 LEU 52 2HD2 LEU 52 0.153 5.308 -5.592 402 H LEU 53 HN LEU 53 -2.493 6.034 -1.526 403 HA LEU 53 HA LEU 53 -3.978 3.657 -1.132 404 HB2 LEU 53 2HB LEU 53 -2.185 5.220 0.722 405 HB3 LEU 53 1HB LEU 53 -2.952 3.719 1.194 406 HG LEU 53 HG LEU 53 -1.762 2.700 -0.858 407 HD11 LEU 53 1HD1 LEU 53 -0.129 5.204 -0.488 408 HD12 LEU 53 2HD1 LEU 53 -1.056 4.757 -1.921 409 HD13 LEU 53 3HD1 LEU 53 0.350 3.803 -1.447 410 HD21 LEU 53 3HD2 LEU 53 -1.221 2.203 1.475 411 HD22 LEU 53 1HD2 LEU 53 -0.159 3.611 1.523 412 HD23 LEU 53 2HD2 LEU 53 0.224 2.253 0.465 413 H GLN 54 HN GLN 54 -4.211 6.886 0.195 414 HA GLN 54 HA GLN 54 -6.191 6.419 2.138 415 HB2 GLN 54 2HB GLN 54 -4.790 8.438 2.046 416 HB3 GLN 54 1HB GLN 54 -5.569 8.917 0.550 417 HG2 GLN 54 2HG GLN 54 -7.683 9.182 1.717 418 HG3 GLN 54 1HG GLN 54 -6.927 8.662 3.223 419 HE21 GLN 54 1HE2 GLN 54 -4.423 10.057 2.616 420 HE22 GLN 54 2HE2 GLN 54 -4.747 11.736 2.887 421 H ALA 55 HN ALA 55 -6.334 7.375 -1.249 422 HA ALA 55 HA ALA 55 -9.103 7.744 -1.468 423 HB1 ALA 55 1HB ALA 55 -8.754 7.535 -3.874 424 HB2 ALA 55 2HB ALA 55 -7.151 6.858 -3.588 425 HB3 ALA 55 3HB ALA 55 -7.495 8.525 -3.134 426 H TRP 56 HN TRP 56 -7.071 4.898 -2.001 427 HA TRP 56 HA TRP 56 -9.033 3.169 -2.986 428 HB2 TRP 56 2HB TRP 56 -6.651 2.675 -3.140 429 HB3 TRP 56 1HB TRP 56 -6.537 2.559 -1.388 430 HD1 TRP 56 1HD TRP 56 -8.567 0.788 -4.185 431 HE1 TRP 56 1HE TRP 56 -8.702 -1.723 -3.606 432 HE3 TRP 56 3HE TRP 56 -6.038 0.866 0.258 433 HZ2 TRP 56 2HZ TRP 56 -7.827 -3.430 -1.538 434 HZ3 TRP 56 3HZ TRP 56 -5.729 -1.252 1.470 435 HH2 TRP 56 2HH TRP 56 -6.607 -3.350 0.592 436 H VAL 57 HN VAL 57 -7.967 3.786 0.325 437 HA VAL 57 HA VAL 57 -9.557 1.811 1.550 438 HB VAL 57 HB VAL 57 -8.330 4.336 2.653 439 HG11 VAL 57 1HG1 VAL 57 -8.741 3.432 4.889 440 HG12 VAL 57 2HG1 VAL 57 -9.646 2.093 4.186 441 HG13 VAL 57 3HG1 VAL 57 -10.258 3.743 4.042 442 HG21 VAL 57 3HG2 VAL 57 -6.731 2.669 1.918 443 HG22 VAL 57 1HG2 VAL 57 -7.563 1.428 2.855 444 HG23 VAL 57 2HG2 VAL 57 -6.749 2.756 3.680 445 H ALA 58 HN ALA 58 -10.129 5.280 1.032 446 HA ALA 58 HA ALA 58 -12.576 5.434 2.400 447 HB1 ALA 58 1HB ALA 58 -11.276 7.394 1.717 448 HB2 ALA 58 2HB ALA 58 -12.944 7.492 1.154 449 HB3 ALA 58 3HB ALA 58 -11.659 7.056 0.029 450 H GLN 59 HN GLN 59 -11.830 4.577 -0.941 451 HA GLN 59 HA GLN 59 -14.512 4.409 -1.828 452 HB2 GLN 59 2HB GLN 59 -11.910 3.315 -2.831 453 HB3 GLN 59 1HB GLN 59 -13.426 2.832 -3.581 454 HG2 GLN 59 2HG GLN 59 -12.580 5.698 -3.255 455 HG3 GLN 59 1HG GLN 59 -12.234 4.730 -4.687 456 HE21 GLN 59 1HE2 GLN 59 -14.730 6.303 -2.820 457 HE22 GLN 59 2HE2 GLN 59 -15.954 6.208 -4.039 458 H ALA 60 HN ALA 60 -12.336 2.067 -0.330 459 HA ALA 60 HA ALA 60 -14.069 -0.168 -0.632 460 HB1 ALA 60 1HB ALA 60 -12.651 -1.226 1.066 461 HB2 ALA 60 2HB ALA 60 -11.879 0.329 1.382 462 HB3 ALA 60 3HB ALA 60 -11.690 -0.447 -0.192 463 H LEU 61 HN LEU 61 -13.647 2.309 1.816 464 HA LEU 61 HA LEU 61 -15.440 1.322 3.739 465 HB2 LEU 61 2HB LEU 61 -14.620 4.141 3.017 466 HB3 LEU 61 1HB LEU 61 -15.605 3.757 4.411 467 HG LEU 61 HG LEU 61 -12.785 2.781 3.954 468 HD11 LEU 61 1HD1 LEU 61 -12.195 4.300 5.774 469 HD12 LEU 61 2HD1 LEU 61 -13.861 4.880 5.831 470 HD13 LEU 61 3HD1 LEU 61 -12.873 5.175 4.400 471 HD21 LEU 61 3HD2 LEU 61 -12.922 1.998 6.268 472 HD22 LEU 61 1HD2 LEU 61 -14.118 1.198 5.248 473 HD23 LEU 61 2HD2 LEU 61 -14.613 2.493 6.338 474 H GLU 62 HN GLU 62 -15.925 3.390 0.909 475 HA GLU 62 HA GLU 62 -18.707 3.793 1.340 476 HB2 GLU 62 2HB GLU 62 -17.019 4.036 -1.153 477 HB3 GLU 62 1HB GLU 62 -18.708 4.521 -1.055 478 HG2 GLU 62 2HG GLU 62 -18.171 6.154 0.639 479 HG3 GLU 62 1HG GLU 62 -16.487 5.637 0.630 480 H ALA 63 HN ALA 63 -16.860 1.216 -0.000 481 HA ALA 63 HA ALA 63 -19.035 -0.004 -1.432 482 HB1 ALA 63 1HB ALA 63 -16.405 -1.185 -0.545 483 HB2 ALA 63 2HB ALA 63 -16.713 -0.396 -2.094 484 HB3 ALA 63 3HB ALA 63 -17.534 -1.907 -1.694 485 H GLY 64 HN GLY 64 -18.609 0.483 1.753 486 HA2 GLY 64 2HA GLY 64 -19.750 -0.371 3.564 487 HA3 GLY 64 1HA GLY 64 -20.537 -1.506 2.475 488 H LYS 65 HN LYS 65 -17.085 -1.171 2.763 489 HA LYS 65 HA LYS 65 -16.947 -3.782 4.097 490 HB2 LYS 65 2HB LYS 65 -14.996 -2.675 2.065 491 HB3 LYS 65 1HB LYS 65 -14.978 -4.278 2.781 492 HG2 LYS 65 2HG LYS 65 -17.211 -3.260 1.045 493 HG3 LYS 65 1HG LYS 65 -15.833 -4.184 0.442 494 HD2 LYS 65 2HD LYS 65 -16.432 -6.073 1.782 495 HD3 LYS 65 1HD LYS 65 -17.685 -5.149 2.615 496 HE2 LYS 65 2HE LYS 65 -17.714 -5.617 -0.354 497 HE3 LYS 65 1HE LYS 65 -18.452 -6.733 0.790 498 HZ1 LYS 65 3HZ LYS 65 -19.153 -3.853 0.535 499 HZ2 LYS 65 1HZ LYS 65 -19.901 -4.986 1.554 500 HZ3 LYS 65 2HZ LYS 65 -20.044 -5.135 -0.129 501 H ASN 66 HN ASN 66 -14.932 -4.050 5.348 502 HA ASN 66 HA ASN 66 -14.307 -1.579 6.742 503 HB2 ASN 66 2HB ASN 66 -14.732 -3.906 7.835 504 HB3 ASN 66 1HB ASN 66 -13.069 -4.231 7.399 505 HD21 ASN 66 1HD2 ASN 66 -12.588 -4.384 9.643 506 HD22 ASN 66 2HD2 ASN 66 -12.375 -2.952 10.600 507 H ALA 67 HN ALA 67 -12.441 -0.520 6.643 508 HA ALA 67 HA ALA 67 -10.133 -1.627 5.296 509 HB1 ALA 67 1HB ALA 67 -11.546 -0.891 3.422 510 HB2 ALA 67 2HB ALA 67 -10.065 0.061 3.538 511 HB3 ALA 67 3HB ALA 67 -11.593 0.734 4.107 512 H ALA 68 HN ALA 68 -8.259 -0.459 5.664 513 HA ALA 68 HA ALA 68 -8.365 2.122 6.958 514 HB1 ALA 68 1HB ALA 68 -7.271 1.450 9.010 515 HB2 ALA 68 2HB ALA 68 -7.279 -0.236 8.490 516 HB3 ALA 68 3HB ALA 68 -8.801 0.589 8.830 517 H TYR 69 HN TYR 69 -6.570 3.271 6.502 518 HA TYR 69 HA TYR 69 -4.216 1.805 5.564 519 HB2 TYR 69 2HB TYR 69 -3.488 3.867 4.465 520 HB3 TYR 69 1HB TYR 69 -5.077 3.393 3.899 521 HD1 TYR 69 1HD TYR 69 -7.090 4.665 4.709 522 HD2 TYR 69 2HD TYR 69 -3.114 5.964 5.487 523 HE1 TYR 69 1HE TYR 69 -7.929 6.920 5.207 524 HE2 TYR 69 2HE TYR 69 -3.944 8.224 5.991 525 HH TYR 69 HH TYR 69 -5.887 9.621 5.483 526 H ILE 70 HN ILE 70 -2.387 1.925 6.673 527 HA ILE 70 HA ILE 70 -2.360 3.697 9.023 528 HB ILE 70 HB ILE 70 -1.296 0.873 8.855 529 HG12 ILE 70 2HG1 ILE 70 -3.613 2.013 10.442 530 HG13 ILE 70 1HG1 ILE 70 -3.759 1.006 9.004 531 HG21 ILE 70 1HG2 ILE 70 0.112 2.282 10.257 532 HG22 ILE 70 2HG2 ILE 70 -0.780 1.121 11.238 533 HG23 ILE 70 3HG2 ILE 70 -1.301 2.806 11.174 534 HD11 ILE 70 3HD1 ILE 70 -2.687 -0.836 10.187 535 HD12 ILE 70 1HD1 ILE 70 -4.137 -0.282 11.022 536 HD13 ILE 70 2HD1 ILE 70 -2.544 0.170 11.629 537 H ASP 71 HN ASP 71 -0.740 5.066 9.048 538 HA ASP 71 HA ASP 71 1.556 4.764 7.321 539 HB2 ASP 71 2HB ASP 71 0.723 6.869 9.325 540 HB3 ASP 71 1HB ASP 71 2.286 6.906 8.518 541 H ALA 72 HN ALA 72 3.003 3.285 7.960 542 HA ALA 72 HA ALA 72 3.265 2.305 10.575 543 HB1 ALA 72 1HB ALA 72 5.288 2.196 8.343 544 HB2 ALA 72 2HB ALA 72 3.962 1.061 8.591 545 HB3 ALA 72 3HB ALA 72 5.261 1.168 9.777 546 H ALA 73 HN ALA 73 4.523 5.158 9.171 547 HA ALA 73 HA ALA 73 6.315 5.511 11.476 548 HB1 ALA 73 1HB ALA 73 6.443 6.857 8.778 549 HB2 ALA 73 2HB ALA 73 7.502 5.564 9.347 550 HB3 ALA 73 3HB ALA 73 7.541 7.144 10.131 551 H SER 74 HN SER 74 3.542 5.921 11.720 552 HA SER 74 HA SER 74 3.534 8.574 12.764 553 HB2 SER 74 2HB SER 74 3.081 9.051 10.354 554 HB3 SER 74 1HB SER 74 1.635 8.051 10.463 555 HG SER 74 HG SER 74 1.315 9.656 12.411 556 H MET 75 HN MET 75 1.797 5.638 11.940 557 HA MET 75 HA MET 75 0.241 5.935 14.415 558 HB2 MET 75 2HB MET 75 -0.745 5.027 11.709 559 HB3 MET 75 1HB MET 75 -1.618 4.690 13.197 560 HG2 MET 75 2HG MET 75 -1.652 7.162 13.611 561 HG3 MET 75 1HG MET 75 -1.017 7.373 11.982 562 HE1 MET 75 3HE MET 75 -3.915 5.938 9.777 563 HE2 MET 75 1HE MET 75 -2.470 5.103 10.344 564 HE3 MET 75 2HE MET 75 -2.358 6.766 9.769 565 HA PRO 76 HA PRO 76 1.860 1.896 15.201 566 HB2 PRO 76 2HB PRO 76 0.306 1.169 17.264 567 HB3 PRO 76 1HB PRO 76 1.504 2.459 17.413 568 HG2 PRO 76 2HG PRO 76 -1.453 2.659 17.004 569 HG3 PRO 76 1HG PRO 76 -0.406 3.601 18.081 570 HD2 PRO 76 2HD PRO 76 -1.269 4.494 15.637 571 HD3 PRO 76 1HD PRO 76 0.240 5.026 16.405 572 H LEU 77 HN LEU 77 1.344 -0.331 15.061 573 HA LEU 77 HA LEU 77 -1.040 -0.876 13.463 574 HB2 LEU 77 2HB LEU 77 1.188 -1.657 12.692 575 HB3 LEU 77 1HB LEU 77 1.306 -2.663 14.121 576 HG LEU 77 HG LEU 77 -0.567 -4.022 13.363 577 HD11 LEU 77 1HD1 LEU 77 -1.849 -2.299 12.206 578 HD12 LEU 77 2HD1 LEU 77 -1.547 -3.678 11.148 579 HD13 LEU 77 3HD1 LEU 77 -0.604 -2.202 10.959 580 HD21 LEU 77 3HD2 LEU 77 0.496 -5.046 11.428 581 HD22 LEU 77 1HD2 LEU 77 1.703 -4.598 12.632 582 HD23 LEU 77 2HD2 LEU 77 1.484 -3.603 11.192 583 H THR 78 HN THR 78 -2.578 -2.430 14.069 584 HA THR 78 HA THR 78 -2.450 -3.406 16.816 585 HB THR 78 HB THR 78 -4.963 -2.628 16.941 586 HG1 THR 78 1HG THR 78 -3.800 -0.861 15.035 587 HG21 THR 78 3HG2 THR 78 -3.198 -1.890 18.477 588 HG22 THR 78 1HG2 THR 78 -4.269 -0.558 18.047 589 HG23 THR 78 2HG2 THR 78 -2.676 -0.684 17.300 590 H ASP 79 HN ASP 79 -4.050 -5.031 17.294 591 HA ASP 79 HA ASP 79 -4.322 -6.919 15.196 592 HB2 ASP 79 2HB ASP 79 -5.382 -8.346 16.824 593 HB3 ASP 79 1HB ASP 79 -4.036 -7.522 17.597 594 H ALA 80 HN ALA 80 -6.274 -4.310 16.183 595 HA ALA 80 HA ALA 80 -8.827 -5.126 15.414 596 HB1 ALA 80 1HB ALA 80 -9.295 -2.753 15.031 597 HB2 ALA 80 2HB ALA 80 -7.569 -2.400 15.088 598 HB3 ALA 80 3HB ALA 80 -8.394 -2.997 16.527 599 H ALA 81 HN ALA 81 -6.018 -4.420 13.516 600 HA ALA 81 HA ALA 81 -7.162 -3.843 11.029 601 HB1 ALA 81 1HB ALA 81 -4.567 -5.279 11.585 602 HB2 ALA 81 2HB ALA 81 -4.785 -3.529 11.554 603 HB3 ALA 81 3HB ALA 81 -5.014 -4.470 10.081 604 H PHE 82 HN PHE 82 -6.980 -6.840 12.753 605 HA PHE 82 HA PHE 82 -7.206 -8.580 10.512 606 HB2 PHE 82 2HB PHE 82 -7.772 -8.946 13.451 607 HB3 PHE 82 1HB PHE 82 -8.047 -10.227 12.277 608 HD1 PHE 82 2HD PHE 82 -6.131 -11.130 10.974 609 HD2 PHE 82 1HD PHE 82 -5.598 -8.451 14.242 610 HE1 PHE 82 2HE PHE 82 -3.776 -11.806 11.142 611 HE2 PHE 82 1HE PHE 82 -3.238 -9.128 14.413 612 HZ PHE 82 HZ PHE 82 -2.331 -10.811 12.860 613 H GLU 83 HN GLU 83 -9.419 -6.535 12.130 614 HA GLU 83 HA GLU 83 -11.776 -7.972 11.295 615 HB2 GLU 83 2HB GLU 83 -11.446 -5.185 12.398 616 HB3 GLU 83 1HB GLU 83 -12.975 -5.999 12.135 617 HG2 GLU 83 2HG GLU 83 -12.219 -7.764 13.719 618 HG3 GLU 83 1HG GLU 83 -10.817 -6.758 14.071 619 H ALA 84 HN ALA 84 -9.622 -5.701 9.995 620 HA ALA 84 HA ALA 84 -11.480 -4.600 8.081 621 HB1 ALA 84 1HB ALA 84 -9.757 -3.158 9.035 622 HB2 ALA 84 2HB ALA 84 -9.575 -3.298 7.286 623 HB3 ALA 84 3HB ALA 84 -8.505 -4.199 8.360 624 H GLU 85 HN GLU 85 -11.667 -5.187 6.010 625 HA GLU 85 HA GLU 85 -10.237 -7.582 5.162 626 HB2 GLU 85 2HB GLU 85 -12.766 -7.110 4.865 627 HB3 GLU 85 1HB GLU 85 -12.269 -6.107 3.511 628 HG2 GLU 85 2HG GLU 85 -12.922 -8.375 2.826 629 HG3 GLU 85 1HG GLU 85 -11.250 -7.989 2.420 630 H TYR 86 HN TYR 86 -10.366 -4.177 4.519 631 HA TYR 86 HA TYR 86 -8.352 -4.509 2.398 632 HB2 TYR 86 2HB TYR 86 -10.274 -2.223 2.879 633 HB3 TYR 86 1HB TYR 86 -9.037 -2.245 1.630 634 HD1 TYR 86 1HD TYR 86 -12.154 -3.899 2.765 635 HD2 TYR 86 2HD TYR 86 -9.432 -3.308 -0.449 636 HE1 TYR 86 1HE TYR 86 -13.742 -4.974 1.228 637 HE2 TYR 86 2HE TYR 86 -11.013 -4.380 -1.993 638 HH TYR 86 HH TYR 86 -12.900 -6.017 -1.848 639 H LEU 87 HN LEU 87 -6.450 -4.435 3.478 640 HA LEU 87 HA LEU 87 -6.001 -2.192 5.314 641 HB2 LEU 87 2HB LEU 87 -4.525 -4.791 4.935 642 HB3 LEU 87 1HB LEU 87 -3.871 -3.468 5.876 643 HG LEU 87 HG LEU 87 -4.794 -4.977 7.421 644 HD11 LEU 87 1HD1 LEU 87 -6.635 -3.711 8.445 645 HD12 LEU 87 2HD1 LEU 87 -6.762 -2.744 6.975 646 HD13 LEU 87 3HD1 LEU 87 -5.291 -2.683 7.946 647 HD21 LEU 87 3HD2 LEU 87 -7.307 -4.997 5.757 648 HD22 LEU 87 1HD2 LEU 87 -7.090 -5.818 7.302 649 HD23 LEU 87 2HD2 LEU 87 -6.138 -6.310 5.901 650 H ALA 88 HN ALA 88 -4.670 -0.589 4.805 651 HA ALA 88 HA ALA 88 -2.810 -0.965 2.544 652 HB1 ALA 88 1HB ALA 88 -4.663 0.473 1.851 653 HB2 ALA 88 2HB ALA 88 -3.154 1.384 1.937 654 HB3 ALA 88 3HB ALA 88 -4.355 1.537 3.221 655 H VAL 89 HN VAL 89 -0.742 -0.674 3.118 656 HA VAL 89 HA VAL 89 -0.220 0.862 5.575 657 HB VAL 89 HB VAL 89 1.322 -1.563 4.636 658 HG11 VAL 89 1HG1 VAL 89 2.417 -1.417 6.832 659 HG12 VAL 89 2HG1 VAL 89 1.549 0.085 7.150 660 HG13 VAL 89 3HG1 VAL 89 2.721 0.006 5.834 661 HG21 VAL 89 3HG2 VAL 89 -0.639 -1.294 6.915 662 HG22 VAL 89 1HG2 VAL 89 0.361 -2.709 6.581 663 HG23 VAL 89 2HG2 VAL 89 -0.880 -2.217 5.432 664 H ASP 90 HN ASP 90 1.035 2.562 5.285 665 HA ASP 90 HA ASP 90 2.845 2.592 2.957 666 HB2 ASP 90 2HB ASP 90 1.110 4.332 2.837 667 HB3 ASP 90 1HB ASP 90 1.592 4.929 4.422 668 H GLN 91 HN GLN 91 4.939 3.435 3.254 669 HA GLN 91 HA GLN 91 6.940 3.593 4.303 670 HB2 GLN 91 2HB GLN 91 5.176 4.566 6.555 671 HB3 GLN 91 1HB GLN 91 6.933 4.560 6.642 672 HG2 GLN 91 2HG GLN 91 7.150 6.213 5.035 673 HG3 GLN 91 1HG GLN 91 5.546 5.914 4.370 674 HE21 GLN 91 1HE2 GLN 91 3.770 6.799 5.334 675 HE22 GLN 91 2HE2 GLN 91 3.868 8.049 6.526 676 H VAL 92 HN VAL 92 5.612 1.118 4.178 677 HA VAL 92 HA VAL 92 5.582 -0.283 6.636 678 HB VAL 92 HB VAL 92 4.380 -1.005 4.588 679 HG11 VAL 92 1HG1 VAL 92 5.570 -2.268 2.868 680 HG12 VAL 92 2HG1 VAL 92 7.106 -1.852 3.627 681 HG13 VAL 92 3HG1 VAL 92 6.094 -0.586 2.930 682 HG21 VAL 92 3HG2 VAL 92 6.248 -3.069 5.753 683 HG22 VAL 92 1HG2 VAL 92 4.750 -3.407 4.888 684 HG23 VAL 92 2HG2 VAL 92 4.703 -2.564 6.437 685 H GLU 93 HN GLU 93 8.113 0.648 4.536 686 HA GLU 93 HA GLU 93 10.044 -1.304 5.140 687 HB2 GLU 93 2HB GLU 93 10.482 1.603 4.434 688 HB3 GLU 93 1HB GLU 93 11.653 0.304 4.272 689 HG2 GLU 93 2HG GLU 93 9.048 0.424 2.773 690 HG3 GLU 93 1HG GLU 93 10.587 1.010 2.145 691 H LYS 94 HN LYS 94 8.624 1.014 7.127 692 HA LYS 94 HA LYS 94 11.036 1.466 8.708 693 HB2 LYS 94 2HB LYS 94 8.373 2.818 9.027 694 HB3 LYS 94 1HB LYS 94 9.927 3.339 9.649 695 HG2 LYS 94 2HG LYS 94 9.046 3.293 6.777 696 HG3 LYS 94 1HG LYS 94 9.348 4.709 7.783 697 HD2 LYS 94 2HD LYS 94 11.474 2.677 7.164 698 HD3 LYS 94 1HD LYS 94 11.171 4.068 6.136 699 HE2 LYS 94 2HE LYS 94 11.516 5.510 8.172 700 HE3 LYS 94 1HE LYS 94 12.066 4.054 9.005 701 HZ1 LYS 94 3HZ LYS 94 13.765 3.800 7.241 702 HZ2 LYS 94 1HZ LYS 94 13.958 5.217 8.154 703 HZ3 LYS 94 2HZ LYS 94 13.285 5.294 6.598 704 H LEU 95 HN LEU 95 9.025 -0.957 8.707 705 HA LEU 95 HA LEU 95 7.645 -1.036 11.125 706 HB2 LEU 95 2HB LEU 95 8.971 -3.287 9.622 707 HB3 LEU 95 1HB LEU 95 7.863 -3.516 10.957 708 HG LEU 95 HG LEU 95 7.208 -2.299 8.273 709 HD11 LEU 95 1HD1 LEU 95 6.344 -4.879 9.571 710 HD12 LEU 95 2HD1 LEU 95 7.470 -4.719 8.223 711 HD13 LEU 95 3HD1 LEU 95 5.778 -4.263 8.020 712 HD21 LEU 95 3HD2 LEU 95 4.888 -2.251 9.082 713 HD22 LEU 95 1HD2 LEU 95 5.938 -1.182 10.015 714 HD23 LEU 95 2HD2 LEU 95 5.447 -2.738 10.683 715 H GLY 96 HN GLY 96 8.168 -1.466 13.215 716 HA2 GLY 96 2HA GLY 96 11.027 -1.398 13.833 717 HA3 GLY 96 1HA GLY 96 9.718 -1.020 14.941 718 H ASN 97 HN ASN 97 8.585 -2.739 15.963 719 HA ASN 97 HA ASN 97 10.012 -5.319 15.857 720 HB2 ASN 97 2HB ASN 97 9.114 -3.967 18.413 721 HB3 ASN 97 1HB ASN 97 9.979 -5.492 18.281 722 HD21 ASN 97 1HD2 ASN 97 10.185 -2.059 18.137 723 HD22 ASN 97 2HD2 ASN 97 11.911 -1.943 18.152 724 H GLU 98 HN GLU 98 7.298 -3.953 17.722 725 HA GLU 98 HA GLU 98 5.773 -6.323 17.690 726 HB2 GLU 98 2HB GLU 98 4.933 -3.447 18.119 727 HB3 GLU 98 1HB GLU 98 3.884 -4.828 18.399 728 HG2 GLU 98 2HG GLU 98 6.490 -4.321 19.818 729 HG3 GLU 98 1HG GLU 98 4.892 -3.942 20.458 730 H GLU 99 HN GLU 99 6.002 -3.640 15.500 731 HA GLU 99 HA GLU 99 3.605 -4.036 14.084 732 HB2 GLU 99 2HB GLU 99 6.194 -2.850 13.064 733 HB3 GLU 99 1HB GLU 99 4.610 -2.653 12.335 734 HG2 GLU 99 2HG GLU 99 5.052 -0.656 13.487 735 HG3 GLU 99 1HG GLU 99 3.888 -1.535 14.477 736 H GLN 100 HN GLN 100 6.863 -5.362 13.639 737 HA GLN 100 HA GLN 100 6.349 -6.644 11.172 738 HB2 GLN 100 2HB GLN 100 8.339 -7.370 13.330 739 HB3 GLN 100 1HB GLN 100 8.331 -8.034 11.704 740 HG2 GLN 100 2HG GLN 100 8.647 -5.697 10.854 741 HG3 GLN 100 1HG GLN 100 8.885 -5.199 12.529 742 HE21 GLN 100 1HE2 GLN 100 11.001 -4.570 12.210 743 HE22 GLN 100 2HE2 GLN 100 12.284 -5.701 11.945 744 H ALA 101 HN ALA 101 6.179 -7.737 14.522 745 HA ALA 101 HA ALA 101 5.517 -10.414 14.005 746 HB1 ALA 101 1HB ALA 101 6.314 -9.625 16.182 747 HB2 ALA 101 2HB ALA 101 4.792 -10.502 16.330 748 HB3 ALA 101 3HB ALA 101 4.805 -8.741 16.411 749 H LEU 102 HN LEU 102 3.481 -7.566 14.557 750 HA LEU 102 HA LEU 102 1.005 -8.950 14.482 751 HB2 LEU 102 2HB LEU 102 1.692 -6.518 15.268 752 HB3 LEU 102 1HB LEU 102 1.273 -6.095 13.624 753 HG LEU 102 HG LEU 102 -0.560 -5.660 15.164 754 HD11 LEU 102 1HD1 LEU 102 -1.158 -7.934 13.289 755 HD12 LEU 102 2HD1 LEU 102 -1.118 -6.221 12.870 756 HD13 LEU 102 3HD1 LEU 102 -2.342 -6.828 13.984 757 HD21 LEU 102 3HD2 LEU 102 -1.747 -7.516 16.241 758 HD22 LEU 102 1HD2 LEU 102 -0.098 -7.339 16.837 759 HD23 LEU 102 2HD2 LEU 102 -0.487 -8.621 15.691 760 H LEU 103 HN LEU 103 2.794 -7.083 12.073 761 HA LEU 103 HA LEU 103 1.085 -7.297 9.901 762 HB2 LEU 103 2HB LEU 103 3.351 -6.033 10.257 763 HB3 LEU 103 1HB LEU 103 4.060 -7.482 9.580 764 HG LEU 103 HG LEU 103 3.776 -5.667 7.942 765 HD11 LEU 103 1HD1 LEU 103 2.781 -6.995 6.162 766 HD12 LEU 103 2HD1 LEU 103 2.102 -8.099 7.359 767 HD13 LEU 103 3HD1 LEU 103 3.850 -7.970 7.170 768 HD21 LEU 103 3HD2 LEU 103 0.831 -6.104 8.397 769 HD22 LEU 103 1HD2 LEU 103 1.539 -5.110 7.122 770 HD23 LEU 103 2HD2 LEU 103 1.752 -4.660 8.815 771 H PHE 104 HN PHE 104 3.667 -9.500 10.930 772 HA PHE 104 HA PHE 104 3.607 -11.349 8.876 773 HB2 PHE 104 2HB PHE 104 5.265 -11.407 10.671 774 HB3 PHE 104 1HB PHE 104 4.021 -11.864 11.828 775 HD1 PHE 104 1HD PHE 104 5.612 -13.000 8.669 776 HD2 PHE 104 2HD PHE 104 3.631 -14.098 12.270 777 HE1 PHE 104 1HE PHE 104 6.028 -15.372 8.172 778 HE2 PHE 104 2HE PHE 104 4.050 -16.474 11.785 779 HZ PHE 104 HZ PHE 104 5.249 -17.112 9.730 780 H SER 105 HN SER 105 1.645 -11.361 11.842 781 HA SER 105 HA SER 105 0.196 -13.681 11.264 782 HB2 SER 105 2HB SER 105 -0.520 -11.283 12.959 783 HB3 SER 105 1HB SER 105 -1.357 -12.827 12.986 784 HG SER 105 HG SER 105 0.548 -13.815 13.687 785 H ILE 106 HN ILE 106 -0.313 -10.317 10.372 786 HA ILE 106 HA ILE 106 -2.932 -10.549 9.367 787 HB ILE 106 HB ILE 106 -0.738 -8.686 8.434 788 HG12 ILE 106 2HG1 ILE 106 -2.932 -8.284 10.480 789 HG13 ILE 106 1HG1 ILE 106 -1.225 -8.496 10.842 790 HG21 ILE 106 1HG2 ILE 106 -2.546 -7.268 7.610 791 HG22 ILE 106 2HG2 ILE 106 -3.729 -8.481 8.100 792 HG23 ILE 106 3HG2 ILE 106 -2.570 -8.846 6.821 793 HD11 ILE 106 3HD1 ILE 106 -0.714 -6.412 9.681 794 HD12 ILE 106 1HD1 ILE 106 -1.877 -6.163 10.983 795 HD13 ILE 106 2HD1 ILE 106 -2.426 -6.205 9.309 796 H PHE 107 HN PHE 107 0.221 -10.870 7.729 797 HA PHE 107 HA PHE 107 -0.844 -11.530 5.203 798 HB2 PHE 107 2HB PHE 107 1.831 -11.875 6.497 799 HB3 PHE 107 1HB PHE 107 1.502 -12.688 4.974 800 HD1 PHE 107 1HD PHE 107 -0.441 -10.199 4.254 801 HD2 PHE 107 2HD PHE 107 3.655 -10.702 5.288 802 HE1 PHE 107 1HE PHE 107 0.118 -8.150 3.014 803 HE2 PHE 107 2HE PHE 107 4.222 -8.654 4.048 804 HZ PHE 107 HZ PHE 107 2.456 -7.376 2.908 805 H ASN 108 HN ASN 108 -0.117 -13.453 8.045 806 HA ASN 108 HA ASN 108 -0.415 -15.982 6.798 807 HB2 ASN 108 2HB ASN 108 0.680 -15.694 9.000 808 HB3 ASN 108 1HB ASN 108 -0.870 -15.241 9.699 809 HD21 ASN 108 1HD2 ASN 108 -2.300 -16.802 10.262 810 HD22 ASN 108 2HD2 ASN 108 -1.983 -18.496 10.115 811 H ARG 109 HN ARG 109 -2.649 -13.789 8.419 812 HA ARG 109 HA ARG 109 -4.952 -15.393 8.303 813 HB2 ARG 109 2HB ARG 109 -4.813 -13.343 9.647 814 HB3 ARG 109 1HB ARG 109 -4.691 -12.375 8.188 815 HG2 ARG 109 2HG ARG 109 -7.080 -14.107 8.505 816 HG3 ARG 109 1HG ARG 109 -6.963 -12.659 9.505 817 HD2 ARG 109 2HD ARG 109 -6.652 -11.304 7.480 818 HD3 ARG 109 1HD ARG 109 -6.795 -12.758 6.493 819 HE ARG 109 HE ARG 109 -9.073 -12.543 8.114 820 HH11 ARG 109 1HH1 ARG 109 -7.576 -10.900 5.410 821 HH12 ARG 109 2HH1 ARG 109 -9.089 -10.360 4.732 822 HH21 ARG 109 1HH2 ARG 109 -11.066 -11.817 7.211 823 HH22 ARG 109 2HH2 ARG 109 -11.047 -10.856 5.763 824 H PHE 110 HN PHE 110 -3.618 -13.048 5.985 825 HA PHE 110 HA PHE 110 -5.631 -13.301 4.044 826 HB2 PHE 110 2HB PHE 110 -2.704 -12.610 3.772 827 HB3 PHE 110 1HB PHE 110 -3.837 -12.554 2.431 828 HD1 PHE 110 1HD PHE 110 -6.220 -11.429 3.864 829 HD2 PHE 110 2HD PHE 110 -2.101 -10.373 3.985 830 HE1 PHE 110 1HE PHE 110 -6.832 -9.118 4.454 831 HE2 PHE 110 2HE PHE 110 -2.706 -8.069 4.583 832 HZ PHE 110 HZ PHE 110 -5.071 -7.436 4.818 833 H ARG 111 HN ARG 111 -2.523 -14.993 4.368 834 HA ARG 111 HA ARG 111 -2.777 -16.592 2.074 835 HB2 ARG 111 2HB ARG 111 -0.649 -16.275 3.232 836 HB3 ARG 111 1HB ARG 111 -1.260 -17.143 4.627 837 HG2 ARG 111 2HG ARG 111 -0.028 -18.764 3.607 838 HG3 ARG 111 1HG ARG 111 -1.626 -19.073 2.929 839 HD2 ARG 111 2HD ARG 111 0.635 -17.570 1.622 840 HD3 ARG 111 1HD ARG 111 0.042 -19.167 1.193 841 HE ARG 111 HE ARG 111 -1.401 -16.640 0.754 842 HH11 ARG 111 1HH1 ARG 111 -1.007 -20.060 0.108 843 HH12 ARG 111 2HH1 ARG 111 -1.898 -20.008 -1.387 844 HH21 ARG 111 1HH2 ARG 111 -2.598 -16.570 -1.192 845 HH22 ARG 111 2HH2 ARG 111 -2.841 -18.036 -2.100 846 H ASN 112 HN ASN 112 -3.745 -17.158 5.424 847 HA ASN 112 HA ASN 112 -4.357 -19.875 5.253 848 HB2 ASN 112 2HB ASN 112 -4.817 -17.714 7.123 849 HB3 ASN 112 1HB ASN 112 -6.196 -18.805 7.068 850 HD21 ASN 112 1HD2 ASN 112 -2.901 -19.786 6.442 851 HD22 ASN 112 2HD2 ASN 112 -2.718 -20.754 7.862 852 H SER 113 HN SER 113 -6.365 -17.064 4.532 853 HA SER 113 HA SER 113 -8.618 -18.835 3.947 854 HB2 SER 113 2HB SER 113 -8.898 -16.828 5.432 855 HB3 SER 113 1HB SER 113 -8.569 -15.811 4.031 856 HG SER 113 HG SER 113 -10.769 -17.505 4.536 857 H GLY 114 HN GLY 114 -6.256 -16.846 2.377 858 HA2 GLY 114 2HA GLY 114 -5.824 -16.585 0.110 859 HA3 GLY 114 1HA GLY 114 -7.247 -17.561 -0.244 860 H LYS 115 HN LYS 115 -7.537 -14.940 1.941 861 HA LYS 115 HA LYS 115 -9.183 -13.496 -0.014 862 HB2 LYS 115 2HB LYS 115 -10.242 -14.684 2.000 863 HB3 LYS 115 1HB LYS 115 -9.481 -13.456 2.988 864 HG2 LYS 115 2HG LYS 115 -10.747 -11.745 1.726 865 HG3 LYS 115 1HG LYS 115 -11.565 -13.048 0.864 866 HD2 LYS 115 2HD LYS 115 -12.353 -13.925 3.036 867 HD3 LYS 115 1HD LYS 115 -11.602 -12.542 3.834 868 HE2 LYS 115 2HE LYS 115 -13.037 -11.108 2.274 869 HE3 LYS 115 1HE LYS 115 -13.947 -12.588 1.964 870 HZ1 LYS 115 3HZ LYS 115 -15.021 -11.452 3.725 871 HZ2 LYS 115 1HZ LYS 115 -13.560 -11.218 4.560 872 HZ3 LYS 115 2HZ LYS 115 -14.220 -12.774 4.421 873 H GLY 116 HN GLY 116 -9.451 -11.139 0.747 874 HA2 GLY 116 2HA GLY 116 -8.604 -9.160 1.649 875 HA3 GLY 116 1HA GLY 116 -7.183 -10.043 2.191 876 H PHE 117 HN PHE 117 -6.902 -7.609 1.043 877 HA PHE 117 HA PHE 117 -5.733 -8.270 -1.567 878 HB2 PHE 117 2HB PHE 117 -6.981 -5.689 -0.642 879 HB3 PHE 117 1HB PHE 117 -5.966 -5.796 -2.076 880 HD1 PHE 117 1HD PHE 117 -9.167 -6.782 -0.578 881 HD2 PHE 117 2HD PHE 117 -6.763 -6.800 -4.089 882 HE1 PHE 117 1HE PHE 117 -11.121 -7.455 -1.909 883 HE2 PHE 117 2HE PHE 117 -8.713 -7.471 -5.427 884 HZ PHE 117 HZ PHE 117 -10.897 -7.802 -4.339 885 H LEU 118 HN LEU 118 -5.427 -5.682 0.789 886 HA LEU 118 HA LEU 118 -3.671 -4.803 1.935 887 HB2 LEU 118 2HB LEU 118 -2.978 -7.314 2.093 888 HB3 LEU 118 1HB LEU 118 -1.828 -6.885 0.848 889 HG LEU 118 HG LEU 118 -0.919 -6.917 3.188 890 HD11 LEU 118 1HD1 LEU 118 0.372 -4.849 2.939 891 HD12 LEU 118 2HD1 LEU 118 -0.734 -4.326 1.669 892 HD13 LEU 118 3HD1 LEU 118 0.268 -5.758 1.432 893 HD21 LEU 118 3HD2 LEU 118 -2.796 -5.961 4.359 894 HD22 LEU 118 1HD2 LEU 118 -2.633 -4.457 3.451 895 HD23 LEU 118 2HD2 LEU 118 -1.372 -4.944 4.584 896 H LEU 119 HN LEU 119 -2.648 -3.072 1.348 897 HA LEU 119 HA LEU 119 -1.427 -2.913 -1.319 898 HB2 LEU 119 2HB LEU 119 -3.644 -1.836 -1.353 899 HB3 LEU 119 1HB LEU 119 -3.164 -0.812 -0.014 900 HG LEU 119 HG LEU 119 -1.416 0.201 -1.455 901 HD11 LEU 119 1HD1 LEU 119 -2.713 -1.440 -3.625 902 HD12 LEU 119 2HD1 LEU 119 -1.074 -1.638 -3.001 903 HD13 LEU 119 3HD1 LEU 119 -1.515 -0.170 -3.871 904 HD21 LEU 119 3HD2 LEU 119 -4.247 0.332 -2.494 905 HD22 LEU 119 1HD2 LEU 119 -2.974 1.496 -2.861 906 HD23 LEU 119 2HD2 LEU 119 -3.549 1.315 -1.205 907 H LEU 120 HN LEU 120 0.579 -2.072 -1.321 908 HA LEU 120 HA LEU 120 1.468 -0.692 1.127 909 HB2 LEU 120 2HB LEU 120 3.012 -2.617 -0.613 910 HB3 LEU 120 1HB LEU 120 3.713 -1.678 0.689 911 HG LEU 120 HG LEU 120 1.537 -3.739 1.051 912 HD11 LEU 120 1HD1 LEU 120 4.492 -3.928 1.630 913 HD12 LEU 120 2HD1 LEU 120 3.649 -4.752 0.319 914 HD13 LEU 120 3HD1 LEU 120 3.278 -5.154 1.995 915 HD21 LEU 120 3HD2 LEU 120 1.540 -1.970 2.743 916 HD22 LEU 120 1HD2 LEU 120 3.251 -2.268 3.050 917 HD23 LEU 120 2HD2 LEU 120 2.058 -3.513 3.420 918 H GLY 121 HN GLY 121 2.042 1.330 0.780 919 HA2 GLY 121 2HA GLY 121 2.825 2.213 -1.890 920 HA3 GLY 121 1HA GLY 121 2.556 3.244 -0.486 921 H SER 122 HN SER 122 4.281 3.947 0.629 922 HA SER 122 HA SER 122 6.369 4.079 1.517 923 HB2 SER 122 2HB SER 122 6.802 1.211 0.660 924 HB3 SER 122 1HB SER 122 7.563 2.068 2.001 925 HG SER 122 HG SER 122 5.018 0.950 1.800 926 H GLU 123 HN GLU 123 8.714 2.669 0.649 927 HA GLU 123 HA GLU 123 9.161 3.348 -2.126 928 HB2 GLU 123 2HB GLU 123 9.603 5.375 -0.443 929 HB3 GLU 123 1HB GLU 123 11.098 4.504 -0.147 930 HG2 GLU 123 2HG GLU 123 10.302 5.110 -2.951 931 HG3 GLU 123 1HG GLU 123 10.967 6.394 -1.947 932 H TYR 124 HN TYR 124 11.551 2.602 -2.640 933 HA TYR 124 HA TYR 124 12.992 0.836 -2.741 934 HB2 TYR 124 2HB TYR 124 12.367 0.464 0.204 935 HB3 TYR 124 1HB TYR 124 13.698 -0.287 -0.665 936 HD1 TYR 124 2HD TYR 124 15.442 1.297 -1.715 937 HD2 TYR 124 1HD TYR 124 12.653 2.514 1.257 938 HE1 TYR 124 2HE TYR 124 16.868 3.219 -1.169 939 HE2 TYR 124 1HE TYR 124 14.077 4.439 1.813 940 HH TYR 124 HH TYR 124 16.640 5.448 -0.155 941 H THR 125 HN THR 125 12.868 -1.718 -1.492 942 HA THR 125 HA THR 125 10.190 -2.638 -2.264 943 HB THR 125 HB THR 125 11.376 -4.723 -3.177 944 HG1 THR 125 1HG THR 125 13.546 -2.866 -3.211 945 HG21 THR 125 3HG2 THR 125 11.704 -3.710 -5.383 946 HG22 THR 125 1HG2 THR 125 11.695 -2.105 -4.653 947 HG23 THR 125 2HG2 THR 125 10.240 -3.099 -4.617 948 HA PRO 126 HA PRO 126 10.199 -4.794 1.553 949 HB2 PRO 126 2HB PRO 126 8.745 -7.022 0.957 950 HB3 PRO 126 1HB PRO 126 8.036 -5.417 1.145 951 HG2 PRO 126 2HG PRO 126 8.731 -6.894 -1.354 952 HG3 PRO 126 1HG PRO 126 7.309 -5.896 -0.998 953 HD2 PRO 126 2HD PRO 126 9.408 -4.996 -2.464 954 HD3 PRO 126 1HD PRO 126 8.417 -3.932 -1.447 955 H GLN 127 HN GLN 127 11.434 -6.299 -1.253 956 HA GLN 127 HA GLN 127 12.502 -8.653 -0.023 957 HB2 GLN 127 2HB GLN 127 13.217 -7.306 -2.639 958 HB3 GLN 127 1HB GLN 127 13.739 -8.910 -2.146 959 HG2 GLN 127 2HG GLN 127 11.485 -9.725 -2.200 960 HG3 GLN 127 1HG GLN 127 10.863 -8.105 -2.500 961 HE21 GLN 127 1HE2 GLN 127 13.764 -9.334 -4.012 962 HE22 GLN 127 2HE2 GLN 127 13.114 -9.440 -5.612 963 H GLN 128 HN GLN 128 13.411 -5.372 -0.188 964 HA GLN 128 HA GLN 128 16.246 -5.892 0.233 965 HB2 GLN 128 2HB GLN 128 15.203 -4.000 -1.214 966 HB3 GLN 128 1HB GLN 128 14.944 -3.187 0.322 967 HG2 GLN 128 2HG GLN 128 16.980 -2.387 -0.630 968 HG3 GLN 128 1HG GLN 128 17.371 -3.374 0.779 969 HE21 GLN 128 1HE2 GLN 128 17.406 -3.172 -2.684 970 HE22 GLN 128 2HE2 GLN 128 18.516 -4.471 -2.955 971 H LEU 129 HN LEU 129 13.479 -5.714 2.058 972 HA LEU 129 HA LEU 129 14.349 -4.210 4.290 973 HB2 LEU 129 2HB LEU 129 12.150 -6.189 3.847 974 HB3 LEU 129 1HB LEU 129 12.486 -5.577 5.452 975 HG LEU 129 HG LEU 129 11.775 -3.866 3.073 976 HD11 LEU 129 1HD1 LEU 129 9.632 -3.548 4.230 977 HD12 LEU 129 2HD1 LEU 129 10.124 -4.725 5.449 978 HD13 LEU 129 3HD1 LEU 129 9.886 -5.233 3.778 979 HD21 LEU 129 3HD2 LEU 129 12.050 -3.183 5.997 980 HD22 LEU 129 1HD2 LEU 129 11.593 -2.078 4.703 981 HD23 LEU 129 2HD2 LEU 129 13.214 -2.770 4.738 982 H VAL 130 HN VAL 130 15.503 -4.709 5.985 983 HA VAL 130 HA VAL 130 16.519 -7.412 6.337 984 HB VAL 130 HB VAL 130 17.138 -4.935 7.971 985 HG11 VAL 130 1HG1 VAL 130 17.602 -7.033 9.132 986 HG12 VAL 130 2HG1 VAL 130 19.095 -6.194 8.712 987 HG13 VAL 130 3HG1 VAL 130 18.567 -7.582 7.762 988 HG21 VAL 130 3HG2 VAL 130 19.205 -4.785 6.669 989 HG22 VAL 130 1HG2 VAL 130 17.787 -4.625 5.631 990 HG23 VAL 130 2HG2 VAL 130 18.680 -6.146 5.677 991 H ILE 131 HN ILE 131 14.582 -8.401 6.904 992 HA ILE 131 HA ILE 131 13.619 -7.839 9.621 993 HB ILE 131 HB ILE 131 11.285 -8.290 8.838 994 HG12 ILE 131 2HG1 ILE 131 12.507 -7.953 6.088 995 HG13 ILE 131 1HG1 ILE 131 11.865 -9.451 6.745 996 HG21 ILE 131 1HG2 ILE 131 12.613 -5.890 7.586 997 HG22 ILE 131 2HG2 ILE 131 12.042 -6.011 9.250 998 HG23 ILE 131 3HG2 ILE 131 10.889 -6.064 7.917 999 HD11 ILE 131 3HD1 ILE 131 10.294 -8.433 5.207 1000 HD12 ILE 131 1HD1 ILE 131 10.284 -6.960 6.176 1001 HD13 ILE 131 2HD1 ILE 131 9.637 -8.458 6.844 1002 H ARG 132 HN ARG 132 11.823 -9.744 9.997 1003 HA ARG 132 HA ARG 132 13.174 -12.159 10.261 1004 HB2 ARG 132 2HB ARG 132 10.200 -12.028 9.792 1005 HB3 ARG 132 1HB ARG 132 11.089 -13.154 10.802 1006 HG2 ARG 132 2HG ARG 132 10.729 -10.222 11.372 1007 HG3 ARG 132 1HG ARG 132 9.786 -11.528 12.090 1008 HD2 ARG 132 2HD ARG 132 11.964 -12.461 12.956 1009 HD3 ARG 132 1HD ARG 132 12.723 -10.955 12.430 1010 HE ARG 132 HE ARG 132 10.557 -11.112 14.436 1011 HH11 ARG 132 1HH1 ARG 132 13.472 -9.627 13.164 1012 HH12 ARG 132 2HH1 ARG 132 13.592 -8.476 14.454 1013 HH21 ARG 132 1HH2 ARG 132 10.712 -9.563 16.117 1014 HH22 ARG 132 2HH2 ARG 132 12.019 -8.418 16.101 1015 H GLU 133 HN GLU 133 13.655 -13.795 8.865 1016 HA GLU 133 HA GLU 133 13.238 -13.598 6.098 1017 HB2 GLU 133 2HB GLU 133 14.980 -15.028 7.149 1018 HB3 GLU 133 1HB GLU 133 13.719 -16.119 7.708 1019 HG2 GLU 133 2HG GLU 133 13.098 -16.582 5.383 1020 HG3 GLU 133 1HG GLU 133 14.386 -15.509 4.836 1021 H ASP 134 HN ASP 134 11.460 -15.217 8.639 1022 HA ASP 134 HA ASP 134 9.533 -16.601 7.192 1023 HB2 ASP 134 2HB ASP 134 8.980 -15.126 9.774 1024 HB3 ASP 134 1HB ASP 134 8.235 -16.613 9.203 1025 H LEU 135 HN LEU 135 9.729 -13.224 8.097 1026 HA LEU 135 HA LEU 135 7.040 -12.625 7.258 1027 HB2 LEU 135 2HB LEU 135 8.012 -11.455 9.155 1028 HB3 LEU 135 1HB LEU 135 9.314 -10.854 8.149 1029 HG LEU 135 HG LEU 135 7.672 -9.534 6.849 1030 HD11 LEU 135 1HD1 LEU 135 5.412 -9.233 7.759 1031 HD12 LEU 135 2HD1 LEU 135 5.726 -10.518 8.926 1032 HD13 LEU 135 3HD1 LEU 135 5.694 -10.883 7.201 1033 HD21 LEU 135 3HD2 LEU 135 7.289 -7.842 8.548 1034 HD22 LEU 135 1HD2 LEU 135 8.898 -8.543 8.728 1035 HD23 LEU 135 2HD2 LEU 135 7.598 -9.024 9.820 1036 H ARG 136 HN ARG 136 10.298 -12.269 5.973 1037 HA ARG 136 HA ARG 136 9.531 -10.419 3.942 1038 HB2 ARG 136 2HB ARG 136 11.866 -10.725 4.920 1039 HB3 ARG 136 1HB ARG 136 12.010 -12.127 3.865 1040 HG2 ARG 136 2HG ARG 136 11.646 -10.719 1.917 1041 HG3 ARG 136 1HG ARG 136 11.444 -9.310 2.958 1042 HD2 ARG 136 2HD ARG 136 13.661 -9.244 2.110 1043 HD3 ARG 136 1HD ARG 136 13.768 -9.721 3.803 1044 HE ARG 136 HE ARG 136 13.651 -12.053 2.273 1045 HH11 ARG 136 1HH1 ARG 136 15.785 -9.330 2.804 1046 HH12 ARG 136 2HH1 ARG 136 17.225 -10.194 2.356 1047 HH21 ARG 136 1HH2 ARG 136 15.544 -13.199 1.665 1048 HH22 ARG 136 2HH2 ARG 136 17.092 -12.403 1.743 1049 H THR 137 HN THR 137 9.662 -13.927 4.114 1050 HA THR 137 HA THR 137 9.417 -14.373 1.321 1051 HB THR 137 HB THR 137 8.423 -16.600 2.022 1052 HG1 THR 137 1HG THR 137 9.092 -16.806 4.480 1053 HG21 THR 137 3HG2 THR 137 11.082 -15.802 3.216 1054 HG22 THR 137 1HG2 THR 137 10.805 -16.342 1.559 1055 HG23 THR 137 2HG2 THR 137 10.553 -17.454 2.904 1056 H ARG 138 HN ARG 138 7.121 -13.776 3.917 1057 HA ARG 138 HA ARG 138 4.763 -14.063 2.381 1058 HB2 ARG 138 2HB ARG 138 5.294 -12.381 4.835 1059 HB3 ARG 138 1HB ARG 138 3.702 -12.784 4.201 1060 HG2 ARG 138 2HG ARG 138 5.711 -14.813 5.144 1061 HG3 ARG 138 1HG ARG 138 4.411 -14.164 6.135 1062 HD2 ARG 138 2HD ARG 138 2.815 -14.961 4.361 1063 HD3 ARG 138 1HD ARG 138 4.179 -15.787 3.613 1064 HE ARG 138 HE ARG 138 3.720 -16.422 6.398 1065 HH11 ARG 138 1HH1 ARG 138 3.190 -17.312 3.056 1066 HH12 ARG 138 2HH1 ARG 138 2.710 -18.939 3.422 1067 HH21 ARG 138 1HH2 ARG 138 3.052 -18.561 6.897 1068 HH22 ARG 138 2HH2 ARG 138 2.588 -19.636 5.614 1069 H MET 139 HN MET 139 7.031 -11.444 2.883 1070 HA MET 139 HA MET 139 5.500 -9.367 1.723 1071 HB2 MET 139 2HB MET 139 8.482 -9.733 2.017 1072 HB3 MET 139 1HB MET 139 7.741 -8.265 1.400 1073 HG2 MET 139 2HG MET 139 7.189 -9.430 4.113 1074 HG3 MET 139 1HG MET 139 8.385 -8.177 3.792 1075 HE1 MET 139 3HE MET 139 5.612 -6.124 5.603 1076 HE2 MET 139 1HE MET 139 7.326 -6.529 5.538 1077 HE3 MET 139 2HE MET 139 6.145 -7.764 5.974 1078 H ALA 140 HN ALA 140 7.155 -12.044 0.388 1079 HA ALA 140 HA ALA 140 7.664 -10.841 -2.181 1080 HB1 ALA 140 1HB ALA 140 9.166 -12.548 -1.279 1081 HB2 ALA 140 2HB ALA 140 8.483 -13.039 -2.830 1082 HB3 ALA 140 3HB ALA 140 7.855 -13.728 -1.333 1083 H TYR 141 HN TYR 141 4.842 -11.557 -0.854 1084 HA TYR 141 HA TYR 141 3.673 -13.000 -3.091 1085 HB2 TYR 141 2HB TYR 141 2.602 -12.008 -0.465 1086 HB3 TYR 141 1HB TYR 141 1.517 -12.546 -1.737 1087 HD1 TYR 141 2HD TYR 141 4.242 -13.623 0.512 1088 HD2 TYR 141 1HD TYR 141 1.150 -14.849 -2.136 1089 HE1 TYR 141 2HE TYR 141 4.508 -15.937 1.289 1090 HE2 TYR 141 1HE TYR 141 1.400 -17.170 -1.364 1091 HH TYR 141 HH TYR 141 2.951 -18.604 -0.290 1092 H CYS 142 HN CYS 142 4.382 -9.798 -2.360 1093 HA CYS 142 HA CYS 142 2.021 -8.677 -3.593 1094 HB2 CYS 142 2HB CYS 142 2.936 -6.515 -2.985 1095 HB3 CYS 142 1HB CYS 142 3.030 -7.591 -1.596 1096 HG CYS 142 HG CYS 142 5.830 -7.866 -3.239 1097 H LEU 143 HN LEU 143 1.946 -7.736 -5.525 1098 HA LEU 143 HA LEU 143 4.070 -8.209 -7.419 1099 HB2 LEU 143 2HB LEU 143 1.420 -6.796 -7.658 1100 HB3 LEU 143 1HB LEU 143 2.555 -6.906 -8.981 1101 HG LEU 143 HG LEU 143 2.363 -9.422 -8.721 1102 HD11 LEU 143 1HD1 LEU 143 1.348 -9.501 -6.520 1103 HD12 LEU 143 2HD1 LEU 143 0.300 -10.260 -7.718 1104 HD13 LEU 143 3HD1 LEU 143 -0.065 -8.637 -7.130 1105 HD21 LEU 143 3HD2 LEU 143 1.384 -8.235 -10.572 1106 HD22 LEU 143 1HD2 LEU 143 -0.018 -7.808 -9.591 1107 HD23 LEU 143 2HD2 LEU 143 0.277 -9.492 -10.022 1108 H VAL 144 HN VAL 144 5.094 -6.484 -8.650 1109 HA VAL 144 HA VAL 144 5.417 -4.059 -7.001 1110 HB VAL 144 HB VAL 144 7.528 -5.428 -8.680 1111 HG11 VAL 144 1HG1 VAL 144 7.722 -3.051 -6.836 1112 HG12 VAL 144 2HG1 VAL 144 7.813 -3.012 -8.597 1113 HG13 VAL 144 3HG1 VAL 144 9.072 -3.824 -7.664 1114 HG21 VAL 144 3HG2 VAL 144 8.607 -5.974 -6.541 1115 HG22 VAL 144 1HG2 VAL 144 7.014 -6.719 -6.672 1116 HG23 VAL 144 2HG2 VAL 144 7.235 -5.279 -5.676 1117 H TYR 145 HN TYR 145 4.601 -2.367 -7.996 1118 HA TYR 145 HA TYR 145 4.760 -2.223 -10.929 1119 HB2 TYR 145 2HB TYR 145 2.867 -1.002 -8.949 1120 HB3 TYR 145 1HB TYR 145 3.080 -0.273 -10.533 1121 HD1 TYR 145 1HD TYR 145 2.856 -1.982 -12.547 1122 HD2 TYR 145 2HD TYR 145 1.186 -2.557 -8.682 1123 HE1 TYR 145 1HE TYR 145 1.200 -3.522 -13.501 1124 HE2 TYR 145 2HE TYR 145 -0.476 -4.107 -9.625 1125 HH TYR 145 HH TYR 145 -1.554 -4.522 -11.859 1126 H GLU 146 HN GLU 146 6.285 -0.996 -11.735 1127 HA GLU 146 HA GLU 146 7.513 1.094 -10.156 1128 HB2 GLU 146 2HB GLU 146 8.895 1.438 -12.248 1129 HB3 GLU 146 1HB GLU 146 9.027 -0.151 -11.509 1130 HG2 GLU 146 2HG GLU 146 7.558 -1.094 -13.169 1131 HG3 GLU 146 1HG GLU 146 7.277 0.498 -13.869 1132 H VAL 147 HN VAL 147 6.632 3.032 -10.015 1133 HA VAL 147 HA VAL 147 4.713 3.847 -12.075 1134 HB VAL 147 HB VAL 147 5.030 4.989 -9.296 1135 HG11 VAL 147 1HG1 VAL 147 3.979 6.513 -10.873 1136 HG12 VAL 147 2HG1 VAL 147 2.802 5.926 -9.699 1137 HG13 VAL 147 3HG1 VAL 147 2.823 5.263 -11.332 1138 HG21 VAL 147 3HG2 VAL 147 3.033 3.687 -8.712 1139 HG22 VAL 147 1HG2 VAL 147 4.386 2.647 -9.156 1140 HG23 VAL 147 2HG2 VAL 147 3.073 2.924 -10.301 1141 H LYS 148 HN LYS 148 5.848 4.894 -13.599 1142 HA LYS 148 HA LYS 148 6.986 6.524 -14.656 1143 HB2 LYS 148 2HB LYS 148 5.386 8.006 -13.576 1144 HB3 LYS 148 1HB LYS 148 6.400 8.095 -12.143 1145 HG2 LYS 148 2HG LYS 148 6.637 10.093 -13.484 1146 HG3 LYS 148 1HG LYS 148 8.152 9.190 -13.447 1147 HD2 LYS 148 2HD LYS 148 7.598 8.227 -15.651 1148 HD3 LYS 148 1HD LYS 148 6.135 9.215 -15.692 1149 HE2 LYS 148 2HE LYS 148 7.812 10.344 -16.967 1150 HE3 LYS 148 1HE LYS 148 7.584 11.235 -15.463 1151 HZ1 LYS 148 3HZ LYS 148 9.558 9.910 -14.618 1152 HZ2 LYS 148 1HZ LYS 148 9.883 11.104 -15.777 1153 HZ3 LYS 148 2HZ LYS 148 9.835 9.476 -16.232 1154 HA PRO 149 HA PRO 149 11.037 5.585 -12.753 1155 HB2 PRO 149 2HB PRO 149 11.800 5.230 -15.563 1156 HB3 PRO 149 1HB PRO 149 11.929 4.095 -14.216 1157 HG2 PRO 149 2HG PRO 149 10.157 3.743 -16.220 1158 HG3 PRO 149 1HG PRO 149 9.813 3.247 -14.552 1159 HD2 PRO 149 2HD PRO 149 8.906 5.694 -16.026 1160 HD3 PRO 149 1HD PRO 149 7.985 4.626 -14.945 Start of MODEL 16 1 H1 MET 1 H1 MET 1 -9.195 48.214 59.968 2 H2 MET 1 H2 MET 1 -10.698 48.420 60.723 3 H3 MET 1 H3 MET 1 -10.612 48.208 59.041 4 HA MET 1 HA MET 1 -9.765 45.982 59.330 5 HB2 MET 1 2HB MET 1 -10.219 46.556 62.265 6 HB3 MET 1 1HB MET 1 -9.901 44.963 61.599 7 HG2 MET 1 2HG MET 1 -7.868 45.771 62.503 8 HG3 MET 1 1HG MET 1 -7.721 45.838 60.749 9 HE1 MET 1 2HE MET 1 -5.783 47.365 62.806 10 HE2 MET 1 3HE MET 1 -5.613 48.916 61.987 11 HE3 MET 1 1HE MET 1 -5.587 47.422 61.053 12 H GLY 2 HN GLY 2 -11.446 45.224 58.252 13 HA2 GLY 2 2HA GLY 2 -13.898 44.636 59.675 14 HA3 GLY 2 1HA GLY 2 -14.075 45.821 58.388 15 H HIS 3 HN HIS 3 -12.151 42.868 58.694 16 HA HIS 3 HA HIS 3 -12.056 40.942 57.506 17 HB2 HIS 3 2HB HIS 3 -14.813 41.755 56.572 18 HB3 HIS 3 1HB HIS 3 -14.059 40.212 56.197 19 HD1 HIS 3 1HD HIS 3 -14.142 38.403 57.970 20 HD2 HIS 3 2HD HIS 3 -15.564 42.076 59.304 21 HE1 HIS 3 1HE HIS 3 -15.193 37.953 60.202 22 HE2 HIS 3 2HE HIS 3 -16.250 40.139 60.875 23 H HIS 4 HN HIS 4 -12.278 40.061 55.169 24 HA HIS 4 HA HIS 4 -11.826 42.173 53.181 25 HB2 HIS 4 2HB HIS 4 -10.030 39.865 53.840 26 HB3 HIS 4 1HB HIS 4 -10.115 40.447 52.181 27 HD1 HIS 4 1HD HIS 4 -8.894 41.394 55.590 28 HD2 HIS 4 2HD HIS 4 -8.954 42.960 51.737 29 HE1 HIS 4 1HE HIS 4 -7.307 43.345 55.625 30 HE2 HIS 4 2HE HIS 4 -7.466 44.360 53.319 31 H HIS 5 HN HIS 5 -13.232 41.927 51.585 32 HA HIS 5 HA HIS 5 -14.378 39.249 51.207 33 HB2 HIS 5 2HB HIS 5 -16.574 40.305 50.773 34 HB3 HIS 5 1HB HIS 5 -15.992 40.584 52.406 35 HD1 HIS 5 1HD HIS 5 -17.836 42.287 50.061 36 HD2 HIS 5 2HD HIS 5 -14.419 43.331 52.194 37 HE1 HIS 5 1HE HIS 5 -17.768 44.802 50.054 38 HE2 HIS 5 2HE HIS 5 -15.613 45.407 51.209 39 H HIS 6 HN HIS 6 -13.242 38.682 49.425 40 HA HIS 6 HA HIS 6 -13.590 40.377 47.040 41 HB2 HIS 6 2HB HIS 6 -11.233 39.885 47.664 42 HB3 HIS 6 1HB HIS 6 -11.571 38.164 47.507 43 HD1 HIS 6 1HD HIS 6 -11.223 41.293 45.459 44 HD2 HIS 6 2HD HIS 6 -11.509 37.183 44.913 45 HE1 HIS 6 1HE HIS 6 -10.727 40.899 43.026 46 HE2 HIS 6 2HE HIS 6 -10.774 38.393 42.739 47 H HIS 7 HN HIS 7 -15.059 39.719 45.629 48 HA HIS 7 HA HIS 7 -15.412 36.862 45.157 49 HB2 HIS 7 2HB HIS 7 -17.863 36.991 45.334 50 HB3 HIS 7 1HB HIS 7 -17.094 37.366 46.871 51 HD1 HIS 7 1HD HIS 7 -19.554 38.609 44.517 52 HD2 HIS 7 2HD HIS 7 -17.056 40.266 47.403 53 HE1 HIS 7 1HE HIS 7 -20.494 40.894 45.003 54 HE2 HIS 7 2HE HIS 7 -18.892 41.931 46.653 55 H HIS 8 HN HIS 8 -15.765 36.410 43.052 56 HA HIS 8 HA HIS 8 -16.192 38.729 41.275 57 HB2 HIS 8 2HB HIS 8 -14.947 37.551 39.545 58 HB3 HIS 8 1HB HIS 8 -13.972 37.685 40.999 59 HD1 HIS 8 1HD HIS 8 -13.106 35.523 42.016 60 HD2 HIS 8 2HD HIS 8 -15.896 34.904 38.991 61 HE1 HIS 8 1HE HIS 8 -13.038 33.062 41.520 62 HE2 HIS 8 2HE HIS 8 -14.640 32.727 39.603 63 H SER 9 HN SER 9 -17.580 38.481 39.459 64 HA SER 9 HA SER 9 -19.213 36.074 39.369 65 HB2 SER 9 2HB SER 9 -21.322 37.478 39.513 66 HB3 SER 9 1HB SER 9 -20.431 37.272 41.023 67 HG SER 9 HG SER 9 -20.999 39.548 39.627 68 H HIS 10 HN HIS 10 -18.030 36.041 37.319 69 HA HIS 10 HA HIS 10 -19.721 36.489 35.176 70 HB2 HIS 10 2HB HIS 10 -19.050 38.923 35.632 71 HB3 HIS 10 1HB HIS 10 -17.442 38.475 35.077 72 HD1 HIS 10 1HD HIS 10 -20.749 39.492 33.889 73 HD2 HIS 10 2HD HIS 10 -17.374 37.676 32.288 74 HE1 HIS 10 1HE HIS 10 -21.014 39.657 31.397 75 HE2 HIS 10 2HE HIS 10 -18.855 38.757 30.457 76 H MET 11 HN MET 11 -19.087 34.476 34.509 77 HA MET 11 HA MET 11 -16.352 34.276 33.464 78 HB2 MET 11 2HB MET 11 -15.998 32.089 34.472 79 HB3 MET 11 1HB MET 11 -16.300 33.290 35.719 80 HG2 MET 11 2HG MET 11 -18.588 32.519 35.946 81 HG3 MET 11 1HG MET 11 -18.337 31.355 34.647 82 HE1 MET 11 3HE MET 11 -19.472 30.626 37.578 83 HE2 MET 11 1HE MET 11 -18.627 29.102 37.849 84 HE3 MET 11 2HE MET 11 -19.293 29.471 36.258 85 H ASP 12 HN ASP 12 -19.444 34.185 32.666 86 HA ASP 12 HA ASP 12 -19.357 31.668 31.166 87 HB2 ASP 12 2HB ASP 12 -21.353 32.220 32.577 88 HB3 ASP 12 1HB ASP 12 -21.684 33.567 31.492 89 H TYR 13 HN TYR 13 -18.519 31.778 29.204 90 HA TYR 13 HA TYR 13 -19.171 34.102 27.521 91 HB2 TYR 13 2HB TYR 13 -16.491 32.718 27.757 92 HB3 TYR 13 1HB TYR 13 -16.890 33.894 26.514 93 HD1 TYR 13 1HD TYR 13 -17.339 36.264 27.172 94 HD2 TYR 13 2HD TYR 13 -15.844 33.393 29.930 95 HE1 TYR 13 1HE TYR 13 -16.595 38.081 28.646 96 HE2 TYR 13 2HE TYR 13 -15.101 35.204 31.422 97 HH TYR 13 HH TYR 13 -14.465 37.610 31.213 98 HA PRO 14 HA PRO 14 -20.305 30.576 24.926 99 HB2 PRO 14 2HB PRO 14 -22.039 32.346 23.482 100 HB3 PRO 14 1HB PRO 14 -22.484 31.080 24.624 101 HG2 PRO 14 2HG PRO 14 -22.837 33.782 25.062 102 HG3 PRO 14 1HG PRO 14 -22.749 32.554 26.337 103 HD2 PRO 14 2HD PRO 14 -20.636 34.434 25.365 104 HD3 PRO 14 1HD PRO 14 -20.986 33.883 27.018 105 H SER 15 HN SER 15 -18.799 30.103 23.423 106 HA SER 15 HA SER 15 -18.580 31.790 21.070 107 HB2 SER 15 2HB SER 15 -16.144 31.092 22.734 108 HB3 SER 15 1HB SER 15 -16.109 31.860 21.147 109 HG SER 15 HG SER 15 -17.767 33.228 22.719 110 H PHE 16 HN PHE 16 -19.530 30.059 19.956 111 HA PHE 16 HA PHE 16 -17.642 27.911 19.302 112 HB2 PHE 16 2HB PHE 16 -20.552 27.466 20.018 113 HB3 PHE 16 1HB PHE 16 -19.504 26.251 19.297 114 HD1 PHE 16 1HD PHE 16 -17.510 25.447 20.593 115 HD2 PHE 16 2HD PHE 16 -20.570 27.842 22.331 116 HE1 PHE 16 1HE PHE 16 -16.790 24.733 22.832 117 HE2 PHE 16 2HE PHE 16 -19.848 27.136 24.576 118 HZ PHE 16 HZ PHE 16 -17.956 25.580 24.826 119 H ASP 17 HN ASP 17 -17.396 27.812 17.152 120 HA ASP 17 HA ASP 17 -19.723 28.147 15.432 121 HB2 ASP 17 2HB ASP 17 -18.820 29.836 14.040 122 HB3 ASP 17 1HB ASP 17 -18.580 30.418 15.681 123 H LYS 18 HN LYS 18 -19.670 26.845 13.681 124 HA LYS 18 HA LYS 18 -17.386 25.887 12.366 125 HB2 LYS 18 2HB LYS 18 -17.389 23.529 13.104 126 HB3 LYS 18 1HB LYS 18 -16.940 24.619 14.407 127 HG2 LYS 18 2HG LYS 18 -19.159 24.434 15.364 128 HG3 LYS 18 1HG LYS 18 -19.670 23.412 14.019 129 HD2 LYS 18 2HD LYS 18 -17.443 22.729 15.935 130 HD3 LYS 18 1HD LYS 18 -19.103 22.150 16.089 131 HE2 LYS 18 2HE LYS 18 -18.936 21.033 13.935 132 HE3 LYS 18 1HE LYS 18 -17.302 21.656 13.716 133 HZ1 LYS 18 3HZ LYS 18 -17.291 19.361 14.481 134 HZ2 LYS 18 1HZ LYS 18 -18.168 19.793 15.869 135 HZ3 LYS 18 2HZ LYS 18 -16.595 20.386 15.642 136 H PHE 19 HN PHE 19 -18.017 23.857 10.967 137 HA PHE 19 HA PHE 19 -20.885 23.821 10.474 138 HB2 PHE 19 2HB PHE 19 -18.828 23.612 8.268 139 HB3 PHE 19 1HB PHE 19 -20.562 23.776 8.115 140 HD1 PHE 19 2HD PHE 19 -21.552 26.003 9.169 141 HD2 PHE 19 1HD PHE 19 -17.519 25.447 7.933 142 HE1 PHE 19 2HE PHE 19 -21.284 28.443 8.959 143 HE2 PHE 19 1HE PHE 19 -17.239 27.881 7.725 144 HZ PHE 19 HZ PHE 19 -19.123 29.384 8.236 145 H LEU 20 HN LEU 20 -18.342 20.622 10.168 146 HA LEU 20 HA LEU 20 -17.745 23.273 9.072 147 HB2 LEU 20 2HB LEU 20 -16.106 21.248 10.525 148 HB3 LEU 20 1HB LEU 20 -15.312 22.206 9.292 149 HG LEU 20 HG LEU 20 -16.790 23.375 11.648 150 HD11 LEU 20 1HD1 LEU 20 -14.837 22.122 12.392 151 HD12 LEU 20 2HD1 LEU 20 -14.577 23.857 12.563 152 HD13 LEU 20 3HD1 LEU 20 -13.834 22.980 11.225 153 HD21 LEU 20 3HD2 LEU 20 -14.934 24.613 9.616 154 HD22 LEU 20 1HD2 LEU 20 -15.632 25.435 11.014 155 HD23 LEU 20 2HD2 LEU 20 -16.679 24.859 9.716 156 H GLY 21 HN GLY 21 -15.679 22.827 7.438 157 HA2 GLY 21 2HA GLY 21 -14.886 21.615 5.593 158 HA3 GLY 21 1HA GLY 21 -16.234 20.504 5.766 159 H THR 22 HN THR 22 -15.185 21.881 3.384 160 HA THR 22 HA THR 22 -17.753 22.677 2.321 161 HB THR 22 HB THR 22 -15.454 24.647 2.209 162 HG1 THR 22 1HG THR 22 -17.399 24.303 4.052 163 HG21 THR 22 3HG2 THR 22 -16.827 24.635 0.182 164 HG22 THR 22 1HG2 THR 22 -17.063 26.120 1.100 165 HG23 THR 22 2HG2 THR 22 -18.279 24.844 1.162 166 H GLU 23 HN GLU 23 -17.925 22.053 0.255 167 HA GLU 23 HA GLU 23 -17.467 21.343 -1.837 168 HB2 GLU 23 2HB GLU 23 -14.782 22.639 -1.355 169 HB3 GLU 23 1HB GLU 23 -15.341 22.040 -2.913 170 HG2 GLU 23 2HG GLU 23 -17.197 23.625 -2.861 171 HG3 GLU 23 1HG GLU 23 -16.642 24.225 -1.300 172 H ASN 24 HN ASN 24 -17.468 19.231 -2.048 173 HA ASN 24 HA ASN 24 -15.413 17.602 -0.777 174 HB2 ASN 24 2HB ASN 24 -17.863 16.798 -2.366 175 HB3 ASN 24 1HB ASN 24 -16.777 15.682 -1.544 176 HD21 ASN 24 1HD2 ASN 24 -19.365 17.917 -1.212 177 HD22 ASN 24 2HD2 ASN 24 -19.683 17.625 0.468 178 H ALA 25 HN ALA 25 -15.107 19.353 -3.279 179 HA ALA 25 HA ALA 25 -14.707 17.774 -5.541 180 HB1 ALA 25 1HB ALA 25 -14.790 20.217 -5.574 181 HB2 ALA 25 2HB ALA 25 -13.348 19.604 -6.380 182 HB3 ALA 25 3HB ALA 25 -13.231 20.281 -4.756 183 H GLU 26 HN GLU 26 -12.545 18.524 -2.857 184 HA GLU 26 HA GLU 26 -10.221 17.424 -4.068 185 HB2 GLU 26 2HB GLU 26 -10.789 17.928 -1.141 186 HB3 GLU 26 1HB GLU 26 -9.204 17.674 -1.864 187 HG2 GLU 26 2HG GLU 26 -9.510 19.711 -3.207 188 HG3 GLU 26 1HG GLU 26 -11.067 19.972 -2.427 189 H LEU 27 HN LEU 27 -12.843 16.132 -2.208 190 HA LEU 27 HA LEU 27 -11.643 13.622 -1.609 191 HB2 LEU 27 2HB LEU 27 -13.487 14.359 -0.279 192 HB3 LEU 27 1HB LEU 27 -14.494 14.603 -1.693 193 HG LEU 27 HG LEU 27 -14.464 12.149 -2.070 194 HD11 LEU 27 1HD1 LEU 27 -13.771 10.685 -0.243 195 HD12 LEU 27 2HD1 LEU 27 -13.166 12.080 0.647 196 HD13 LEU 27 3HD1 LEU 27 -12.410 11.612 -0.875 197 HD21 LEU 27 3HD2 LEU 27 -15.530 13.084 0.588 198 HD22 LEU 27 1HD2 LEU 27 -16.045 11.631 -0.269 199 HD23 LEU 27 2HD2 LEU 27 -16.343 13.223 -0.971 200 H VAL 28 HN VAL 28 -13.821 14.817 -4.128 201 HA VAL 28 HA VAL 28 -14.224 12.405 -5.504 202 HB VAL 28 HB VAL 28 -14.211 15.215 -6.624 203 HG11 VAL 28 1HG1 VAL 28 -15.483 12.701 -7.698 204 HG12 VAL 28 2HG1 VAL 28 -14.088 13.535 -8.385 205 HG13 VAL 28 3HG1 VAL 28 -15.667 14.319 -8.372 206 HG21 VAL 28 3HG2 VAL 28 -15.740 14.981 -4.744 207 HG22 VAL 28 1HG2 VAL 28 -16.472 13.565 -5.502 208 HG23 VAL 28 2HG2 VAL 28 -16.632 15.151 -6.256 209 H TYR 29 HN TYR 29 -11.702 14.842 -5.739 210 HA TYR 29 HA TYR 29 -10.356 13.959 -8.004 211 HB2 TYR 29 2HB TYR 29 -9.617 16.003 -7.142 212 HB3 TYR 29 1HB TYR 29 -9.482 15.374 -5.504 213 HD1 TYR 29 1HD TYR 29 -7.920 15.139 -8.884 214 HD2 TYR 29 2HD TYR 29 -7.416 14.645 -4.688 215 HE1 TYR 29 1HE TYR 29 -5.517 14.743 -9.223 216 HE2 TYR 29 2HE TYR 29 -5.011 14.254 -5.016 217 HH TYR 29 HH TYR 29 -3.401 14.975 -7.845 218 H VAL 30 HN VAL 30 -10.079 12.861 -4.651 219 HA VAL 30 HA VAL 30 -7.762 11.281 -5.095 220 HB VAL 30 HB VAL 30 -9.771 11.118 -2.844 221 HG11 VAL 30 1HG1 VAL 30 -7.891 10.139 -1.561 222 HG12 VAL 30 2HG1 VAL 30 -6.953 10.060 -3.054 223 HG13 VAL 30 3HG1 VAL 30 -8.434 9.114 -2.889 224 HG21 VAL 30 3HG2 VAL 30 -8.811 13.342 -3.051 225 HG22 VAL 30 1HG2 VAL 30 -7.187 12.655 -3.048 226 HG23 VAL 30 2HG2 VAL 30 -8.202 12.528 -1.612 227 H LEU 31 HN LEU 31 -11.201 10.576 -5.156 228 HA LEU 31 HA LEU 31 -11.253 7.910 -4.542 229 HB2 LEU 31 2HB LEU 31 -13.004 9.379 -6.503 230 HB3 LEU 31 1HB LEU 31 -13.368 7.806 -5.814 231 HG LEU 31 HG LEU 31 -13.053 10.361 -4.232 232 HD11 LEU 31 1HD1 LEU 31 -15.463 10.220 -3.904 233 HD12 LEU 31 2HD1 LEU 31 -15.531 8.809 -4.959 234 HD13 LEU 31 3HD1 LEU 31 -15.063 10.377 -5.616 235 HD21 LEU 31 3HD2 LEU 31 -13.919 7.594 -3.394 236 HD22 LEU 31 1HD2 LEU 31 -13.958 9.033 -2.376 237 HD23 LEU 31 2HD2 LEU 31 -12.414 8.398 -2.945 238 H ARG 32 HN ARG 32 -9.724 6.596 -5.343 239 HA ARG 32 HA ARG 32 -10.144 5.645 -8.090 240 HB2 ARG 32 2HB ARG 32 -7.477 6.070 -6.712 241 HB3 ARG 32 1HB ARG 32 -7.671 5.087 -8.154 242 HG2 ARG 32 2HG ARG 32 -8.263 8.031 -7.934 243 HG3 ARG 32 1HG ARG 32 -6.842 7.307 -8.696 244 HD2 ARG 32 2HD ARG 32 -8.325 6.155 -10.294 245 HD3 ARG 32 1HD ARG 32 -9.714 6.946 -9.550 246 HE ARG 32 HE ARG 32 -7.604 8.275 -11.121 247 HH11 ARG 32 1HH1 ARG 32 -10.717 8.369 -9.532 248 HH12 ARG 32 2HH1 ARG 32 -11.270 9.768 -10.400 249 HH21 ARG 32 1HH2 ARG 32 -8.331 10.103 -12.292 250 HH22 ARG 32 2HH2 ARG 32 -9.920 10.748 -11.993 251 H HIS 33 HN HIS 33 -9.114 3.278 -8.209 252 HA HIS 33 HA HIS 33 -9.041 1.861 -5.712 253 HB2 HIS 33 2HB HIS 33 -11.464 2.411 -5.920 254 HB3 HIS 33 1HB HIS 33 -11.514 1.464 -7.400 255 HD1 HIS 33 1HD HIS 33 -10.775 0.981 -3.699 256 HD2 HIS 33 2HD HIS 33 -12.090 -1.154 -7.011 257 HE1 HIS 33 1HE HIS 33 -11.464 -1.265 -2.823 258 HE2 HIS 33 2HE HIS 33 -12.540 -2.406 -4.795 259 H LYS 34 HN LYS 34 -8.808 1.924 -9.119 260 HA LYS 34 HA LYS 34 -9.005 -0.749 -9.846 261 HB2 LYS 34 2HB LYS 34 -8.851 1.197 -11.387 262 HB3 LYS 34 1HB LYS 34 -7.135 1.310 -11.024 263 HG2 LYS 34 2HG LYS 34 -6.798 -0.929 -11.962 264 HG3 LYS 34 1HG LYS 34 -8.520 -1.018 -12.344 265 HD2 LYS 34 2HD LYS 34 -8.283 0.952 -13.793 266 HD3 LYS 34 1HD LYS 34 -6.557 1.006 -13.432 267 HE2 LYS 34 2HE LYS 34 -6.820 -0.065 -15.545 268 HE3 LYS 34 1HE LYS 34 -6.379 -1.307 -14.376 269 HZ1 LYS 34 3HZ LYS 34 -8.125 -2.148 -15.731 270 HZ2 LYS 34 1HZ LYS 34 -9.080 -0.766 -15.489 271 HZ3 LYS 34 2HZ LYS 34 -8.791 -1.838 -14.204 272 H HIS 35 HN HIS 35 -8.026 -2.308 -8.697 273 HA HIS 35 HA HIS 35 -5.163 -2.606 -8.848 274 HB2 HIS 35 2HB HIS 35 -6.536 -2.176 -6.193 275 HB3 HIS 35 1HB HIS 35 -5.032 -3.079 -6.322 276 HD1 HIS 35 1HD HIS 35 -6.308 0.251 -5.860 277 HD2 HIS 35 2HD HIS 35 -2.880 -1.422 -7.493 278 HE1 HIS 35 1HE HIS 35 -4.627 2.112 -5.939 279 HE2 HIS 35 2HE HIS 35 -2.664 1.132 -7.175 280 H GLY 36 HN GLY 36 -4.719 -4.657 -7.192 281 HA2 GLY 36 2HA GLY 36 -6.680 -6.696 -8.008 282 HA3 GLY 36 1HA GLY 36 -4.986 -7.005 -7.652 283 H GLN 37 HN GLN 37 -5.375 -8.558 -6.070 284 HA GLN 37 HA GLN 37 -7.036 -7.814 -3.792 285 HB2 GLN 37 2HB GLN 37 -7.181 -10.091 -4.871 286 HB3 GLN 37 1HB GLN 37 -5.573 -10.420 -4.237 287 HG2 GLN 37 2HG GLN 37 -6.442 -10.020 -1.956 288 HG3 GLN 37 1HG GLN 37 -8.054 -9.829 -2.642 289 HE21 GLN 37 1HE2 GLN 37 -7.109 -11.758 -0.712 290 HE22 GLN 37 2HE2 GLN 37 -7.409 -13.322 -1.398 291 H PHE 38 HN PHE 38 -3.898 -9.475 -4.009 292 HA PHE 38 HA PHE 38 -2.950 -7.869 -1.739 293 HB2 PHE 38 2HB PHE 38 -2.367 -10.623 -2.712 294 HB3 PHE 38 1HB PHE 38 -1.041 -9.736 -1.973 295 HD1 PHE 38 1HD PHE 38 -4.589 -10.706 -1.333 296 HD2 PHE 38 2HD PHE 38 -0.761 -9.801 0.302 297 HE1 PHE 38 1HE PHE 38 -5.393 -11.346 0.905 298 HE2 PHE 38 2HE PHE 38 -1.562 -10.431 2.539 299 HZ PHE 38 HZ PHE 38 -3.880 -11.206 2.840 300 H ILE 39 HN ILE 39 -1.947 -6.083 -2.481 301 HA ILE 39 HA ILE 39 -0.163 -6.398 -4.816 302 HB ILE 39 HB ILE 39 -1.921 -4.028 -4.166 303 HG12 ILE 39 2HG1 ILE 39 -3.195 -5.895 -5.094 304 HG13 ILE 39 1HG1 ILE 39 -3.077 -4.588 -6.268 305 HG21 ILE 39 1HG2 ILE 39 -0.021 -4.452 -6.462 306 HG22 ILE 39 2HG2 ILE 39 0.190 -3.319 -5.126 307 HG23 ILE 39 3HG2 ILE 39 -1.126 -3.092 -6.280 308 HD11 ILE 39 3HD1 ILE 39 -1.325 -5.810 -7.446 309 HD12 ILE 39 1HD1 ILE 39 -2.803 -6.762 -7.317 310 HD13 ILE 39 2HD1 ILE 39 -1.432 -7.112 -6.262 311 H TYR 40 HN TYR 40 1.870 -5.978 -4.357 312 HA TYR 40 HA TYR 40 2.516 -3.969 -2.302 313 HB2 TYR 40 2HB TYR 40 3.442 -6.167 -1.806 314 HB3 TYR 40 1HB TYR 40 4.144 -6.272 -3.413 315 HD1 TYR 40 2HD TYR 40 4.413 -4.654 -0.115 316 HD2 TYR 40 1HD TYR 40 6.228 -5.189 -3.929 317 HE1 TYR 40 2HE TYR 40 6.496 -3.672 0.744 318 HE2 TYR 40 1HE TYR 40 8.317 -4.213 -3.077 319 HH TYR 40 HH TYR 40 9.066 -2.720 -1.272 320 H VAL 41 HN VAL 41 3.225 -2.072 -3.044 321 HA VAL 41 HA VAL 41 4.534 -2.041 -5.680 322 HB VAL 41 HB VAL 41 3.875 0.347 -5.872 323 HG11 VAL 41 1HG1 VAL 41 2.563 -1.362 -6.986 324 HG12 VAL 41 2HG1 VAL 41 1.517 -0.064 -6.410 325 HG13 VAL 41 3HG1 VAL 41 1.588 -1.592 -5.533 326 HG21 VAL 41 3HG2 VAL 41 2.162 -0.217 -3.452 327 HG22 VAL 41 1HG2 VAL 41 2.143 1.255 -4.420 328 HG23 VAL 41 2HG2 VAL 41 3.582 0.830 -3.490 329 H TRP 42 HN TRP 42 6.527 -1.180 -5.826 330 HA TRP 42 HA TRP 42 7.766 -0.437 -3.272 331 HB2 TRP 42 2HB TRP 42 9.903 -1.130 -4.380 332 HB3 TRP 42 1HB TRP 42 8.734 -2.429 -4.183 333 HD1 TRP 42 1HD TRP 42 7.498 -3.311 -6.435 334 HE1 TRP 42 1HE TRP 42 8.275 -3.286 -8.885 335 HE3 TRP 42 3HE TRP 42 11.218 0.184 -6.080 336 HZ2 TRP 42 2HZ TRP 42 10.213 -1.972 -10.458 337 HZ3 TRP 42 3HZ TRP 42 12.490 0.761 -8.105 338 HH2 TRP 42 2HH TRP 42 11.996 -0.297 -10.250 339 H GLY 43 HN GLY 43 6.358 1.264 -5.391 340 HA2 GLY 43 2HA GLY 43 8.427 3.333 -5.429 341 HA3 GLY 43 1HA GLY 43 7.671 2.886 -6.953 342 H GLU 44 HN GLU 44 7.599 5.043 -4.496 343 HA GLU 44 HA GLU 44 4.819 5.542 -4.214 344 HB2 GLU 44 2HB GLU 44 6.708 6.324 -2.701 345 HB3 GLU 44 1HB GLU 44 7.065 7.544 -3.912 346 HG2 GLU 44 2HG GLU 44 4.280 7.414 -2.934 347 HG3 GLU 44 1HG GLU 44 5.502 7.984 -1.798 348 H GLU 45 HN GLU 45 3.617 7.307 -5.135 349 HA GLU 45 HA GLU 45 3.651 7.214 -7.918 350 HB2 GLU 45 2HB GLU 45 2.299 9.222 -6.115 351 HB3 GLU 45 1HB GLU 45 1.895 8.928 -7.800 352 HG2 GLU 45 2HG GLU 45 1.184 6.687 -7.287 353 HG3 GLU 45 1HG GLU 45 1.706 6.870 -5.614 354 H GLY 46 HN GLY 46 4.973 9.611 -5.713 355 HA2 GLY 46 2HA GLY 46 7.061 10.642 -6.706 356 HA3 GLY 46 1HA GLY 46 6.018 11.086 -8.051 357 H ALA 47 HN ALA 47 6.123 11.328 -4.513 358 HA ALA 47 HA ALA 47 5.732 13.041 -3.078 359 HB1 ALA 47 1HB ALA 47 5.713 14.828 -5.514 360 HB2 ALA 47 2HB ALA 47 7.113 14.466 -4.503 361 HB3 ALA 47 3HB ALA 47 5.751 15.366 -3.835 362 H GLY 48 HN GLY 48 3.675 11.462 -4.530 363 HA2 GLY 48 2HA GLY 48 1.353 13.240 -4.509 364 HA3 GLY 48 1HA GLY 48 1.356 11.531 -4.935 365 H LYS 49 HN LYS 49 2.885 10.786 -2.600 366 HA LYS 49 HA LYS 49 2.694 10.165 -0.445 367 HB2 LYS 49 2HB LYS 49 2.915 12.536 0.023 368 HB3 LYS 49 1HB LYS 49 1.187 12.771 -0.198 369 HG2 LYS 49 2HG LYS 49 1.888 12.721 2.170 370 HG3 LYS 49 1HG LYS 49 0.702 11.479 1.761 371 HD2 LYS 49 2HD LYS 49 2.582 9.863 1.511 372 HD3 LYS 49 1HD LYS 49 3.675 11.119 2.098 373 HE2 LYS 49 2HE LYS 49 2.527 11.205 4.209 374 HE3 LYS 49 1HE LYS 49 1.288 10.096 3.623 375 HZ1 LYS 49 3HZ LYS 49 2.921 8.357 3.470 376 HZ2 LYS 49 1HZ LYS 49 2.931 9.004 5.040 377 HZ3 LYS 49 2HZ LYS 49 4.160 9.416 3.939 378 H SER 50 HN SER 50 1.427 8.374 -1.138 379 HA SER 50 HA SER 50 -0.207 6.859 -0.735 380 HB2 SER 50 2HB SER 50 0.179 8.098 1.598 381 HB3 SER 50 1HB SER 50 -1.497 8.574 1.329 382 HG SER 50 HG SER 50 -0.396 5.984 1.595 383 H HIS 51 HN HIS 51 -0.736 9.266 -2.527 384 HA HIS 51 HA HIS 51 -3.406 10.058 -2.387 385 HB2 HIS 51 2HB HIS 51 -2.153 11.333 -3.854 386 HB3 HIS 51 1HB HIS 51 -1.343 9.938 -4.549 387 HD1 HIS 51 1HD HIS 51 -2.152 9.170 -6.757 388 HD2 HIS 51 2HD HIS 51 -4.927 11.617 -4.842 389 HE1 HIS 51 1HE HIS 51 -3.981 9.579 -8.436 390 HE2 HIS 51 2HE HIS 51 -5.726 10.903 -7.206 391 H LEU 52 HN LEU 52 -1.961 7.420 -4.293 392 HA LEU 52 HA LEU 52 -4.487 6.507 -5.235 393 HB2 LEU 52 2HB LEU 52 -2.498 6.284 -6.567 394 HB3 LEU 52 1HB LEU 52 -1.700 5.369 -5.304 395 HG LEU 52 HG LEU 52 -3.348 3.578 -5.618 396 HD11 LEU 52 1HD1 LEU 52 -4.712 3.577 -7.673 397 HD12 LEU 52 2HD1 LEU 52 -4.221 5.244 -7.971 398 HD13 LEU 52 3HD1 LEU 52 -5.188 4.851 -6.549 399 HD21 LEU 52 3HD2 LEU 52 -1.165 3.475 -6.690 400 HD22 LEU 52 1HD2 LEU 52 -1.798 4.360 -8.078 401 HD23 LEU 52 2HD2 LEU 52 -2.401 2.743 -7.714 402 H LEU 53 HN LEU 53 -2.498 5.835 -2.472 403 HA LEU 53 HA LEU 53 -3.554 3.237 -1.922 404 HB2 LEU 53 2HB LEU 53 -1.961 5.172 -0.257 405 HB3 LEU 53 1HB LEU 53 -2.519 3.634 0.371 406 HG LEU 53 HG LEU 53 -1.258 2.563 -1.581 407 HD11 LEU 53 1HD1 LEU 53 0.603 3.845 -2.490 408 HD12 LEU 53 2HD1 LEU 53 0.048 5.280 -1.631 409 HD13 LEU 53 3HD1 LEU 53 -0.941 4.584 -2.915 410 HD21 LEU 53 3HD2 LEU 53 0.867 2.643 -0.361 411 HD22 LEU 53 1HD2 LEU 53 -0.507 2.421 0.722 412 HD23 LEU 53 2HD2 LEU 53 0.262 4.003 0.587 413 H GLN 54 HN GLN 54 -4.138 6.451 -0.504 414 HA GLN 54 HA GLN 54 -6.088 5.540 1.351 415 HB2 GLN 54 2HB GLN 54 -6.566 7.882 1.735 416 HB3 GLN 54 1HB GLN 54 -4.831 7.657 1.599 417 HG2 GLN 54 2HG GLN 54 -5.017 8.400 -0.783 418 HG3 GLN 54 1HG GLN 54 -6.691 8.835 -0.441 419 HE21 GLN 54 1HE2 GLN 54 -3.364 9.558 0.138 420 HE22 GLN 54 2HE2 GLN 54 -3.603 11.129 0.829 421 H ALA 55 HN ALA 55 -6.199 6.762 -1.901 422 HA ALA 55 HA ALA 55 -8.924 7.049 -2.312 423 HB1 ALA 55 1HB ALA 55 -7.205 7.664 -3.949 424 HB2 ALA 55 2HB ALA 55 -8.444 6.633 -4.664 425 HB3 ALA 55 3HB ALA 55 -6.874 5.956 -4.235 426 H TRP 56 HN TRP 56 -6.889 4.192 -2.642 427 HA TRP 56 HA TRP 56 -8.805 2.375 -3.529 428 HB2 TRP 56 2HB TRP 56 -6.365 2.028 -3.569 429 HB3 TRP 56 1HB TRP 56 -6.353 1.903 -1.818 430 HD1 TRP 56 1HD TRP 56 -7.995 0.010 -4.801 431 HE1 TRP 56 1HE TRP 56 -7.971 -2.501 -4.221 432 HE3 TRP 56 3HE TRP 56 -6.013 0.276 -0.096 433 HZ2 TRP 56 2HZ TRP 56 -7.202 -4.142 -2.069 434 HZ3 TRP 56 3HZ TRP 56 -5.660 -1.815 1.153 435 HH2 TRP 56 2HH TRP 56 -6.247 -3.975 0.184 436 H VAL 57 HN VAL 57 -7.925 3.450 -0.321 437 HA VAL 57 HA VAL 57 -9.486 1.592 1.147 438 HB VAL 57 HB VAL 57 -8.383 4.310 1.884 439 HG11 VAL 57 1HG1 VAL 57 -8.829 3.721 4.213 440 HG12 VAL 57 2HG1 VAL 57 -9.624 2.236 3.690 441 HG13 VAL 57 3HG1 VAL 57 -10.325 3.802 3.281 442 HG21 VAL 57 3HG2 VAL 57 -6.660 2.681 1.441 443 HG22 VAL 57 1HG2 VAL 57 -7.459 1.502 2.481 444 HG23 VAL 57 2HG2 VAL 57 -6.760 2.961 3.180 445 H ALA 58 HN ALA 58 -10.022 5.021 0.321 446 HA ALA 58 HA ALA 58 -12.506 5.258 1.614 447 HB1 ALA 58 1HB ALA 58 -11.465 6.858 -0.722 448 HB2 ALA 58 2HB ALA 58 -11.095 7.159 0.976 449 HB3 ALA 58 3HB ALA 58 -12.748 7.339 0.386 450 H GLN 59 HN GLN 59 -11.718 4.349 -1.720 451 HA GLN 59 HA GLN 59 -14.385 4.425 -2.670 452 HB2 GLN 59 2HB GLN 59 -12.108 4.271 -3.956 453 HB3 GLN 59 1HB GLN 59 -12.338 2.537 -3.787 454 HG2 GLN 59 2HG GLN 59 -14.393 4.353 -5.015 455 HG3 GLN 59 1HG GLN 59 -13.118 3.568 -5.943 456 HE21 GLN 59 1HE2 GLN 59 -16.038 3.319 -6.048 457 HE22 GLN 59 2HE2 GLN 59 -16.371 1.637 -5.848 458 H ALA 60 HN ALA 60 -12.400 1.888 -1.210 459 HA ALA 60 HA ALA 60 -14.267 -0.217 -1.522 460 HB1 ALA 60 1HB ALA 60 -12.945 -1.388 0.143 461 HB2 ALA 60 2HB ALA 60 -12.127 0.112 0.576 462 HB3 ALA 60 3HB ALA 60 -11.890 -0.590 -1.025 463 H LEU 61 HN LEU 61 -13.732 2.216 0.943 464 HA LEU 61 HA LEU 61 -15.534 1.312 2.877 465 HB2 LEU 61 2HB LEU 61 -14.636 4.087 2.118 466 HB3 LEU 61 1HB LEU 61 -15.681 3.777 3.489 467 HG LEU 61 HG LEU 61 -12.896 2.657 3.154 468 HD11 LEU 61 1HD1 LEU 61 -12.276 4.227 4.918 469 HD12 LEU 61 2HD1 LEU 61 -13.906 4.903 4.891 470 HD13 LEU 61 3HD1 LEU 61 -12.859 5.066 3.481 471 HD21 LEU 61 3HD2 LEU 61 -13.134 1.980 5.484 472 HD22 LEU 61 1HD2 LEU 61 -14.374 1.226 4.482 473 HD23 LEU 61 2HD2 LEU 61 -14.785 2.599 5.507 474 H GLU 62 HN GLU 62 -16.053 3.492 0.112 475 HA GLU 62 HA GLU 62 -18.820 3.847 0.643 476 HB2 GLU 62 2HB GLU 62 -17.287 4.233 -1.922 477 HB3 GLU 62 1HB GLU 62 -18.938 4.769 -1.643 478 HG2 GLU 62 2HG GLU 62 -18.053 6.132 0.271 479 HG3 GLU 62 1HG GLU 62 -16.438 5.743 -0.310 480 H ALA 63 HN ALA 63 -16.985 1.425 -0.993 481 HA ALA 63 HA ALA 63 -19.098 0.363 -2.585 482 HB1 ALA 63 1HB ALA 63 -16.764 0.016 -3.181 483 HB2 ALA 63 2HB ALA 63 -17.588 -1.529 -2.963 484 HB3 ALA 63 3HB ALA 63 -16.511 -0.917 -1.707 485 H GLY 64 HN GLY 64 -18.557 0.287 0.726 486 HA2 GLY 64 2HA GLY 64 -20.237 -0.592 2.172 487 HA3 GLY 64 1HA GLY 64 -20.587 -1.826 0.968 488 H LYS 65 HN LYS 65 -17.293 -1.294 1.412 489 HA LYS 65 HA LYS 65 -17.083 -3.720 3.042 490 HB2 LYS 65 2HB LYS 65 -15.244 -2.479 1.005 491 HB3 LYS 65 1HB LYS 65 -14.678 -3.690 2.142 492 HG2 LYS 65 2HG LYS 65 -15.182 -4.727 0.041 493 HG3 LYS 65 1HG LYS 65 -16.348 -5.267 1.247 494 HD2 LYS 65 2HD LYS 65 -18.023 -3.806 0.370 495 HD3 LYS 65 1HD LYS 65 -16.857 -3.040 -0.707 496 HE2 LYS 65 2HE LYS 65 -16.605 -5.098 -1.955 497 HE3 LYS 65 1HE LYS 65 -17.652 -5.947 -0.820 498 HZ1 LYS 65 3HZ LYS 65 -18.866 -5.375 -2.796 499 HZ2 LYS 65 1HZ LYS 65 -18.467 -3.738 -2.640 500 HZ3 LYS 65 2HZ LYS 65 -19.475 -4.480 -1.496 501 H ASN 66 HN ASN 66 -14.794 -3.668 4.163 502 HA ASN 66 HA ASN 66 -14.650 -1.125 5.635 503 HB2 ASN 66 2HB ASN 66 -15.242 -3.244 6.927 504 HB3 ASN 66 1HB ASN 66 -13.597 -3.777 6.615 505 HD21 ASN 66 1HD2 ASN 66 -13.203 -3.782 8.872 506 HD22 ASN 66 2HD2 ASN 66 -12.890 -2.298 9.718 507 H ALA 67 HN ALA 67 -12.762 -0.052 5.730 508 HA ALA 67 HA ALA 67 -10.305 -1.288 4.814 509 HB1 ALA 67 1HB ALA 67 -11.516 1.053 3.345 510 HB2 ALA 67 2HB ALA 67 -11.388 -0.594 2.731 511 HB3 ALA 67 3HB ALA 67 -9.928 0.346 3.041 512 H ALA 68 HN ALA 68 -8.463 -0.100 5.366 513 HA ALA 68 HA ALA 68 -8.790 2.463 6.693 514 HB1 ALA 68 1HB ALA 68 -9.191 0.878 8.504 515 HB2 ALA 68 2HB ALA 68 -7.671 1.740 8.744 516 HB3 ALA 68 3HB ALA 68 -7.660 0.079 8.154 517 H TYR 69 HN TYR 69 -7.015 3.727 6.477 518 HA TYR 69 HA TYR 69 -4.664 2.483 5.256 519 HB2 TYR 69 2HB TYR 69 -4.069 4.671 4.392 520 HB3 TYR 69 1HB TYR 69 -5.727 4.306 3.938 521 HD1 TYR 69 2HD TYR 69 -7.582 5.576 4.896 522 HD2 TYR 69 1HD TYR 69 -3.557 6.447 5.958 523 HE1 TYR 69 2HE TYR 69 -8.300 7.727 5.847 524 HE2 TYR 69 1HE TYR 69 -4.265 8.596 6.909 525 HH TYR 69 HH TYR 69 -6.119 10.186 6.711 526 H ILE 70 HN ILE 70 -2.737 2.576 6.239 527 HA ILE 70 HA ILE 70 -2.572 4.093 8.760 528 HB ILE 70 HB ILE 70 -1.498 1.304 8.274 529 HG12 ILE 70 2HG1 ILE 70 -3.629 2.316 10.169 530 HG13 ILE 70 1HG1 ILE 70 -3.929 1.410 8.687 531 HG21 ILE 70 1HG2 ILE 70 0.049 2.605 9.628 532 HG22 ILE 70 2HG2 ILE 70 -0.765 1.394 10.618 533 HG23 ILE 70 3HG2 ILE 70 -1.267 3.082 10.702 534 HD11 ILE 70 3HD1 ILE 70 -4.109 -0.020 10.629 535 HD12 ILE 70 1HD1 ILE 70 -2.472 0.409 11.129 536 HD13 ILE 70 2HD1 ILE 70 -2.732 -0.500 9.641 537 H ASP 71 HN ASP 71 -1.082 5.605 8.586 538 HA ASP 71 HA ASP 71 1.095 5.398 6.686 539 HB2 ASP 71 2HB ASP 71 -0.074 7.562 7.163 540 HB3 ASP 71 1HB ASP 71 0.571 7.507 8.798 541 H ALA 72 HN ALA 72 2.520 3.827 7.347 542 HA ALA 72 HA ALA 72 2.904 3.255 10.110 543 HB1 ALA 72 1HB ALA 72 4.448 2.234 7.737 544 HB2 ALA 72 2HB ALA 72 2.976 1.520 8.395 545 HB3 ALA 72 3HB ALA 72 4.452 1.547 9.361 546 H ALA 73 HN ALA 73 4.235 5.636 8.172 547 HA ALA 73 HA ALA 73 6.809 5.689 9.493 548 HB1 ALA 73 1HB ALA 73 6.594 6.419 7.165 549 HB2 ALA 73 2HB ALA 73 7.225 7.697 8.202 550 HB3 ALA 73 3HB ALA 73 5.540 7.737 7.680 551 H SER 74 HN SER 74 3.651 6.848 10.115 552 HA SER 74 HA SER 74 4.716 8.523 12.303 553 HB2 SER 74 2HB SER 74 3.719 9.766 10.294 554 HB3 SER 74 1HB SER 74 2.161 9.138 10.820 555 HG SER 74 HG SER 74 3.291 11.310 11.640 556 H MET 75 HN MET 75 2.687 5.989 11.348 557 HA MET 75 HA MET 75 1.273 5.989 13.937 558 HB2 MET 75 2HB MET 75 0.277 5.047 11.239 559 HB3 MET 75 1HB MET 75 -0.589 4.834 12.747 560 HG2 MET 75 2HG MET 75 -0.859 7.208 12.984 561 HG3 MET 75 1HG MET 75 0.148 7.496 11.566 562 HE1 MET 75 3HE MET 75 -4.010 5.485 11.380 563 HE2 MET 75 1HE MET 75 -3.264 6.051 12.873 564 HE3 MET 75 2HE MET 75 -2.582 4.669 12.013 565 HA PRO 76 HA PRO 76 2.818 1.775 14.077 566 HB2 PRO 76 2HB PRO 76 1.499 1.021 16.355 567 HB3 PRO 76 1HB PRO 76 2.959 2.013 16.350 568 HG2 PRO 76 2HG PRO 76 0.246 2.771 17.045 569 HG3 PRO 76 1HG PRO 76 1.741 3.693 17.242 570 HD2 PRO 76 2HD PRO 76 -0.303 3.912 15.169 571 HD3 PRO 76 1HD PRO 76 1.027 5.020 15.557 572 H LEU 77 HN LEU 77 2.104 -0.367 13.740 573 HA LEU 77 HA LEU 77 -0.555 -0.612 12.610 574 HB2 LEU 77 2HB LEU 77 1.409 -1.664 11.527 575 HB3 LEU 77 1HB LEU 77 1.630 -2.680 12.939 576 HG LEU 77 HG LEU 77 -0.566 -3.733 12.503 577 HD11 LEU 77 1HD1 LEU 77 -1.670 -3.346 10.348 578 HD12 LEU 77 2HD1 LEU 77 -0.523 -2.052 9.999 579 HD13 LEU 77 3HD1 LEU 77 -1.654 -1.888 11.343 580 HD21 LEU 77 3HD2 LEU 77 0.134 -5.003 10.532 581 HD22 LEU 77 1HD2 LEU 77 1.478 -4.746 11.646 582 HD23 LEU 77 2HD2 LEU 77 1.351 -3.778 10.178 583 H THR 78 HN THR 78 -2.198 -1.962 13.425 584 HA THR 78 HA THR 78 -1.804 -2.928 16.162 585 HB THR 78 HB THR 78 -4.095 -2.055 16.713 586 HG1 THR 78 1HG THR 78 -4.187 -0.064 14.946 587 HG21 THR 78 3HG2 THR 78 -2.034 0.023 15.962 588 HG22 THR 78 1HG2 THR 78 -2.088 -0.881 17.477 589 HG23 THR 78 2HG2 THR 78 -3.375 0.259 17.083 590 H ASP 79 HN ASP 79 -3.777 -4.219 16.864 591 HA ASP 79 HA ASP 79 -4.167 -6.352 15.002 592 HB2 ASP 79 2HB ASP 79 -5.488 -7.374 16.818 593 HB3 ASP 79 1HB ASP 79 -3.929 -6.797 17.395 594 H ALA 80 HN ALA 80 -5.771 -3.442 15.583 595 HA ALA 80 HA ALA 80 -8.448 -4.127 15.037 596 HB1 ALA 80 1HB ALA 80 -7.757 -1.966 15.994 597 HB2 ALA 80 2HB ALA 80 -8.778 -1.770 14.569 598 HB3 ALA 80 3HB ALA 80 -7.034 -1.526 14.448 599 H ALA 81 HN ALA 81 -5.674 -3.809 13.029 600 HA ALA 81 HA ALA 81 -6.826 -3.225 10.558 601 HB1 ALA 81 1HB ALA 81 -4.415 -3.173 11.016 602 HB2 ALA 81 2HB ALA 81 -4.803 -4.111 9.574 603 HB3 ALA 81 3HB ALA 81 -4.403 -4.935 11.083 604 H PHE 82 HN PHE 82 -6.803 -6.194 12.379 605 HA PHE 82 HA PHE 82 -7.287 -7.986 10.241 606 HB2 PHE 82 2HB PHE 82 -7.809 -8.148 13.198 607 HB3 PHE 82 1HB PHE 82 -8.260 -9.449 12.106 608 HD1 PHE 82 1HD PHE 82 -6.458 -10.562 10.747 609 HD2 PHE 82 2HD PHE 82 -5.613 -7.924 13.978 610 HE1 PHE 82 1HE PHE 82 -4.190 -11.498 10.913 611 HE2 PHE 82 2HE PHE 82 -3.342 -8.855 14.148 612 HZ PHE 82 HZ PHE 82 -2.631 -10.647 12.615 613 H GLU 83 HN GLU 83 -9.301 -5.689 11.806 614 HA GLU 83 HA GLU 83 -11.770 -7.055 11.224 615 HB2 GLU 83 2HB GLU 83 -11.219 -4.245 12.148 616 HB3 GLU 83 1HB GLU 83 -12.816 -4.965 12.016 617 HG2 GLU 83 2HG GLU 83 -12.055 -6.719 13.626 618 HG3 GLU 83 1HG GLU 83 -10.586 -5.781 13.856 619 H ALA 84 HN ALA 84 -9.667 -4.908 9.608 620 HA ALA 84 HA ALA 84 -11.667 -3.879 7.798 621 HB1 ALA 84 1HB ALA 84 -9.810 -2.697 6.743 622 HB2 ALA 84 2HB ALA 84 -8.669 -3.564 7.771 623 HB3 ALA 84 3HB ALA 84 -9.822 -2.438 8.488 624 H GLU 85 HN GLU 85 -11.923 -4.442 5.691 625 HA GLU 85 HA GLU 85 -10.868 -7.023 4.902 626 HB2 GLU 85 2HB GLU 85 -13.256 -6.082 4.456 627 HB3 GLU 85 1HB GLU 85 -12.494 -5.241 3.112 628 HG2 GLU 85 2HG GLU 85 -13.424 -7.275 2.284 629 HG3 GLU 85 1HG GLU 85 -11.668 -7.433 2.283 630 H TYR 86 HN TYR 86 -10.429 -3.656 4.164 631 HA TYR 86 HA TYR 86 -8.317 -4.339 2.221 632 HB2 TYR 86 2HB TYR 86 -10.038 -1.856 2.397 633 HB3 TYR 86 1HB TYR 86 -8.678 -2.041 1.300 634 HD1 TYR 86 1HD TYR 86 -11.902 -3.719 2.187 635 HD2 TYR 86 2HD TYR 86 -9.093 -2.758 -0.850 636 HE1 TYR 86 1HE TYR 86 -13.416 -4.663 0.497 637 HE2 TYR 86 2HE TYR 86 -10.596 -3.702 -2.548 638 HH TYR 86 HH TYR 86 -12.443 -5.365 -2.648 639 H LEU 87 HN LEU 87 -6.374 -4.131 3.125 640 HA LEU 87 HA LEU 87 -5.967 -1.948 5.060 641 HB2 LEU 87 2HB LEU 87 -4.550 -4.585 4.730 642 HB3 LEU 87 1HB LEU 87 -3.861 -3.270 5.660 643 HG LEU 87 HG LEU 87 -4.878 -4.743 7.206 644 HD11 LEU 87 1HD1 LEU 87 -5.233 -2.419 7.720 645 HD12 LEU 87 2HD1 LEU 87 -6.652 -3.352 8.200 646 HD13 LEU 87 3HD1 LEU 87 -6.688 -2.388 6.724 647 HD21 LEU 87 3HD2 LEU 87 -6.300 -5.973 5.645 648 HD22 LEU 87 1HD2 LEU 87 -7.393 -4.591 5.556 649 HD23 LEU 87 2HD2 LEU 87 -7.197 -5.462 7.077 650 H ALA 88 HN ALA 88 -4.899 -0.252 4.351 651 HA ALA 88 HA ALA 88 -2.842 -0.657 2.279 652 HB1 ALA 88 1HB ALA 88 -4.541 1.787 2.780 653 HB2 ALA 88 2HB ALA 88 -4.670 0.684 1.411 654 HB3 ALA 88 3HB ALA 88 -3.232 1.687 1.605 655 H VAL 89 HN VAL 89 -0.865 -0.470 3.057 656 HA VAL 89 HA VAL 89 -0.462 1.197 5.456 657 HB VAL 89 HB VAL 89 1.200 -1.166 4.561 658 HG11 VAL 89 1HG1 VAL 89 2.252 -0.982 6.752 659 HG12 VAL 89 2HG1 VAL 89 1.271 0.436 7.115 660 HG13 VAL 89 3HG1 VAL 89 2.470 0.501 5.823 661 HG21 VAL 89 3HG2 VAL 89 0.210 -2.348 6.480 662 HG22 VAL 89 1HG2 VAL 89 -1.009 -1.895 5.288 663 HG23 VAL 89 2HG2 VAL 89 -0.842 -0.964 6.775 664 H ASP 90 HN ASP 90 0.731 2.922 5.238 665 HA ASP 90 HA ASP 90 2.254 3.338 2.772 666 HB2 ASP 90 2HB ASP 90 0.543 4.973 4.090 667 HB3 ASP 90 1HB ASP 90 2.054 5.471 4.837 668 H GLN 91 HN GLN 91 4.364 2.894 2.774 669 HA GLN 91 HA GLN 91 6.445 2.341 3.442 670 HB2 GLN 91 2HB GLN 91 5.884 4.570 5.380 671 HB3 GLN 91 1HB GLN 91 7.405 3.699 5.404 672 HG2 GLN 91 2HG GLN 91 7.816 5.610 4.125 673 HG3 GLN 91 1HG GLN 91 7.639 4.306 2.960 674 HE21 GLN 91 1HE2 GLN 91 4.984 5.825 4.630 675 HE22 GLN 91 2HE2 GLN 91 4.267 6.549 3.232 676 H VAL 92 HN VAL 92 5.480 0.245 4.033 677 HA VAL 92 HA VAL 92 4.780 -0.322 6.736 678 HB VAL 92 HB VAL 92 3.964 -1.616 4.759 679 HG11 VAL 92 1HG1 VAL 92 6.059 -1.818 3.537 680 HG12 VAL 92 2HG1 VAL 92 5.354 -3.403 3.854 681 HG13 VAL 92 3HG1 VAL 92 6.716 -2.836 4.819 682 HG21 VAL 92 3HG2 VAL 92 4.031 -3.808 5.870 683 HG22 VAL 92 1HG2 VAL 92 3.689 -2.499 7.004 684 HG23 VAL 92 2HG2 VAL 92 5.302 -3.213 6.937 685 H GLU 93 HN GLU 93 7.779 -0.020 5.120 686 HA GLU 93 HA GLU 93 9.279 -1.862 6.714 687 HB2 GLU 93 2HB GLU 93 11.260 -0.811 5.728 688 HB3 GLU 93 1HB GLU 93 10.073 -1.233 4.505 689 HG2 GLU 93 2HG GLU 93 9.996 1.517 5.606 690 HG3 GLU 93 1HG GLU 93 11.325 1.090 4.535 691 H LYS 94 HN LYS 94 7.865 1.061 7.455 692 HA LYS 94 HA LYS 94 9.949 2.040 9.198 693 HB2 LYS 94 2HB LYS 94 7.107 2.950 8.802 694 HB3 LYS 94 1HB LYS 94 8.301 3.780 9.783 695 HG2 LYS 94 2HG LYS 94 8.558 3.273 6.833 696 HG3 LYS 94 1HG LYS 94 8.002 4.785 7.551 697 HD2 LYS 94 2HD LYS 94 10.679 3.549 8.164 698 HD3 LYS 94 1HD LYS 94 10.428 4.720 6.872 699 HE2 LYS 94 2HE LYS 94 9.502 6.288 8.584 700 HE3 LYS 94 1HE LYS 94 9.985 5.131 9.822 701 HZ1 LYS 94 3HZ LYS 94 11.613 6.936 9.462 702 HZ2 LYS 94 1HZ LYS 94 11.854 6.376 7.878 703 HZ3 LYS 94 2HZ LYS 94 12.269 5.394 9.195 704 H LEU 95 HN LEU 95 7.755 -0.414 9.436 705 HA LEU 95 HA LEU 95 6.900 -0.047 12.146 706 HB2 LEU 95 2HB LEU 95 6.905 -2.496 10.381 707 HB3 LEU 95 1HB LEU 95 6.133 -2.397 11.950 708 HG LEU 95 HG LEU 95 5.375 -0.801 9.501 709 HD11 LEU 95 1HD1 LEU 95 4.723 -3.152 9.382 710 HD12 LEU 95 2HD1 LEU 95 3.317 -2.105 9.576 711 HD13 LEU 95 3HD1 LEU 95 3.935 -3.017 10.953 712 HD21 LEU 95 3HD2 LEU 95 5.038 0.510 11.517 713 HD22 LEU 95 1HD2 LEU 95 4.177 -0.830 12.270 714 HD23 LEU 95 2HD2 LEU 95 3.486 -0.016 10.866 715 H GLY 96 HN GLY 96 7.685 -1.013 14.007 716 HA2 GLY 96 2HA GLY 96 10.541 -1.373 13.948 717 HA3 GLY 96 1HA GLY 96 9.519 -1.317 15.371 718 H ASN 97 HN ASN 97 8.359 -3.278 15.968 719 HA ASN 97 HA ASN 97 9.811 -5.684 15.069 720 HB2 ASN 97 2HB ASN 97 10.805 -4.844 17.166 721 HB3 ASN 97 1HB ASN 97 9.229 -4.932 17.944 722 HD21 ASN 97 1HD2 ASN 97 9.776 -6.415 19.482 723 HD22 ASN 97 2HD2 ASN 97 10.238 -8.048 19.123 724 H GLU 98 HN GLU 98 7.307 -4.930 17.469 725 HA GLU 98 HA GLU 98 5.910 -7.348 17.129 726 HB2 GLU 98 2HB GLU 98 5.836 -5.884 19.144 727 HB3 GLU 98 1HB GLU 98 4.884 -4.726 18.230 728 HG2 GLU 98 2HG GLU 98 3.099 -6.339 17.990 729 HG3 GLU 98 1HG GLU 98 4.062 -7.558 18.826 730 H GLU 99 HN GLU 99 5.553 -4.162 15.749 731 HA GLU 99 HA GLU 99 3.090 -4.480 14.472 732 HB2 GLU 99 2HB GLU 99 5.379 -2.874 13.347 733 HB3 GLU 99 1HB GLU 99 3.658 -2.582 13.156 734 HG2 GLU 99 2HG GLU 99 4.179 -0.991 14.703 735 HG3 GLU 99 1HG GLU 99 3.724 -2.324 15.761 736 H GLN 100 HN GLN 100 6.336 -5.437 13.460 737 HA GLN 100 HA GLN 100 5.561 -6.130 10.804 738 HB2 GLN 100 2HB GLN 100 7.981 -6.900 12.440 739 HB3 GLN 100 1HB GLN 100 7.754 -7.364 10.759 740 HG2 GLN 100 2HG GLN 100 7.554 -4.903 10.235 741 HG3 GLN 100 1HG GLN 100 8.103 -4.602 11.883 742 HE21 GLN 100 1HE2 GLN 100 9.973 -3.577 11.169 743 HE22 GLN 100 2HE2 GLN 100 11.295 -4.457 10.482 744 H ALA 101 HN ALA 101 5.761 -7.852 13.858 745 HA ALA 101 HA ALA 101 5.220 -10.437 12.799 746 HB1 ALA 101 1HB ALA 101 4.755 -9.343 15.573 747 HB2 ALA 101 2HB ALA 101 6.210 -10.163 15.003 748 HB3 ALA 101 3HB ALA 101 4.688 -11.046 15.117 749 H LEU 102 HN LEU 102 3.265 -7.753 13.877 750 HA LEU 102 HA LEU 102 0.746 -9.033 13.810 751 HB2 LEU 102 2HB LEU 102 1.501 -6.710 14.741 752 HB3 LEU 102 1HB LEU 102 1.157 -6.141 13.123 753 HG LEU 102 HG LEU 102 -0.683 -5.736 14.711 754 HD11 LEU 102 1HD1 LEU 102 -1.394 -7.679 12.530 755 HD12 LEU 102 2HD1 LEU 102 -1.179 -5.939 12.341 756 HD13 LEU 102 3HD1 LEU 102 -2.500 -6.562 13.330 757 HD21 LEU 102 3HD2 LEU 102 -2.045 -7.609 15.501 758 HD22 LEU 102 1HD2 LEU 102 -0.402 -7.678 16.138 759 HD23 LEU 102 2HD2 LEU 102 -0.878 -8.740 14.813 760 H LEU 103 HN LEU 103 2.489 -7.061 11.434 761 HA LEU 103 HA LEU 103 0.733 -7.231 9.287 762 HB2 LEU 103 2HB LEU 103 2.880 -5.873 9.526 763 HB3 LEU 103 1HB LEU 103 3.740 -7.323 9.058 764 HG LEU 103 HG LEU 103 3.364 -5.601 7.247 765 HD11 LEU 103 1HD1 LEU 103 2.872 -7.248 5.521 766 HD12 LEU 103 2HD1 LEU 103 2.307 -8.374 6.756 767 HD13 LEU 103 3HD1 LEU 103 4.000 -7.880 6.720 768 HD21 LEU 103 3HD2 LEU 103 0.537 -6.626 7.433 769 HD22 LEU 103 1HD2 LEU 103 1.177 -5.609 6.141 770 HD23 LEU 103 2HD2 LEU 103 1.082 -4.986 7.789 771 H PHE 104 HN PHE 104 3.385 -9.413 10.187 772 HA PHE 104 HA PHE 104 3.155 -11.348 8.235 773 HB2 PHE 104 2HB PHE 104 4.930 -11.545 9.784 774 HB3 PHE 104 1HB PHE 104 3.841 -11.545 11.161 775 HD1 PHE 104 1HD PHE 104 4.652 -13.559 8.128 776 HD2 PHE 104 2HD PHE 104 3.276 -13.540 12.153 777 HE1 PHE 104 1HE PHE 104 4.625 -16.019 8.127 778 HE2 PHE 104 2HE PHE 104 3.253 -15.999 12.159 779 HZ PHE 104 HZ PHE 104 3.923 -17.241 10.144 780 H SER 105 HN SER 105 1.407 -11.170 11.310 781 HA SER 105 HA SER 105 -0.081 -13.518 10.997 782 HB2 SER 105 2HB SER 105 0.245 -12.128 13.108 783 HB3 SER 105 1HB SER 105 -1.047 -11.092 12.507 784 HG SER 105 HG SER 105 -1.789 -12.776 13.927 785 H ILE 106 HN ILE 106 -0.759 -10.196 10.021 786 HA ILE 106 HA ILE 106 -3.373 -10.530 9.087 787 HB ILE 106 HB ILE 106 -1.207 -8.741 7.960 788 HG12 ILE 106 2HG1 ILE 106 -3.411 -8.160 9.954 789 HG13 ILE 106 1HG1 ILE 106 -1.710 -8.369 10.352 790 HG21 ILE 106 1HG2 ILE 106 -3.018 -9.051 6.359 791 HG22 ILE 106 2HG2 ILE 106 -3.051 -7.417 7.024 792 HG23 ILE 106 3HG2 ILE 106 -4.201 -8.625 7.597 793 HD11 ILE 106 3HD1 ILE 106 -1.158 -6.399 9.019 794 HD12 ILE 106 1HD1 ILE 106 -2.315 -6.023 10.296 795 HD13 ILE 106 2HD1 ILE 106 -2.866 -6.191 8.630 796 H PHE 107 HN PHE 107 -0.298 -10.829 7.310 797 HA PHE 107 HA PHE 107 -1.385 -11.607 4.846 798 HB2 PHE 107 2HB PHE 107 1.271 -11.814 6.157 799 HB3 PHE 107 1HB PHE 107 0.988 -12.864 4.776 800 HD1 PHE 107 2HD PHE 107 0.016 -9.324 5.496 801 HD2 PHE 107 1HD PHE 107 2.106 -12.042 2.967 802 HE1 PHE 107 2HE PHE 107 0.567 -7.478 3.968 803 HE2 PHE 107 1HE PHE 107 2.660 -10.198 1.437 804 HZ PHE 107 HZ PHE 107 1.892 -7.915 1.936 805 H ASN 108 HN ASN 108 -0.336 -13.517 7.619 806 HA ASN 108 HA ASN 108 -0.691 -16.053 6.458 807 HB2 ASN 108 2HB ASN 108 0.599 -15.671 8.519 808 HB3 ASN 108 1HB ASN 108 -0.880 -15.239 9.369 809 HD21 ASN 108 1HD2 ASN 108 -0.606 -16.848 10.874 810 HD22 ASN 108 2HD2 ASN 108 -0.867 -18.522 10.494 811 H ARG 109 HN ARG 109 -2.865 -14.175 8.583 812 HA ARG 109 HA ARG 109 -4.922 -16.115 8.594 813 HB2 ARG 109 2HB ARG 109 -4.683 -13.274 9.439 814 HB3 ARG 109 1HB ARG 109 -6.304 -13.917 9.219 815 HG2 ARG 109 2HG ARG 109 -5.498 -14.085 11.543 816 HG3 ARG 109 1HG ARG 109 -5.895 -15.651 10.834 817 HD2 ARG 109 2HD ARG 109 -3.465 -15.935 10.317 818 HD3 ARG 109 1HD ARG 109 -3.154 -14.465 11.239 819 HE ARG 109 HE ARG 109 -3.823 -15.601 13.218 820 HH11 ARG 109 1HH1 ARG 109 -3.636 -17.675 10.398 821 HH12 ARG 109 2HH1 ARG 109 -3.500 -19.138 11.327 822 HH21 ARG 109 1HH2 ARG 109 -3.661 -17.524 14.430 823 HH22 ARG 109 2HH2 ARG 109 -3.537 -19.050 13.614 824 H PHE 110 HN PHE 110 -4.388 -13.256 6.573 825 HA PHE 110 HA PHE 110 -6.874 -13.415 5.227 826 HB2 PHE 110 2HB PHE 110 -4.267 -12.054 4.624 827 HB3 PHE 110 1HB PHE 110 -5.548 -12.083 3.419 828 HD1 PHE 110 1HD PHE 110 -5.935 -11.774 7.099 829 HD2 PHE 110 2HD PHE 110 -6.160 -9.840 3.317 830 HE1 PHE 110 1HE PHE 110 -6.982 -9.820 8.165 831 HE2 PHE 110 2HE PHE 110 -7.209 -7.884 4.374 832 HZ PHE 110 HZ PHE 110 -7.621 -7.872 6.801 833 H ARG 111 HN ARG 111 -3.692 -14.827 4.571 834 HA ARG 111 HA ARG 111 -4.528 -15.978 2.087 835 HB2 ARG 111 2HB ARG 111 -2.108 -16.297 3.819 836 HB3 ARG 111 1HB ARG 111 -2.402 -17.424 2.501 837 HG2 ARG 111 2HG ARG 111 -2.080 -14.438 2.270 838 HG3 ARG 111 1HG ARG 111 -0.936 -15.676 1.746 839 HD2 ARG 111 2HD ARG 111 -2.677 -16.549 0.201 840 HD3 ARG 111 1HD ARG 111 -3.700 -15.186 0.646 841 HE ARG 111 HE ARG 111 -1.229 -14.194 -0.218 842 HH11 ARG 111 1HH1 ARG 111 -4.040 -15.852 -1.505 843 HH12 ARG 111 2HH1 ARG 111 -3.810 -15.249 -3.119 844 HH21 ARG 111 1HH2 ARG 111 -0.936 -13.398 -2.343 845 HH22 ARG 111 2HH2 ARG 111 -2.054 -13.864 -3.595 846 H ASN 112 HN ASN 112 -4.645 -16.974 5.414 847 HA ASN 112 HA ASN 112 -5.166 -19.723 5.000 848 HB2 ASN 112 2HB ASN 112 -5.661 -17.779 7.219 849 HB3 ASN 112 1HB ASN 112 -6.487 -19.324 7.267 850 HD21 ASN 112 1HD2 ASN 112 -3.295 -18.910 5.903 851 HD22 ASN 112 2HD2 ASN 112 -2.451 -19.775 7.139 852 H SER 113 HN SER 113 -7.237 -16.876 5.186 853 HA SER 113 HA SER 113 -9.652 -18.382 4.778 854 HB2 SER 113 2HB SER 113 -9.576 -16.238 6.058 855 HB3 SER 113 1HB SER 113 -9.195 -15.393 4.557 856 HG SER 113 HG SER 113 -11.536 -15.718 5.425 857 H GLY 114 HN GLY 114 -7.495 -16.380 2.823 858 HA2 GLY 114 2HA GLY 114 -7.108 -16.821 0.508 859 HA3 GLY 114 1HA GLY 114 -8.722 -17.517 0.408 860 H LYS 115 HN LYS 115 -9.601 -15.152 2.108 861 HA LYS 115 HA LYS 115 -9.983 -13.291 -0.111 862 HB2 LYS 115 2HB LYS 115 -11.957 -14.454 0.859 863 HB3 LYS 115 1HB LYS 115 -11.595 -13.737 2.412 864 HG2 LYS 115 2HG LYS 115 -11.899 -11.807 0.243 865 HG3 LYS 115 1HG LYS 115 -13.332 -12.772 0.591 866 HD2 LYS 115 2HD LYS 115 -11.747 -11.220 2.633 867 HD3 LYS 115 1HD LYS 115 -13.263 -10.685 1.909 868 HE2 LYS 115 2HE LYS 115 -14.477 -12.456 2.937 869 HE3 LYS 115 1HE LYS 115 -12.994 -13.272 3.431 870 HZ1 LYS 115 3HZ LYS 115 -14.174 -12.025 5.232 871 HZ2 LYS 115 1HZ LYS 115 -13.785 -10.583 4.423 872 HZ3 LYS 115 2HZ LYS 115 -12.550 -11.582 5.019 873 H GLY 116 HN GLY 116 -10.435 -10.975 0.867 874 HA2 GLY 116 2HA GLY 116 -9.723 -9.320 2.464 875 HA3 GLY 116 1HA GLY 116 -8.402 -10.389 2.921 876 H PHE 117 HN PHE 117 -8.433 -7.553 1.986 877 HA PHE 117 HA PHE 117 -6.766 -7.873 -0.427 878 HB2 PHE 117 2HB PHE 117 -8.629 -5.605 0.306 879 HB3 PHE 117 1HB PHE 117 -7.517 -5.577 -1.058 880 HD1 PHE 117 1HD PHE 117 -10.474 -7.312 0.341 881 HD2 PHE 117 2HD PHE 117 -8.096 -6.557 -3.106 882 HE1 PHE 117 1HE PHE 117 -12.186 -8.374 -1.072 883 HE2 PHE 117 2HE PHE 117 -9.803 -7.618 -4.524 884 HZ PHE 117 HZ PHE 117 -11.853 -8.529 -3.504 885 H LEU 118 HN LEU 118 -4.858 -6.730 -0.533 886 HA LEU 118 HA LEU 118 -4.089 -5.150 1.818 887 HB2 LEU 118 2HB LEU 118 -3.328 -7.798 1.468 888 HB3 LEU 118 1HB LEU 118 -1.960 -6.894 0.854 889 HG LEU 118 HG LEU 118 -1.581 -7.444 3.165 890 HD11 LEU 118 1HD1 LEU 118 -1.207 -5.233 4.111 891 HD12 LEU 118 2HD1 LEU 118 -2.268 -4.525 2.893 892 HD13 LEU 118 3HD1 LEU 118 -0.750 -5.280 2.407 893 HD21 LEU 118 3HD2 LEU 118 -3.884 -7.751 3.863 894 HD22 LEU 118 1HD2 LEU 118 -4.168 -6.015 3.733 895 HD23 LEU 118 2HD2 LEU 118 -3.047 -6.637 4.943 896 H LEU 119 HN LEU 119 -3.036 -3.349 1.245 897 HA LEU 119 HA LEU 119 -1.561 -3.323 -1.304 898 HB2 LEU 119 2HB LEU 119 -3.649 -2.058 -1.548 899 HB3 LEU 119 1HB LEU 119 -3.232 -1.084 -0.151 900 HG LEU 119 HG LEU 119 -1.272 -0.199 -1.385 901 HD11 LEU 119 1HD1 LEU 119 -2.427 -1.758 -3.693 902 HD12 LEU 119 2HD1 LEU 119 -0.878 -2.047 -2.900 903 HD13 LEU 119 3HD1 LEU 119 -1.139 -0.560 -3.810 904 HD21 LEU 119 3HD2 LEU 119 -3.917 0.143 -2.799 905 HD22 LEU 119 1HD2 LEU 119 -2.535 1.233 -2.906 906 HD23 LEU 119 2HD2 LEU 119 -3.381 1.031 -1.371 907 H LEU 120 HN LEU 120 0.520 -3.108 -0.882 908 HA LEU 120 HA LEU 120 1.323 -1.536 1.479 909 HB2 LEU 120 2HB LEU 120 2.733 -3.804 0.076 910 HB3 LEU 120 1HB LEU 120 3.452 -2.841 1.351 911 HG LEU 120 HG LEU 120 1.005 -4.584 1.654 912 HD11 LEU 120 1HD1 LEU 120 3.058 -5.870 1.327 913 HD12 LEU 120 2HD1 LEU 120 2.457 -6.022 2.978 914 HD13 LEU 120 3HD1 LEU 120 3.830 -4.971 2.632 915 HD21 LEU 120 3HD2 LEU 120 0.964 -2.647 3.135 916 HD22 LEU 120 1HD2 LEU 120 2.594 -3.026 3.690 917 HD23 LEU 120 2HD2 LEU 120 1.264 -4.128 4.045 918 H GLY 121 HN GLY 121 2.272 0.347 1.076 919 HA2 GLY 121 2HA GLY 121 3.630 0.691 -1.531 920 HA3 GLY 121 1HA GLY 121 2.832 1.994 -0.655 921 H SER 122 HN SER 122 5.750 0.389 -1.205 922 HA SER 122 HA SER 122 6.980 1.753 1.093 923 HB2 SER 122 2HB SER 122 7.425 -1.074 0.141 924 HB3 SER 122 1HB SER 122 8.565 -0.234 1.194 925 HG SER 122 HG SER 122 7.134 -0.224 2.793 926 H GLU 123 HN GLU 123 9.519 1.508 0.790 927 HA GLU 123 HA GLU 123 10.086 2.597 -1.881 928 HB2 GLU 123 2HB GLU 123 10.597 4.000 0.124 929 HB3 GLU 123 1HB GLU 123 11.740 2.773 0.652 930 HG2 GLU 123 2HG GLU 123 12.989 4.489 -0.377 931 HG3 GLU 123 1HG GLU 123 12.972 3.128 -1.497 932 H TYR 124 HN TYR 124 10.837 1.146 -3.250 933 HA TYR 124 HA TYR 124 12.201 -0.364 -4.235 934 HB2 TYR 124 2HB TYR 124 13.763 -0.330 -1.644 935 HB3 TYR 124 1HB TYR 124 14.276 -1.131 -3.125 936 HD1 TYR 124 1HD TYR 124 13.970 0.641 -5.251 937 HD2 TYR 124 2HD TYR 124 14.918 1.614 -1.224 938 HE1 TYR 124 1HE TYR 124 15.022 2.728 -6.009 939 HE2 TYR 124 2HE TYR 124 15.969 3.708 -1.971 940 HH TYR 124 HH TYR 124 15.551 4.979 -5.060 941 H THR 125 HN THR 125 13.300 -2.689 -3.550 942 HA THR 125 HA THR 125 10.894 -4.231 -3.124 943 HB THR 125 HB THR 125 12.367 -6.155 -3.841 944 HG1 THR 125 1HG THR 125 14.375 -5.272 -4.925 945 HG21 THR 125 3HG2 THR 125 12.491 -5.418 -6.187 946 HG22 THR 125 1HG2 THR 125 12.233 -3.751 -5.670 947 HG23 THR 125 2HG2 THR 125 10.961 -4.951 -5.442 948 HA PRO 126 HA PRO 126 11.402 -5.607 0.987 949 HB2 PRO 126 2HB PRO 126 11.088 -8.401 0.030 950 HB3 PRO 126 1HB PRO 126 10.146 -7.507 1.223 951 HG2 PRO 126 2HG PRO 126 9.143 -7.978 -1.187 952 HG3 PRO 126 1HG PRO 126 8.891 -6.403 -0.401 953 HD2 PRO 126 2HD PRO 126 10.824 -7.163 -2.562 954 HD3 PRO 126 1HD PRO 126 9.830 -5.700 -2.408 955 H GLN 127 HN GLN 127 13.401 -7.163 -1.420 956 HA GLN 127 HA GLN 127 15.082 -8.466 0.524 957 HB2 GLN 127 2HB GLN 127 15.395 -8.091 -2.446 958 HB3 GLN 127 1HB GLN 127 16.546 -8.966 -1.440 959 HG2 GLN 127 2HG GLN 127 15.220 -10.655 -2.255 960 HG3 GLN 127 1HG GLN 127 14.496 -10.338 -0.687 961 HE21 GLN 127 1HE2 GLN 127 14.143 -8.326 -3.534 962 HE22 GLN 127 2HE2 GLN 127 12.444 -8.604 -3.752 963 H GLN 128 HN GLN 128 14.904 -5.366 -0.902 964 HA GLN 128 HA GLN 128 17.651 -4.700 -0.181 965 HB2 GLN 128 2HB GLN 128 15.471 -3.087 -1.513 966 HB3 GLN 128 1HB GLN 128 17.055 -2.440 -1.107 967 HG2 GLN 128 2HG GLN 128 18.104 -4.096 -2.562 968 HG3 GLN 128 1HG GLN 128 16.512 -4.731 -2.981 969 HE21 GLN 128 1HE2 GLN 128 15.178 -3.559 -4.334 970 HE22 GLN 128 2HE2 GLN 128 15.753 -2.218 -5.268 971 H LEU 129 HN LEU 129 14.550 -4.704 1.128 972 HA LEU 129 HA LEU 129 15.082 -2.617 3.077 973 HB2 LEU 129 2HB LEU 129 12.714 -4.453 2.698 974 HB3 LEU 129 1HB LEU 129 12.812 -3.189 3.904 975 HG LEU 129 HG LEU 129 12.847 -2.763 0.920 976 HD11 LEU 129 1HD1 LEU 129 10.640 -1.795 1.242 977 HD12 LEU 129 2HD1 LEU 129 10.707 -2.178 2.962 978 HD13 LEU 129 3HD1 LEU 129 10.667 -3.477 1.770 979 HD21 LEU 129 3HD2 LEU 129 14.170 -1.096 2.125 980 HD22 LEU 129 1HD2 LEU 129 12.795 -0.767 3.181 981 HD23 LEU 129 2HD2 LEU 129 12.696 -0.394 1.460 982 H VAL 130 HN VAL 130 15.686 -2.984 5.141 983 HA VAL 130 HA VAL 130 16.342 -5.727 5.862 984 HB VAL 130 HB VAL 130 17.003 -3.186 7.363 985 HG11 VAL 130 1HG1 VAL 130 17.038 -5.222 8.741 986 HG12 VAL 130 2HG1 VAL 130 18.653 -4.550 8.524 987 HG13 VAL 130 3HG1 VAL 130 18.158 -5.967 7.598 988 HG21 VAL 130 3HG2 VAL 130 18.728 -4.781 5.470 989 HG22 VAL 130 1HG2 VAL 130 19.219 -3.358 6.385 990 HG23 VAL 130 2HG2 VAL 130 18.001 -3.212 5.119 991 H ILE 131 HN ILE 131 14.333 -6.552 6.286 992 HA ILE 131 HA ILE 131 13.055 -5.570 8.750 993 HB ILE 131 HB ILE 131 10.943 -6.594 7.915 994 HG12 ILE 131 2HG1 ILE 131 12.479 -6.855 5.316 995 HG13 ILE 131 1HG1 ILE 131 11.945 -8.189 6.333 996 HG21 ILE 131 1HG2 ILE 131 11.299 -4.208 7.694 997 HG22 ILE 131 2HG2 ILE 131 10.415 -4.820 6.296 998 HG23 ILE 131 3HG2 ILE 131 12.133 -4.450 6.159 999 HD11 ILE 131 3HD1 ILE 131 10.501 -7.882 4.398 1000 HD12 ILE 131 1HD1 ILE 131 10.140 -6.239 4.925 1001 HD13 ILE 131 2HD1 ILE 131 9.629 -7.612 5.906 1002 H ARG 132 HN ARG 132 11.529 -7.638 9.487 1003 HA ARG 132 HA ARG 132 13.386 -9.560 10.400 1004 HB2 ARG 132 2HB ARG 132 10.383 -9.892 10.273 1005 HB3 ARG 132 1HB ARG 132 11.496 -10.746 11.332 1006 HG2 ARG 132 2HG ARG 132 12.081 -8.445 12.275 1007 HG3 ARG 132 1HG ARG 132 10.629 -7.882 11.448 1008 HD2 ARG 132 2HD ARG 132 9.856 -8.377 13.580 1009 HD3 ARG 132 1HD ARG 132 9.455 -9.830 12.666 1010 HE ARG 132 HE ARG 132 12.000 -10.155 13.803 1011 HH11 ARG 132 1HH1 ARG 132 8.636 -10.008 14.753 1012 HH12 ARG 132 2HH1 ARG 132 8.877 -10.902 16.223 1013 HH21 ARG 132 1HH2 ARG 132 12.323 -11.334 15.708 1014 HH22 ARG 132 2HH2 ARG 132 10.991 -11.637 16.784 1015 H GLU 133 HN GLU 133 13.985 -11.502 9.616 1016 HA GLU 133 HA GLU 133 14.007 -11.826 6.856 1017 HB2 GLU 133 2HB GLU 133 15.694 -12.739 8.398 1018 HB3 GLU 133 1HB GLU 133 14.522 -13.914 8.974 1019 HG2 GLU 133 2HG GLU 133 14.467 -15.008 6.857 1020 HG3 GLU 133 1HG GLU 133 15.439 -13.734 6.117 1021 H ASP 134 HN ASP 134 11.987 -13.425 9.286 1022 HA ASP 134 HA ASP 134 10.824 -15.309 7.533 1023 HB2 ASP 134 2HB ASP 134 10.724 -15.518 9.988 1024 HB3 ASP 134 1HB ASP 134 9.657 -14.119 10.058 1025 H LEU 135 HN LEU 135 9.936 -12.024 8.432 1026 HA LEU 135 HA LEU 135 7.409 -11.988 7.181 1027 HB2 LEU 135 2HB LEU 135 8.110 -10.341 8.868 1028 HB3 LEU 135 1HB LEU 135 9.300 -9.702 7.751 1029 HG LEU 135 HG LEU 135 7.463 -9.027 6.228 1030 HD11 LEU 135 1HD1 LEU 135 5.690 -9.898 8.508 1031 HD12 LEU 135 2HD1 LEU 135 5.781 -10.646 6.914 1032 HD13 LEU 135 3HD1 LEU 135 5.166 -9.001 7.082 1033 HD21 LEU 135 3HD2 LEU 135 8.423 -7.433 7.802 1034 HD22 LEU 135 1HD2 LEU 135 7.269 -7.943 9.036 1035 HD23 LEU 135 2HD2 LEU 135 6.700 -7.138 7.574 1036 H ARG 136 HN ARG 136 10.663 -11.367 6.012 1037 HA ARG 136 HA ARG 136 10.007 -10.081 3.598 1038 HB2 ARG 136 2HB ARG 136 12.276 -10.063 4.472 1039 HB3 ARG 136 1HB ARG 136 12.392 -11.809 4.302 1040 HG2 ARG 136 2HG ARG 136 12.195 -11.564 1.863 1041 HG3 ARG 136 1HG ARG 136 12.144 -9.812 2.058 1042 HD2 ARG 136 2HD ARG 136 14.416 -11.551 3.009 1043 HD3 ARG 136 1HD ARG 136 14.387 -10.744 1.442 1044 HE ARG 136 HE ARG 136 14.117 -8.630 2.870 1045 HH11 ARG 136 1HH1 ARG 136 15.982 -11.450 3.806 1046 HH12 ARG 136 2HH1 ARG 136 17.064 -10.552 4.821 1047 HH21 ARG 136 1HH2 ARG 136 15.582 -7.440 4.166 1048 HH22 ARG 136 2HH2 ARG 136 16.850 -8.277 5.025 1049 H THR 137 HN THR 137 10.320 -13.542 4.369 1050 HA THR 137 HA THR 137 9.976 -14.281 1.618 1051 HB THR 137 HB THR 137 11.257 -15.713 3.211 1052 HG1 THR 137 1HG THR 137 9.121 -16.669 1.642 1053 HG21 THR 137 3HG2 THR 137 9.807 -15.540 5.165 1054 HG22 THR 137 1HG2 THR 137 10.022 -17.228 4.696 1055 HG23 THR 137 2HG2 THR 137 8.524 -16.385 4.300 1056 H ARG 138 HN ARG 138 7.848 -13.571 4.256 1057 HA ARG 138 HA ARG 138 5.550 -14.885 3.133 1058 HB2 ARG 138 2HB ARG 138 5.522 -12.571 5.065 1059 HB3 ARG 138 1HB ARG 138 4.294 -13.812 4.848 1060 HG2 ARG 138 2HG ARG 138 7.063 -14.280 5.918 1061 HG3 ARG 138 1HG ARG 138 5.610 -14.120 6.891 1062 HD2 ARG 138 2HD ARG 138 4.677 -16.115 5.899 1063 HD3 ARG 138 1HD ARG 138 6.038 -16.229 4.780 1064 HE ARG 138 HE ARG 138 7.181 -16.247 7.266 1065 HH11 ARG 138 1HH1 ARG 138 4.765 -18.199 5.657 1066 HH12 ARG 138 2HH1 ARG 138 5.159 -19.643 6.528 1067 HH21 ARG 138 1HH2 ARG 138 7.728 -18.131 8.404 1068 HH22 ARG 138 2HH2 ARG 138 6.834 -19.606 8.120 1069 H MET 139 HN MET 139 7.188 -11.894 2.686 1070 HA MET 139 HA MET 139 5.138 -10.320 1.579 1071 HB2 MET 139 2HB MET 139 8.126 -10.329 1.169 1072 HB3 MET 139 1HB MET 139 7.074 -9.133 0.434 1073 HG2 MET 139 2HG MET 139 7.340 -9.623 3.387 1074 HG3 MET 139 1HG MET 139 8.146 -8.337 2.486 1075 HE1 MET 139 3HE MET 139 7.173 -6.491 4.096 1076 HE2 MET 139 1HE MET 139 6.389 -7.750 5.051 1077 HE3 MET 139 2HE MET 139 5.465 -6.349 4.510 1078 H ALA 140 HN ALA 140 6.853 -13.027 0.343 1079 HA ALA 140 HA ALA 140 6.429 -12.510 -2.437 1080 HB1 ALA 140 1HB ALA 140 8.223 -13.984 -1.645 1081 HB2 ALA 140 2HB ALA 140 7.151 -14.810 -2.776 1082 HB3 ALA 140 3HB ALA 140 7.017 -15.125 -1.046 1083 H TYR 141 HN TYR 141 4.289 -13.224 -0.004 1084 HA TYR 141 HA TYR 141 2.540 -14.864 -1.653 1085 HB2 TYR 141 2HB TYR 141 2.476 -14.025 1.232 1086 HB3 TYR 141 1HB TYR 141 1.058 -14.715 0.453 1087 HD1 TYR 141 2HD TYR 141 1.073 -17.049 -0.326 1088 HD2 TYR 141 1HD TYR 141 4.395 -15.402 1.767 1089 HE1 TYR 141 2HE TYR 141 1.936 -19.314 0.075 1090 HE2 TYR 141 1HE TYR 141 5.265 -17.668 2.173 1091 HH TYR 141 HH TYR 141 4.137 -20.387 0.524 1092 H CYS 142 HN CYS 142 3.213 -11.876 -1.982 1093 HA CYS 142 HA CYS 142 0.470 -11.229 -2.734 1094 HB2 CYS 142 2HB CYS 142 0.800 -8.875 -2.142 1095 HB3 CYS 142 1HB CYS 142 0.950 -9.901 -0.723 1096 HG CYS 142 HG CYS 142 3.925 -9.818 -1.247 1097 H LEU 143 HN LEU 143 0.461 -9.552 -4.486 1098 HA LEU 143 HA LEU 143 2.501 -10.270 -6.416 1099 HB2 LEU 143 2HB LEU 143 -0.010 -8.623 -6.649 1100 HB3 LEU 143 1HB LEU 143 1.097 -8.872 -7.978 1101 HG LEU 143 HG LEU 143 0.663 -11.373 -7.562 1102 HD11 LEU 143 1HD1 LEU 143 -1.754 -10.212 -6.201 1103 HD12 LEU 143 2HD1 LEU 143 -0.485 -11.164 -5.433 1104 HD13 LEU 143 3HD1 LEU 143 -1.532 -11.907 -6.641 1105 HD21 LEU 143 3HD2 LEU 143 -0.048 -10.203 -9.555 1106 HD22 LEU 143 1HD2 LEU 143 -1.463 -9.580 -8.708 1107 HD23 LEU 143 2HD2 LEU 143 -1.313 -11.310 -9.020 1108 H VAL 144 HN VAL 144 3.670 -8.674 -7.652 1109 HA VAL 144 HA VAL 144 4.136 -6.214 -6.105 1110 HB VAL 144 HB VAL 144 6.191 -7.790 -7.670 1111 HG11 VAL 144 1HG1 VAL 144 6.646 -5.415 -7.712 1112 HG12 VAL 144 2HG1 VAL 144 7.817 -6.247 -6.689 1113 HG13 VAL 144 3HG1 VAL 144 6.498 -5.329 -5.958 1114 HG21 VAL 144 3HG2 VAL 144 5.521 -8.927 -5.609 1115 HG22 VAL 144 1HG2 VAL 144 5.892 -7.473 -4.684 1116 HG23 VAL 144 2HG2 VAL 144 7.182 -8.338 -5.520 1117 H TYR 145 HN TYR 145 3.489 -4.495 -7.193 1118 HA TYR 145 HA TYR 145 3.511 -4.552 -10.126 1119 HB2 TYR 145 2HB TYR 145 2.083 -2.844 -8.117 1120 HB3 TYR 145 1HB TYR 145 2.318 -2.261 -9.758 1121 HD1 TYR 145 1HD TYR 145 2.063 -5.268 -10.839 1122 HD2 TYR 145 2HD TYR 145 -0.339 -2.708 -8.438 1123 HE1 TYR 145 1HE TYR 145 0.049 -6.465 -11.586 1124 HE2 TYR 145 2HE TYR 145 -2.354 -3.906 -9.167 1125 HH TYR 145 HH TYR 145 -2.206 -6.873 -10.907 1126 H GLU 146 HN GLU 146 5.096 -3.638 -11.199 1127 HA GLU 146 HA GLU 146 6.988 -1.917 -9.865 1128 HB2 GLU 146 2HB GLU 146 8.140 -1.892 -12.087 1129 HB3 GLU 146 1HB GLU 146 7.892 -3.502 -11.430 1130 HG2 GLU 146 2HG GLU 146 5.843 -3.648 -12.897 1131 HG3 GLU 146 1HG GLU 146 6.416 -2.179 -13.688 1132 H VAL 147 HN VAL 147 6.957 0.216 -9.820 1133 HA VAL 147 HA VAL 147 4.745 1.620 -11.005 1134 HB VAL 147 HB VAL 147 5.604 2.095 -8.709 1135 HG11 VAL 147 1HG1 VAL 147 7.924 3.316 -10.190 1136 HG12 VAL 147 2HG1 VAL 147 7.974 1.918 -9.116 1137 HG13 VAL 147 3HG1 VAL 147 7.593 3.513 -8.469 1138 HG21 VAL 147 3HG2 VAL 147 5.591 4.432 -10.626 1139 HG22 VAL 147 1HG2 VAL 147 5.398 4.542 -8.875 1140 HG23 VAL 147 2HG2 VAL 147 4.183 3.710 -9.846 1141 H LYS 148 HN LYS 148 8.047 1.045 -11.767 1142 HA LYS 148 HA LYS 148 8.288 3.291 -13.568 1143 HB2 LYS 148 2HB LYS 148 10.113 0.925 -13.087 1144 HB3 LYS 148 1HB LYS 148 10.486 2.281 -14.137 1145 HG2 LYS 148 2HG LYS 148 10.371 3.782 -12.186 1146 HG3 LYS 148 1HG LYS 148 10.105 2.373 -11.153 1147 HD2 LYS 148 2HD LYS 148 12.249 1.440 -11.876 1148 HD3 LYS 148 1HD LYS 148 12.512 2.838 -12.918 1149 HE2 LYS 148 2HE LYS 148 12.441 4.285 -10.913 1150 HE3 LYS 148 1HE LYS 148 12.301 2.838 -9.912 1151 HZ1 LYS 148 3HZ LYS 148 14.442 2.092 -10.751 1152 HZ2 LYS 148 1HZ LYS 148 14.583 3.624 -10.032 1153 HZ3 LYS 148 2HZ LYS 148 14.568 3.481 -11.720 1154 HA PRO 149 HA PRO 149 6.652 0.787 -16.919 1155 HB2 PRO 149 2HB PRO 149 6.692 3.123 -18.579 1156 HB3 PRO 149 1HB PRO 149 5.296 2.374 -17.807 1157 HG2 PRO 149 2HG PRO 149 6.303 4.860 -17.157 1158 HG3 PRO 149 1HG PRO 149 5.301 3.865 -16.084 1159 HD2 PRO 149 2HD PRO 149 8.274 4.226 -16.118 1160 HD3 PRO 149 1HD PRO 149 7.169 4.079 -14.732 Start of MODEL 17 1 H1 MET 1 H1 MET 1 -29.271 74.925 36.520 2 H2 MET 1 H2 MET 1 -28.815 76.334 37.345 3 H3 MET 1 H3 MET 1 -28.836 74.848 38.157 4 HA MET 1 HA MET 1 -27.033 75.598 35.936 5 HB2 MET 1 2HB MET 1 -26.558 75.166 38.891 6 HB3 MET 1 1HB MET 1 -25.271 75.286 37.703 7 HG2 MET 1 2HG MET 1 -25.492 77.392 38.787 8 HG3 MET 1 1HG MET 1 -26.072 77.560 37.133 9 HE1 MET 1 2HE MET 1 -28.324 80.058 39.164 10 HE2 MET 1 3HE MET 1 -27.234 79.875 37.792 11 HE3 MET 1 1HE MET 1 -26.623 79.683 39.439 12 H GLY 2 HN GLY 2 -26.880 73.863 34.665 13 HA2 GLY 2 2HA GLY 2 -26.680 71.222 35.982 14 HA3 GLY 2 1HA GLY 2 -27.606 71.473 34.512 15 H HIS 3 HN HIS 3 -24.327 71.800 35.820 16 HA HIS 3 HA HIS 3 -23.055 71.745 33.285 17 HB2 HIS 3 2HB HIS 3 -21.895 72.688 35.183 18 HB3 HIS 3 1HB HIS 3 -22.013 71.172 36.066 19 HD1 HIS 3 1HD HIS 3 -20.248 72.658 33.048 20 HD2 HIS 3 2HD HIS 3 -19.931 69.450 35.681 21 HE1 HIS 3 1HE HIS 3 -18.046 71.564 32.526 22 HE2 HIS 3 2HE HIS 3 -17.899 69.585 34.083 23 H HIS 4 HN HIS 4 -23.924 70.021 32.140 24 HA HIS 4 HA HIS 4 -22.609 67.478 32.722 25 HB2 HIS 4 2HB HIS 4 -25.579 67.703 32.144 26 HB3 HIS 4 1HB HIS 4 -24.670 66.198 32.142 27 HD1 HIS 4 1HD HIS 4 -23.399 65.766 34.611 28 HD2 HIS 4 2HD HIS 4 -26.789 68.180 34.513 29 HE1 HIS 4 1HE HIS 4 -24.271 65.813 36.970 30 HE2 HIS 4 2HE HIS 4 -26.389 67.176 36.864 31 H HIS 5 HN HIS 5 -22.122 66.293 30.835 32 HA HIS 5 HA HIS 5 -22.518 67.867 28.376 33 HB2 HIS 5 2HB HIS 5 -20.169 67.627 29.001 34 HB3 HIS 5 1HB HIS 5 -20.338 65.876 29.037 35 HD1 HIS 5 1HD HIS 5 -20.331 64.636 26.782 36 HD2 HIS 5 2HD HIS 5 -20.073 68.768 26.423 37 HE1 HIS 5 1HE HIS 5 -19.721 65.067 24.381 38 HE2 HIS 5 2HE HIS 5 -19.790 67.579 24.141 39 H HIS 6 HN HIS 6 -22.819 64.707 29.817 40 HA HIS 6 HA HIS 6 -24.068 62.895 29.247 41 HB2 HIS 6 2HB HIS 6 -25.005 64.650 26.973 42 HB3 HIS 6 1HB HIS 6 -25.572 63.004 27.212 43 HD1 HIS 6 1HD HIS 6 -27.741 62.924 28.346 44 HD2 HIS 6 2HD HIS 6 -25.510 66.218 29.543 45 HE1 HIS 6 1HE HIS 6 -29.200 64.175 29.971 46 HE2 HIS 6 2HE HIS 6 -27.918 66.288 30.483 47 H HIS 7 HN HIS 7 -23.979 61.064 27.904 48 HA HIS 7 HA HIS 7 -22.214 61.173 25.568 49 HB2 HIS 7 2HB HIS 7 -21.850 59.471 28.003 50 HB3 HIS 7 1HB HIS 7 -21.442 58.789 26.433 51 HD1 HIS 7 1HD HIS 7 -19.127 59.189 25.680 52 HD2 HIS 7 2HD HIS 7 -20.365 62.032 28.456 53 HE1 HIS 7 1HE HIS 7 -17.117 60.637 26.117 54 HE2 HIS 7 2HE HIS 7 -17.961 62.480 27.613 55 H HIS 8 HN HIS 8 -23.674 60.730 24.026 56 HA HIS 8 HA HIS 8 -25.667 58.655 24.538 57 HB2 HIS 8 2HB HIS 8 -26.805 59.412 22.528 58 HB3 HIS 8 1HB HIS 8 -26.479 60.777 23.585 59 HD1 HIS 8 1HD HIS 8 -26.099 59.633 20.159 60 HD2 HIS 8 2HD HIS 8 -24.221 62.412 22.621 61 HE1 HIS 8 1HE HIS 8 -24.816 61.156 18.617 62 HE2 HIS 8 2HE HIS 8 -23.555 62.717 20.140 63 H SER 9 HN SER 9 -25.423 56.664 23.877 64 HA SER 9 HA SER 9 -23.080 55.971 22.329 65 HB2 SER 9 2HB SER 9 -25.169 54.091 23.433 66 HB3 SER 9 1HB SER 9 -23.497 53.721 23.016 67 HG SER 9 HG SER 9 -24.318 54.269 25.355 68 H HIS 10 HN HIS 10 -23.095 54.667 20.460 69 HA HIS 10 HA HIS 10 -25.688 54.364 19.110 70 HB2 HIS 10 2HB HIS 10 -24.465 56.297 18.112 71 HB3 HIS 10 1HB HIS 10 -23.129 55.218 17.724 72 HD1 HIS 10 1HD HIS 10 -26.668 56.009 16.741 73 HD2 HIS 10 2HD HIS 10 -23.508 53.619 15.462 74 HE1 HIS 10 1HE HIS 10 -27.331 55.164 14.466 75 HE2 HIS 10 2HE HIS 10 -25.477 53.614 13.771 76 H MET 11 HN MET 11 -26.009 52.249 19.020 77 HA MET 11 HA MET 11 -23.675 50.485 18.698 78 HB2 MET 11 2HB MET 11 -25.127 50.188 20.725 79 HB3 MET 11 1HB MET 11 -26.445 49.741 19.651 80 HG2 MET 11 2HG MET 11 -25.189 47.822 18.863 81 HG3 MET 11 1HG MET 11 -23.820 48.283 19.872 82 HE1 MET 11 3HE MET 11 -25.053 45.102 21.727 83 HE2 MET 11 1HE MET 11 -23.669 45.952 21.043 84 HE3 MET 11 2HE MET 11 -24.961 45.378 19.986 85 H ASP 12 HN ASP 12 -23.384 49.559 16.801 86 HA ASP 12 HA ASP 12 -25.643 49.542 14.896 87 HB2 ASP 12 2HB ASP 12 -23.734 51.083 14.376 88 HB3 ASP 12 1HB ASP 12 -22.681 49.677 14.282 89 H TYR 13 HN TYR 13 -26.035 47.691 13.694 90 HA TYR 13 HA TYR 13 -24.471 45.310 14.464 91 HB2 TYR 13 2HB TYR 13 -27.396 45.373 13.696 92 HB3 TYR 13 1HB TYR 13 -26.487 43.979 14.266 93 HD1 TYR 13 1HD TYR 13 -28.152 47.088 15.234 94 HD2 TYR 13 2HD TYR 13 -25.958 43.721 16.628 95 HE1 TYR 13 1HE TYR 13 -28.844 47.600 17.535 96 HE2 TYR 13 2HE TYR 13 -26.643 44.224 18.936 97 HH TYR 13 HH TYR 13 -27.406 46.181 20.249 98 HA PRO 14 HA PRO 14 -24.198 45.384 9.924 99 HB2 PRO 14 2HB PRO 14 -21.531 45.531 9.728 100 HB3 PRO 14 1HB PRO 14 -22.507 46.945 10.139 101 HG2 PRO 14 2HG PRO 14 -20.699 45.364 11.841 102 HG3 PRO 14 1HG PRO 14 -21.288 47.018 12.060 103 HD2 PRO 14 2HD PRO 14 -22.282 44.567 13.249 104 HD3 PRO 14 1HD PRO 14 -22.765 46.240 13.588 105 H SER 15 HN SER 15 -22.993 44.014 8.386 106 HA SER 15 HA SER 15 -22.206 42.097 7.526 107 HB2 SER 15 2HB SER 15 -20.949 41.732 10.247 108 HB3 SER 15 1HB SER 15 -20.479 40.899 8.763 109 HG SER 15 HG SER 15 -19.309 42.936 9.466 110 H PHE 16 HN PHE 16 -24.205 41.127 7.221 111 HA PHE 16 HA PHE 16 -24.368 38.604 8.658 112 HB2 PHE 16 2HB PHE 16 -26.012 40.121 9.763 113 HB3 PHE 16 1HB PHE 16 -26.830 40.303 8.216 114 HD1 PHE 16 2HD PHE 16 -25.802 37.749 10.712 115 HD2 PHE 16 1HD PHE 16 -28.486 38.797 7.577 116 HE1 PHE 16 2HE PHE 16 -27.136 35.734 11.183 117 HE2 PHE 16 1HE PHE 16 -29.819 36.783 8.041 118 HZ PHE 16 HZ PHE 16 -29.147 35.249 9.844 119 H ASP 17 HN ASP 17 -23.997 37.222 7.080 120 HA ASP 17 HA ASP 17 -25.751 37.128 4.778 121 HB2 ASP 17 2HB ASP 17 -24.064 38.646 3.931 122 HB3 ASP 17 1HB ASP 17 -22.772 37.594 4.495 123 H LYS 18 HN LYS 18 -25.955 35.035 3.993 124 HA LYS 18 HA LYS 18 -24.364 33.042 5.457 125 HB2 LYS 18 2HB LYS 18 -26.282 31.495 5.123 126 HB3 LYS 18 1HB LYS 18 -26.663 32.897 6.110 127 HG2 LYS 18 2HG LYS 18 -27.790 33.942 4.233 128 HG3 LYS 18 1HG LYS 18 -27.357 32.580 3.196 129 HD2 LYS 18 2HD LYS 18 -28.658 31.077 4.603 130 HD3 LYS 18 1HD LYS 18 -29.064 32.417 5.678 131 HE2 LYS 18 2HE LYS 18 -30.235 33.534 3.849 132 HE3 LYS 18 1HE LYS 18 -29.810 32.213 2.761 133 HZ1 LYS 18 3HZ LYS 18 -31.150 30.713 4.008 134 HZ2 LYS 18 1HZ LYS 18 -32.095 32.091 3.696 135 HZ3 LYS 18 2HZ LYS 18 -31.417 31.856 5.233 136 H PHE 19 HN PHE 19 -23.156 31.660 4.414 137 HA PHE 19 HA PHE 19 -23.458 30.424 1.991 138 HB2 PHE 19 2HB PHE 19 -23.294 32.848 1.132 139 HB3 PHE 19 1HB PHE 19 -21.623 32.814 1.661 140 HD1 PHE 19 1HD PHE 19 -24.055 31.466 -0.722 141 HD2 PHE 19 2HD PHE 19 -19.965 31.594 0.434 142 HE1 PHE 19 1HE PHE 19 -23.420 30.466 -2.878 143 HE2 PHE 19 2HE PHE 19 -19.319 30.596 -1.720 144 HZ PHE 19 HZ PHE 19 -21.049 30.030 -3.380 145 H LEU 20 HN LEU 20 -21.019 29.121 4.163 146 HA LEU 20 HA LEU 20 -22.392 27.479 3.805 147 HB2 LEU 20 2HB LEU 20 -24.253 29.679 2.992 148 HB3 LEU 20 1HB LEU 20 -24.694 27.996 3.051 149 HG LEU 20 HG LEU 20 -23.827 29.680 5.381 150 HD11 LEU 20 1HD1 LEU 20 -26.459 28.362 4.726 151 HD12 LEU 20 2HD1 LEU 20 -26.114 30.089 4.645 152 HD13 LEU 20 3HD1 LEU 20 -26.089 29.259 6.201 153 HD21 LEU 20 3HD2 LEU 20 -22.961 27.391 5.563 154 HD22 LEU 20 1HD2 LEU 20 -24.591 26.763 5.323 155 HD23 LEU 20 2HD2 LEU 20 -24.217 27.714 6.759 156 H GLY 21 HN GLY 21 -21.507 26.223 2.419 157 HA2 GLY 21 2HA GLY 21 -22.540 25.539 0.013 158 HA3 GLY 21 1HA GLY 21 -21.386 26.803 -0.403 159 H THR 22 HN THR 22 -21.213 24.015 -1.184 160 HA THR 22 HA THR 22 -18.526 23.527 -0.227 161 HB THR 22 HB THR 22 -19.865 22.387 1.499 162 HG1 THR 22 1HG THR 22 -18.919 20.243 1.160 163 HG21 THR 22 3HG2 THR 22 -21.230 20.439 0.943 164 HG22 THR 22 1HG2 THR 22 -20.934 20.714 -0.777 165 HG23 THR 22 2HG2 THR 22 -21.854 21.890 0.161 166 H GLU 23 HN GLU 23 -17.313 22.229 -1.575 167 HA GLU 23 HA GLU 23 -18.654 21.152 -3.963 168 HB2 GLU 23 2HB GLU 23 -16.060 22.706 -3.845 169 HB3 GLU 23 1HB GLU 23 -16.574 21.775 -5.248 170 HG2 GLU 23 2HG GLU 23 -18.558 23.161 -5.466 171 HG3 GLU 23 1HG GLU 23 -18.092 24.074 -4.032 172 H ASN 24 HN ASN 24 -18.062 19.114 -4.536 173 HA ASN 24 HA ASN 24 -16.491 17.715 -2.512 174 HB2 ASN 24 2HB ASN 24 -17.591 15.710 -3.260 175 HB3 ASN 24 1HB ASN 24 -18.805 16.968 -3.072 176 HD21 ASN 24 1HD2 ASN 24 -18.919 14.548 -4.663 177 HD22 ASN 24 2HD2 ASN 24 -19.180 15.050 -6.297 178 H ALA 25 HN ALA 25 -15.401 19.232 -4.972 179 HA ALA 25 HA ALA 25 -14.436 17.471 -6.894 180 HB1 ALA 25 1HB ALA 25 -12.794 19.165 -7.438 181 HB2 ALA 25 2HB ALA 25 -13.073 19.961 -5.888 182 HB3 ALA 25 3HB ALA 25 -14.355 19.914 -7.100 183 H GLU 26 HN GLU 26 -12.766 18.574 -3.938 184 HA GLU 26 HA GLU 26 -10.471 16.993 -4.380 185 HB2 GLU 26 2HB GLU 26 -11.552 18.113 -1.792 186 HB3 GLU 26 1HB GLU 26 -9.939 17.445 -2.011 187 HG2 GLU 26 2HG GLU 26 -9.584 19.193 -3.786 188 HG3 GLU 26 1HG GLU 26 -11.091 19.928 -3.241 189 H LEU 27 HN LEU 27 -13.560 16.321 -2.957 190 HA LEU 27 HA LEU 27 -12.770 13.978 -1.550 191 HB2 LEU 27 2HB LEU 27 -15.418 15.149 -2.336 192 HB3 LEU 27 1HB LEU 27 -15.300 13.596 -1.550 193 HG LEU 27 HG LEU 27 -15.788 15.167 0.148 194 HD11 LEU 27 1HD1 LEU 27 -13.826 15.050 1.598 195 HD12 LEU 27 2HD1 LEU 27 -12.831 14.597 0.212 196 HD13 LEU 27 3HD1 LEU 27 -14.112 13.522 0.764 197 HD21 LEU 27 3HD2 LEU 27 -13.495 16.827 -0.892 198 HD22 LEU 27 1HD2 LEU 27 -14.453 17.178 0.546 199 HD23 LEU 27 2HD2 LEU 27 -15.211 17.206 -1.045 200 H VAL 28 HN VAL 28 -14.054 14.676 -4.741 201 HA VAL 28 HA VAL 28 -14.489 11.994 -5.537 202 HB VAL 28 HB VAL 28 -13.764 14.376 -7.264 203 HG11 VAL 28 1HG1 VAL 28 -15.028 11.737 -8.016 204 HG12 VAL 28 2HG1 VAL 28 -13.398 12.265 -8.431 205 HG13 VAL 28 3HG1 VAL 28 -14.794 13.111 -9.098 206 HG21 VAL 28 3HG2 VAL 28 -16.463 13.250 -6.516 207 HG22 VAL 28 1HG2 VAL 28 -16.176 14.558 -7.663 208 HG23 VAL 28 2HG2 VAL 28 -15.780 14.778 -5.960 209 H TYR 29 HN TYR 29 -11.708 14.152 -5.649 210 HA TYR 29 HA TYR 29 -9.957 12.428 -7.053 211 HB2 TYR 29 2HB TYR 29 -9.590 14.873 -6.688 212 HB3 TYR 29 1HB TYR 29 -9.235 14.533 -4.998 213 HD1 TYR 29 2HD TYR 29 -8.054 14.090 -8.460 214 HD2 TYR 29 1HD TYR 29 -7.087 13.700 -4.337 215 HE1 TYR 29 2HE TYR 29 -5.694 13.758 -9.055 216 HE2 TYR 29 1HE TYR 29 -4.719 13.368 -4.919 217 HH TYR 29 HH TYR 29 -3.467 14.062 -7.982 218 H VAL 30 HN VAL 30 -10.989 12.528 -3.750 219 HA VAL 30 HA VAL 30 -8.908 10.955 -2.627 220 HB VAL 30 HB VAL 30 -11.731 11.425 -1.638 221 HG11 VAL 30 1HG1 VAL 30 -10.891 10.683 0.553 222 HG12 VAL 30 2HG1 VAL 30 -9.358 10.237 -0.195 223 HG13 VAL 30 3HG1 VAL 30 -10.838 9.389 -0.645 224 HG21 VAL 30 3HG2 VAL 30 -9.111 12.692 -0.838 225 HG22 VAL 30 1HG2 VAL 30 -10.684 13.021 -0.111 226 HG23 VAL 30 2HG2 VAL 30 -10.380 13.458 -1.793 227 H LEU 31 HN LEU 31 -11.884 10.175 -4.295 228 HA LEU 31 HA LEU 31 -11.779 7.380 -3.470 229 HB2 LEU 31 2HB LEU 31 -13.690 8.805 -5.321 230 HB3 LEU 31 1HB LEU 31 -13.861 7.157 -4.750 231 HG LEU 31 HG LEU 31 -13.954 9.624 -3.009 232 HD11 LEU 31 1HD1 LEU 31 -16.326 9.104 -2.786 233 HD12 LEU 31 2HD1 LEU 31 -16.147 7.768 -3.924 234 HD13 LEU 31 3HD1 LEU 31 -15.901 9.428 -4.466 235 HD21 LEU 31 3HD2 LEU 31 -14.711 8.047 -1.274 236 HD22 LEU 31 1HD2 LEU 31 -13.062 7.719 -1.810 237 HD23 LEU 31 2HD2 LEU 31 -14.392 6.708 -2.376 238 H ARG 32 HN ARG 32 -12.378 5.801 -5.326 239 HA ARG 32 HA ARG 32 -12.154 4.835 -7.367 240 HB2 ARG 32 2HB ARG 32 -10.982 7.470 -8.261 241 HB3 ARG 32 1HB ARG 32 -11.412 6.132 -9.316 242 HG2 ARG 32 2HG ARG 32 -13.752 6.366 -8.676 243 HG3 ARG 32 1HG ARG 32 -13.327 7.695 -7.595 244 HD2 ARG 32 2HD ARG 32 -14.186 8.577 -9.674 245 HD3 ARG 32 1HD ARG 32 -12.470 8.956 -9.531 246 HE ARG 32 HE ARG 32 -13.253 6.587 -11.065 247 HH11 ARG 32 1HH1 ARG 32 -11.941 9.830 -10.995 248 HH12 ARG 32 2HH1 ARG 32 -11.407 9.787 -12.649 249 HH21 ARG 32 1HH2 ARG 32 -12.561 6.524 -13.233 250 HH22 ARG 32 2HH2 ARG 32 -11.771 7.907 -13.923 251 H HIS 33 HN HIS 33 -10.176 4.881 -9.230 252 HA HIS 33 HA HIS 33 -8.033 4.420 -9.781 253 HB2 HIS 33 2HB HIS 33 -7.499 6.268 -8.058 254 HB3 HIS 33 1HB HIS 33 -7.092 4.943 -6.977 255 HD1 HIS 33 1HD HIS 33 -5.468 3.085 -8.664 256 HD2 HIS 33 2HD HIS 33 -5.180 7.221 -9.011 257 HE1 HIS 33 1HE HIS 33 -3.214 3.525 -9.688 258 HE2 HIS 33 2HE HIS 33 -3.159 6.013 -10.094 259 H LYS 34 HN LYS 34 -8.412 2.301 -10.169 260 HA LYS 34 HA LYS 34 -8.380 0.326 -8.055 261 HB2 LYS 34 2HB LYS 34 -8.228 -0.153 -11.035 262 HB3 LYS 34 1HB LYS 34 -8.776 -1.276 -9.800 263 HG2 LYS 34 2HG LYS 34 -10.770 -0.021 -9.439 264 HG3 LYS 34 1HG LYS 34 -10.186 1.297 -10.460 265 HD2 LYS 34 2HD LYS 34 -10.123 -0.345 -12.366 266 HD3 LYS 34 1HD LYS 34 -10.946 -1.495 -11.314 267 HE2 LYS 34 2HE LYS 34 -12.831 0.003 -11.092 268 HE3 LYS 34 1HE LYS 34 -12.003 1.230 -12.049 269 HZ1 LYS 34 3HZ LYS 34 -12.022 -0.333 -13.934 270 HZ2 LYS 34 1HZ LYS 34 -13.588 0.060 -13.414 271 HZ3 LYS 34 2HZ LYS 34 -12.906 -1.440 -13.006 272 H HIS 35 HN HIS 35 -6.919 -1.707 -8.611 273 HA HIS 35 HA HIS 35 -4.522 -1.413 -10.021 274 HB2 HIS 35 2HB HIS 35 -2.925 -1.439 -8.024 275 HB3 HIS 35 1HB HIS 35 -3.640 0.104 -8.468 276 HD1 HIS 35 1HD HIS 35 -4.618 -2.711 -6.076 277 HD2 HIS 35 2HD HIS 35 -4.398 1.434 -6.269 278 HE1 HIS 35 1HE HIS 35 -5.407 -1.888 -3.847 279 HE2 HIS 35 2HE HIS 35 -5.448 0.617 -4.058 280 H GLY 36 HN GLY 36 -6.352 -3.098 -7.543 281 HA2 GLY 36 2HA GLY 36 -6.413 -5.567 -8.200 282 HA3 GLY 36 1HA GLY 36 -4.668 -5.481 -8.019 283 H GLN 37 HN GLN 37 -5.435 -7.344 -6.552 284 HA GLN 37 HA GLN 37 -6.639 -6.599 -4.045 285 HB2 GLN 37 2HB GLN 37 -7.204 -8.744 -4.942 286 HB3 GLN 37 1HB GLN 37 -5.515 -9.198 -5.088 287 HG2 GLN 37 2HG GLN 37 -5.292 -9.314 -2.687 288 HG3 GLN 37 1HG GLN 37 -6.934 -8.712 -2.474 289 HE21 GLN 37 1HE2 GLN 37 -7.444 -10.573 -1.258 290 HE22 GLN 37 2HE2 GLN 37 -7.736 -12.093 -2.035 291 H PHE 38 HN PHE 38 -3.660 -8.517 -4.468 292 HA PHE 38 HA PHE 38 -2.551 -7.169 -2.121 293 HB2 PHE 38 2HB PHE 38 -1.658 -9.650 -3.610 294 HB3 PHE 38 1HB PHE 38 -0.795 -8.962 -2.242 295 HD1 PHE 38 1HD PHE 38 -3.062 -8.261 -0.465 296 HD2 PHE 38 2HD PHE 38 -2.353 -11.720 -2.838 297 HE1 PHE 38 1HE PHE 38 -4.419 -9.599 1.090 298 HE2 PHE 38 2HE PHE 38 -3.704 -13.075 -1.281 299 HZ PHE 38 HZ PHE 38 -4.741 -12.010 0.684 300 H ILE 39 HN ILE 39 -1.638 -5.275 -2.722 301 HA ILE 39 HA ILE 39 0.209 -5.355 -5.019 302 HB ILE 39 HB ILE 39 -1.547 -3.030 -4.207 303 HG12 ILE 39 2HG1 ILE 39 -2.816 -4.822 -5.304 304 HG13 ILE 39 1HG1 ILE 39 -2.690 -3.409 -6.349 305 HG21 ILE 39 1HG2 ILE 39 0.570 -2.250 -5.075 306 HG22 ILE 39 2HG2 ILE 39 -0.699 -1.966 -6.266 307 HG23 ILE 39 3HG2 ILE 39 0.421 -3.312 -6.475 308 HD11 ILE 39 3HD1 ILE 39 -2.400 -5.494 -7.583 309 HD12 ILE 39 1HD1 ILE 39 -1.016 -5.906 -6.568 310 HD13 ILE 39 2HD1 ILE 39 -0.942 -4.502 -7.633 311 H TYR 40 HN TYR 40 2.226 -4.941 -4.507 312 HA TYR 40 HA TYR 40 2.828 -3.262 -2.166 313 HB2 TYR 40 2HB TYR 40 3.758 -5.538 -2.054 314 HB3 TYR 40 1HB TYR 40 4.546 -5.303 -3.608 315 HD1 TYR 40 1HD TYR 40 6.506 -3.837 -3.795 316 HD2 TYR 40 2HD TYR 40 4.675 -4.611 -0.037 317 HE1 TYR 40 1HE TYR 40 8.515 -3.001 -2.651 318 HE2 TYR 40 2HE TYR 40 6.679 -3.782 1.117 319 HH TYR 40 HH TYR 40 9.282 -2.224 -0.607 320 H VAL 41 HN VAL 41 3.643 -1.294 -2.555 321 HA VAL 41 HA VAL 41 4.888 -0.801 -5.178 322 HB VAL 41 HB VAL 41 3.929 1.509 -5.099 323 HG11 VAL 41 1HG1 VAL 41 1.700 0.859 -5.879 324 HG12 VAL 41 2HG1 VAL 41 1.936 -0.751 -5.200 325 HG13 VAL 41 3HG1 VAL 41 2.954 -0.195 -6.529 326 HG21 VAL 41 3HG2 VAL 41 1.966 1.924 -3.690 327 HG22 VAL 41 1HG2 VAL 41 3.412 1.638 -2.719 328 HG23 VAL 41 2HG2 VAL 41 2.205 0.365 -2.900 329 H TRP 42 HN TRP 42 6.653 0.551 -5.206 330 HA TRP 42 HA TRP 42 7.510 1.685 -2.642 331 HB2 TRP 42 2HB TRP 42 9.831 0.929 -3.068 332 HB3 TRP 42 1HB TRP 42 8.716 -0.412 -2.856 333 HD1 TRP 42 1HD TRP 42 7.784 -1.403 -5.429 334 HE1 TRP 42 1HE TRP 42 9.280 -1.971 -7.454 335 HE3 TRP 42 3HE TRP 42 11.903 1.362 -4.186 336 HZ2 TRP 42 2HZ TRP 42 11.869 -1.333 -8.382 337 HZ3 TRP 42 3HZ TRP 42 13.845 1.327 -5.695 338 HH2 TRP 42 2HH TRP 42 13.827 0.007 -7.748 339 H GLY 43 HN GLY 43 6.304 3.297 -4.282 340 HA2 GLY 43 2HA GLY 43 7.948 4.471 -6.306 341 HA3 GLY 43 1HA GLY 43 6.471 5.156 -5.640 342 H GLU 44 HN GLU 44 9.825 5.379 -5.773 343 HA GLU 44 HA GLU 44 10.462 6.469 -3.272 344 HB2 GLU 44 2HB GLU 44 12.467 7.371 -4.388 345 HB3 GLU 44 1HB GLU 44 12.181 5.683 -4.790 346 HG2 GLU 44 2HG GLU 44 11.407 6.227 -6.949 347 HG3 GLU 44 1HG GLU 44 11.290 7.942 -6.556 348 H GLU 45 HN GLU 45 10.570 8.506 -2.483 349 HA GLU 45 HA GLU 45 10.255 10.888 -3.922 350 HB2 GLU 45 2HB GLU 45 7.925 10.123 -4.208 351 HB3 GLU 45 1HB GLU 45 7.757 9.991 -2.461 352 HG2 GLU 45 2HG GLU 45 8.009 12.357 -2.198 353 HG3 GLU 45 1HG GLU 45 8.392 12.549 -3.909 354 H GLY 46 HN GLY 46 9.726 9.175 -0.905 355 HA2 GLY 46 2HA GLY 46 11.659 10.357 0.588 356 HA3 GLY 46 1HA GLY 46 10.298 11.459 0.742 357 H ALA 47 HN ALA 47 8.613 10.943 2.041 358 HA ALA 47 HA ALA 47 8.493 8.244 3.165 359 HB1 ALA 47 1HB ALA 47 8.629 10.733 4.871 360 HB2 ALA 47 2HB ALA 47 9.884 9.502 4.729 361 HB3 ALA 47 3HB ALA 47 8.331 9.095 5.456 362 H GLY 48 HN GLY 48 6.532 7.755 2.339 363 HA2 GLY 48 2HA GLY 48 4.215 7.649 2.663 364 HA3 GLY 48 1HA GLY 48 4.272 9.226 3.432 365 H LYS 49 HN LYS 49 3.171 7.632 0.831 366 HA LYS 49 HA LYS 49 2.796 10.159 -0.619 367 HB2 LYS 49 2HB LYS 49 4.523 8.659 -1.752 368 HB3 LYS 49 1HB LYS 49 3.229 7.500 -2.009 369 HG2 LYS 49 2HG LYS 49 2.058 9.042 -3.431 370 HG3 LYS 49 1HG LYS 49 3.219 10.322 -3.066 371 HD2 LYS 49 2HD LYS 49 5.002 8.975 -4.095 372 HD3 LYS 49 1HD LYS 49 3.823 7.723 -4.480 373 HE2 LYS 49 2HE LYS 49 4.291 9.114 -6.426 374 HE3 LYS 49 1HE LYS 49 2.614 9.293 -5.910 375 HZ1 LYS 49 3HZ LYS 49 3.679 11.420 -6.483 376 HZ2 LYS 49 1HZ LYS 49 4.806 11.193 -5.237 377 HZ3 LYS 49 2HZ LYS 49 3.160 11.382 -4.874 378 H SER 50 HN SER 50 1.746 6.864 -1.335 379 HA SER 50 HA SER 50 -0.109 5.681 -0.902 380 HB2 SER 50 2HB SER 50 -0.464 7.679 1.325 381 HB3 SER 50 1HB SER 50 -1.259 6.108 1.211 382 HG SER 50 HG SER 50 1.015 6.571 2.342 383 H HIS 51 HN HIS 51 -0.528 8.653 -2.313 384 HA HIS 51 HA HIS 51 -3.283 9.030 -1.864 385 HB2 HIS 51 2HB HIS 51 -3.363 10.484 -3.798 386 HB3 HIS 51 1HB HIS 51 -1.949 10.831 -2.820 387 HD1 HIS 51 1HD HIS 51 0.150 11.101 -4.060 388 HD2 HIS 51 2HD HIS 51 -2.653 8.916 -6.229 389 HE1 HIS 51 1HE HIS 51 1.165 10.758 -6.336 390 HE2 HIS 51 2HE HIS 51 -0.628 9.620 -7.690 391 H LEU 52 HN LEU 52 -1.613 6.918 -4.116 392 HA LEU 52 HA LEU 52 -4.032 6.193 -5.478 393 HB2 LEU 52 2HB LEU 52 -2.737 4.525 -6.615 394 HB3 LEU 52 1HB LEU 52 -1.839 6.025 -6.574 395 HG LEU 52 HG LEU 52 -0.814 4.772 -4.393 396 HD11 LEU 52 1HD1 LEU 52 -1.419 2.618 -6.411 397 HD12 LEU 52 2HD1 LEU 52 -2.089 2.739 -4.786 398 HD13 LEU 52 3HD1 LEU 52 -0.365 2.448 -5.008 399 HD21 LEU 52 3HD2 LEU 52 1.103 4.229 -5.833 400 HD22 LEU 52 1HD2 LEU 52 0.475 5.849 -6.136 401 HD23 LEU 52 2HD2 LEU 52 0.104 4.535 -7.254 402 H LEU 53 HN LEU 53 -2.372 5.151 -2.620 403 HA LEU 53 HA LEU 53 -3.790 2.683 -2.288 404 HB2 LEU 53 2HB LEU 53 -2.148 4.383 -0.419 405 HB3 LEU 53 1HB LEU 53 -3.017 2.973 0.150 406 HG LEU 53 HG LEU 53 -1.699 1.631 -1.565 407 HD11 LEU 53 1HD1 LEU 53 -0.968 3.586 -2.910 408 HD12 LEU 53 2HD1 LEU 53 0.357 2.543 -2.396 409 HD13 LEU 53 3HD1 LEU 53 0.067 4.071 -1.568 410 HD21 LEU 53 3HD2 LEU 53 0.259 1.484 -0.110 411 HD22 LEU 53 1HD2 LEU 53 -1.232 1.574 0.828 412 HD23 LEU 53 2HD2 LEU 53 -0.201 2.997 0.669 413 H GLN 54 HN GLN 54 -4.113 5.964 -0.983 414 HA GLN 54 HA GLN 54 -6.176 5.401 0.850 415 HB2 GLN 54 2HB GLN 54 -6.440 7.781 1.064 416 HB3 GLN 54 1HB GLN 54 -4.727 7.434 0.898 417 HG2 GLN 54 2HG GLN 54 -4.781 8.102 -1.423 418 HG3 GLN 54 1HG GLN 54 -6.519 8.365 -1.327 419 HE21 GLN 54 1HE2 GLN 54 -6.381 10.483 -1.920 420 HE22 GLN 54 2HE2 GLN 54 -5.734 11.715 -0.889 421 H ALA 55 HN ALA 55 -6.216 6.474 -2.490 422 HA ALA 55 HA ALA 55 -8.920 7.054 -2.775 423 HB1 ALA 55 1HB ALA 55 -8.566 6.705 -5.170 424 HB2 ALA 55 2HB ALA 55 -7.033 5.899 -4.829 425 HB3 ALA 55 3HB ALA 55 -7.234 7.610 -4.450 426 H TRP 56 HN TRP 56 -7.183 4.045 -3.032 427 HA TRP 56 HA TRP 56 -9.370 2.438 -3.862 428 HB2 TRP 56 2HB TRP 56 -7.123 1.750 -4.308 429 HB3 TRP 56 1HB TRP 56 -6.693 1.843 -2.610 430 HD1 TRP 56 1HD TRP 56 -9.070 -0.270 -4.847 431 HE1 TRP 56 1HE TRP 56 -9.050 -2.678 -3.929 432 HE3 TRP 56 3HE TRP 56 -6.052 0.449 -0.787 433 HZ2 TRP 56 2HZ TRP 56 -7.891 -4.072 -1.764 434 HZ3 TRP 56 3HZ TRP 56 -5.534 -1.474 0.654 435 HH2 TRP 56 2HH TRP 56 -6.435 -3.687 0.176 436 H VAL 57 HN VAL 57 -7.885 3.162 -0.747 437 HA VAL 57 HA VAL 57 -9.435 1.442 0.854 438 HB VAL 57 HB VAL 57 -8.066 4.052 1.549 439 HG11 VAL 57 1HG1 VAL 57 -9.187 1.951 3.402 440 HG12 VAL 57 2HG1 VAL 57 -9.828 3.577 3.169 441 HG13 VAL 57 3HG1 VAL 57 -8.232 3.353 3.887 442 HG21 VAL 57 3HG2 VAL 57 -6.345 2.594 2.522 443 HG22 VAL 57 1HG2 VAL 57 -6.539 2.315 0.791 444 HG23 VAL 57 2HG2 VAL 57 -7.229 1.179 1.951 445 H ALA 58 HN ALA 58 -9.833 4.901 0.102 446 HA ALA 58 HA ALA 58 -12.171 5.262 1.644 447 HB1 ALA 58 1HB ALA 58 -12.413 7.368 0.429 448 HB2 ALA 58 2HB ALA 58 -11.189 6.844 -0.729 449 HB3 ALA 58 3HB ALA 58 -10.750 7.115 0.957 450 H GLN 59 HN GLN 59 -11.669 4.358 -1.736 451 HA GLN 59 HA GLN 59 -14.352 4.541 -2.563 452 HB2 GLN 59 2HB GLN 59 -12.366 4.273 -4.072 453 HB3 GLN 59 1HB GLN 59 -12.284 2.588 -3.580 454 HG2 GLN 59 2HG GLN 59 -14.580 2.269 -4.448 455 HG3 GLN 59 1HG GLN 59 -14.550 3.931 -5.032 456 HE21 GLN 59 1HE2 GLN 59 -14.772 3.361 -7.173 457 HE22 GLN 59 2HE2 GLN 59 -13.503 2.588 -8.065 458 H ALA 60 HN ALA 60 -12.513 1.946 -1.050 459 HA ALA 60 HA ALA 60 -14.571 -0.003 -1.174 460 HB1 ALA 60 1HB ALA 60 -12.216 -0.597 -0.837 461 HB2 ALA 60 2HB ALA 60 -13.240 -1.244 0.444 462 HB3 ALA 60 3HB ALA 60 -12.249 0.184 0.745 463 H LEU 61 HN LEU 61 -13.691 2.474 1.151 464 HA LEU 61 HA LEU 61 -15.349 1.713 3.270 465 HB2 LEU 61 2HB LEU 61 -14.348 4.404 2.368 466 HB3 LEU 61 1HB LEU 61 -15.288 4.194 3.830 467 HG LEU 61 HG LEU 61 -12.615 2.896 3.289 468 HD11 LEU 61 1HD1 LEU 61 -12.414 5.306 3.583 469 HD12 LEU 61 2HD1 LEU 61 -11.764 4.448 4.979 470 HD13 LEU 61 3HD1 LEU 61 -13.350 5.214 5.076 471 HD21 LEU 61 3HD2 LEU 61 -14.341 2.946 5.760 472 HD22 LEU 61 1HD2 LEU 61 -12.713 2.276 5.658 473 HD23 LEU 61 2HD2 LEU 61 -14.027 1.547 4.734 474 H GLU 62 HN GLU 62 -16.013 3.943 0.561 475 HA GLU 62 HA GLU 62 -18.727 4.329 1.409 476 HB2 GLU 62 2HB GLU 62 -17.349 5.088 -1.163 477 HB3 GLU 62 1HB GLU 62 -18.988 5.564 -0.724 478 HG2 GLU 62 2HG GLU 62 -18.007 6.603 1.344 479 HG3 GLU 62 1HG GLU 62 -16.425 6.316 0.625 480 H ALA 63 HN ALA 63 -17.153 1.886 -0.210 481 HA ALA 63 HA ALA 63 -19.478 0.944 -1.670 482 HB1 ALA 63 1HB ALA 63 -18.100 -0.976 -2.247 483 HB2 ALA 63 2HB ALA 63 -16.860 -0.448 -1.111 484 HB3 ALA 63 3HB ALA 63 -17.216 0.522 -2.539 485 H GLY 64 HN GLY 64 -18.580 1.045 1.495 486 HA2 GLY 64 2HA GLY 64 -19.811 0.200 3.287 487 HA3 GLY 64 1HA GLY 64 -20.579 -0.942 2.193 488 H LYS 65 HN LYS 65 -17.129 -0.651 2.199 489 HA LYS 65 HA LYS 65 -16.945 -3.282 3.500 490 HB2 LYS 65 2HB LYS 65 -14.863 -2.012 1.714 491 HB3 LYS 65 1HB LYS 65 -14.964 -3.689 2.225 492 HG2 LYS 65 2HG LYS 65 -16.894 -2.309 0.376 493 HG3 LYS 65 1HG LYS 65 -15.594 -3.397 -0.112 494 HD2 LYS 65 2HD LYS 65 -16.635 -5.233 1.064 495 HD3 LYS 65 1HD LYS 65 -17.880 -4.158 1.703 496 HE2 LYS 65 2HE LYS 65 -18.668 -3.718 -0.566 497 HE3 LYS 65 1HE LYS 65 -17.422 -4.785 -1.210 498 HZ1 LYS 65 3HZ LYS 65 -19.624 -5.596 0.611 499 HZ2 LYS 65 1HZ LYS 65 -18.428 -6.626 -0.012 500 HZ3 LYS 65 2HZ LYS 65 -19.554 -5.902 -1.056 501 H ASN 66 HN ASN 66 -15.046 -3.603 4.867 502 HA ASN 66 HA ASN 66 -14.379 -1.179 6.339 503 HB2 ASN 66 2HB ASN 66 -14.906 -3.425 7.452 504 HB3 ASN 66 1HB ASN 66 -13.316 -3.944 6.907 505 HD21 ASN 66 1HD2 ASN 66 -12.938 -4.210 9.219 506 HD22 ASN 66 2HD2 ASN 66 -12.429 -2.836 10.146 507 H ALA 67 HN ALA 67 -12.480 -0.161 6.281 508 HA ALA 67 HA ALA 67 -10.182 -1.285 4.961 509 HB1 ALA 67 1HB ALA 67 -11.656 1.005 3.654 510 HB2 ALA 67 2HB ALA 67 -11.558 -0.644 3.036 511 HB3 ALA 67 3HB ALA 67 -10.102 0.347 3.142 512 H ALA 68 HN ALA 68 -8.331 -0.228 5.484 513 HA ALA 68 HA ALA 68 -8.395 2.464 6.539 514 HB1 ALA 68 1HB ALA 68 -7.532 0.181 8.310 515 HB2 ALA 68 2HB ALA 68 -8.992 1.150 8.517 516 HB3 ALA 68 3HB ALA 68 -7.403 1.897 8.694 517 H TYR 69 HN TYR 69 -6.459 3.494 6.288 518 HA TYR 69 HA TYR 69 -4.170 1.817 5.550 519 HB2 TYR 69 2HB TYR 69 -3.354 3.585 4.110 520 HB3 TYR 69 1HB TYR 69 -4.985 3.148 3.631 521 HD1 TYR 69 2HD TYR 69 -6.859 4.710 4.056 522 HD2 TYR 69 1HD TYR 69 -2.832 5.780 4.925 523 HE1 TYR 69 2HE TYR 69 -7.513 7.081 4.153 524 HE2 TYR 69 1HE TYR 69 -3.476 8.147 5.024 525 HH TYR 69 HH TYR 69 -5.209 9.614 4.187 526 H ILE 70 HN ILE 70 -2.343 2.095 6.658 527 HA ILE 70 HA ILE 70 -2.342 4.180 8.741 528 HB ILE 70 HB ILE 70 -1.332 1.338 8.964 529 HG12 ILE 70 2HG1 ILE 70 -3.582 2.777 10.392 530 HG13 ILE 70 1HG1 ILE 70 -3.781 1.574 9.121 531 HG21 ILE 70 1HG2 ILE 70 0.143 2.860 10.152 532 HG22 ILE 70 2HG2 ILE 70 -0.800 1.902 11.294 533 HG23 ILE 70 3HG2 ILE 70 -1.238 3.581 10.978 534 HD11 ILE 70 3HD1 ILE 70 -4.178 0.621 11.319 535 HD12 ILE 70 1HD1 ILE 70 -2.557 1.093 11.829 536 HD13 ILE 70 2HD1 ILE 70 -2.766 -0.112 10.559 537 H ASP 71 HN ASP 71 -0.645 5.487 8.760 538 HA ASP 71 HA ASP 71 1.651 4.920 7.049 539 HB2 ASP 71 2HB ASP 71 1.315 7.384 8.751 540 HB3 ASP 71 1HB ASP 71 2.225 7.204 7.258 541 H ALA 72 HN ALA 72 3.211 3.731 8.001 542 HA ALA 72 HA ALA 72 3.258 3.149 10.736 543 HB1 ALA 72 1HB ALA 72 5.346 2.001 10.321 544 HB2 ALA 72 2HB ALA 72 5.517 2.835 8.776 545 HB3 ALA 72 3HB ALA 72 4.199 1.688 9.017 546 H ALA 73 HN ALA 73 4.495 5.905 9.147 547 HA ALA 73 HA ALA 73 6.359 6.466 11.330 548 HB1 ALA 73 1HB ALA 73 5.938 7.969 8.751 549 HB2 ALA 73 2HB ALA 73 7.202 6.776 9.059 550 HB3 ALA 73 3HB ALA 73 7.186 8.294 9.955 551 H SER 74 HN SER 74 3.169 6.954 10.714 552 HA SER 74 HA SER 74 3.136 9.444 12.301 553 HB2 SER 74 2HB SER 74 2.508 9.880 9.945 554 HB3 SER 74 1HB SER 74 1.219 8.685 10.078 555 HG SER 74 HG SER 74 1.250 10.733 11.976 556 H MET 75 HN MET 75 1.781 6.329 11.628 557 HA MET 75 HA MET 75 0.248 6.425 14.125 558 HB2 MET 75 2HB MET 75 -0.736 5.471 11.426 559 HB3 MET 75 1HB MET 75 -1.533 5.064 12.935 560 HG2 MET 75 2HG MET 75 -1.804 7.512 13.357 561 HG3 MET 75 1HG MET 75 -1.183 7.797 11.736 562 HE1 MET 75 3HE MET 75 -3.920 6.306 9.442 563 HE2 MET 75 1HE MET 75 -2.432 5.523 9.974 564 HE3 MET 75 2HE MET 75 -2.422 7.232 9.536 565 HA PRO 76 HA PRO 76 2.152 2.392 14.511 566 HB2 PRO 76 2HB PRO 76 0.926 1.562 16.745 567 HB3 PRO 76 1HB PRO 76 2.128 2.855 16.778 568 HG2 PRO 76 2HG PRO 76 -0.849 3.030 16.891 569 HG3 PRO 76 1HG PRO 76 0.366 3.987 17.757 570 HD2 PRO 76 2HD PRO 76 -0.983 4.808 15.475 571 HD3 PRO 76 1HD PRO 76 0.554 5.484 16.051 572 H LEU 77 HN LEU 77 1.527 0.117 14.470 573 HA LEU 77 HA LEU 77 -0.955 -0.294 13.025 574 HB2 LEU 77 2HB LEU 77 1.175 -1.366 12.301 575 HB3 LEU 77 1HB LEU 77 1.174 -2.302 13.784 576 HG LEU 77 HG LEU 77 -0.913 -3.402 13.093 577 HD11 LEU 77 1HD1 LEU 77 -0.587 -1.806 10.555 578 HD12 LEU 77 2HD1 LEU 77 -1.870 -1.614 11.750 579 HD13 LEU 77 3HD1 LEU 77 -1.756 -3.103 10.812 580 HD21 LEU 77 3HD2 LEU 77 1.240 -3.516 10.987 581 HD22 LEU 77 1HD2 LEU 77 0.027 -4.755 11.309 582 HD23 LEU 77 2HD2 LEU 77 1.256 -4.389 12.520 583 H THR 78 HN THR 78 -2.638 -1.623 13.726 584 HA THR 78 HA THR 78 -2.655 -2.184 16.604 585 HB THR 78 HB THR 78 -5.107 -1.610 16.525 586 HG1 THR 78 1HG THR 78 -5.503 -0.087 14.624 587 HG21 THR 78 3HG2 THR 78 -4.765 0.815 16.586 588 HG22 THR 78 1HG2 THR 78 -3.201 0.622 15.798 589 HG23 THR 78 2HG2 THR 78 -3.456 -0.026 17.417 590 H ASP 79 HN ASP 79 -4.209 -3.825 17.248 591 HA ASP 79 HA ASP 79 -4.232 -6.070 15.482 592 HB2 ASP 79 2HB ASP 79 -5.405 -7.233 17.297 593 HB3 ASP 79 1HB ASP 79 -3.984 -6.394 17.898 594 H ALA 80 HN ALA 80 -6.312 -3.449 16.135 595 HA ALA 80 HA ALA 80 -8.809 -4.465 15.375 596 HB1 ALA 80 1HB ALA 80 -8.488 -2.280 16.448 597 HB2 ALA 80 2HB ALA 80 -9.441 -2.155 14.968 598 HB3 ALA 80 3HB ALA 80 -7.745 -1.673 14.970 599 H ALA 81 HN ALA 81 -6.003 -3.671 13.533 600 HA ALA 81 HA ALA 81 -7.129 -3.182 11.015 601 HB1 ALA 81 1HB ALA 81 -4.926 -3.721 10.109 602 HB2 ALA 81 2HB ALA 81 -4.454 -4.417 11.658 603 HB3 ALA 81 3HB ALA 81 -4.797 -2.691 11.533 604 H PHE 82 HN PHE 82 -6.900 -6.109 12.793 605 HA PHE 82 HA PHE 82 -6.916 -7.981 10.681 606 HB2 PHE 82 2HB PHE 82 -7.646 -8.031 13.564 607 HB3 PHE 82 1HB PHE 82 -8.277 -9.326 12.550 608 HD1 PHE 82 1HD PHE 82 -6.759 -10.833 11.388 609 HD2 PHE 82 2HD PHE 82 -5.336 -7.920 14.138 610 HE1 PHE 82 1HE PHE 82 -4.623 -12.034 11.544 611 HE2 PHE 82 2HE PHE 82 -3.195 -9.117 14.300 612 HZ PHE 82 HZ PHE 82 -2.841 -11.177 13.001 613 H GLU 83 HN GLU 83 -9.377 -5.943 11.999 614 HA GLU 83 HA GLU 83 -11.588 -7.465 10.975 615 HB2 GLU 83 2HB GLU 83 -11.508 -4.608 11.918 616 HB3 GLU 83 1HB GLU 83 -12.932 -5.610 11.734 617 HG2 GLU 83 2HG GLU 83 -12.191 -7.054 13.521 618 HG3 GLU 83 1HG GLU 83 -10.697 -6.132 13.672 619 H ALA 84 HN ALA 84 -9.467 -5.040 9.827 620 HA ALA 84 HA ALA 84 -11.185 -3.924 7.835 621 HB1 ALA 84 1HB ALA 84 -9.316 -2.653 8.771 622 HB2 ALA 84 2HB ALA 84 -9.182 -2.800 7.020 623 HB3 ALA 84 3HB ALA 84 -8.177 -3.802 8.067 624 H GLU 85 HN GLU 85 -11.793 -4.890 6.042 625 HA GLU 85 HA GLU 85 -10.502 -7.261 5.090 626 HB2 GLU 85 2HB GLU 85 -13.022 -6.196 4.826 627 HB3 GLU 85 1HB GLU 85 -12.329 -5.908 3.233 628 HG2 GLU 85 2HG GLU 85 -13.511 -8.024 3.286 629 HG3 GLU 85 1HG GLU 85 -11.783 -8.274 3.030 630 H TYR 86 HN TYR 86 -10.525 -3.869 4.244 631 HA TYR 86 HA TYR 86 -8.449 -4.373 2.213 632 HB2 TYR 86 2HB TYR 86 -10.303 -1.992 2.556 633 HB3 TYR 86 1HB TYR 86 -9.026 -2.103 1.353 634 HD1 TYR 86 1HD TYR 86 -12.053 -4.017 2.474 635 HD2 TYR 86 2HD TYR 86 -9.602 -2.775 -0.770 636 HE1 TYR 86 1HE TYR 86 -13.628 -5.052 0.894 637 HE2 TYR 86 2HE TYR 86 -11.169 -3.802 -2.359 638 HH TYR 86 HH TYR 86 -12.873 -5.455 -2.456 639 H LEU 87 HN LEU 87 -6.551 -4.260 3.305 640 HA LEU 87 HA LEU 87 -6.233 -2.091 5.276 641 HB2 LEU 87 2HB LEU 87 -6.291 -4.587 5.990 642 HB3 LEU 87 1HB LEU 87 -4.686 -4.663 5.301 643 HG LEU 87 HG LEU 87 -4.837 -4.345 7.808 644 HD11 LEU 87 1HD1 LEU 87 -3.306 -2.301 6.218 645 HD12 LEU 87 2HD1 LEU 87 -2.777 -3.940 6.596 646 HD13 LEU 87 3HD1 LEU 87 -2.985 -2.760 7.890 647 HD21 LEU 87 3HD2 LEU 87 -5.219 -2.075 8.622 648 HD22 LEU 87 1HD2 LEU 87 -6.656 -2.721 7.830 649 HD23 LEU 87 2HD2 LEU 87 -5.634 -1.556 6.988 650 H ALA 88 HN ALA 88 -4.629 -0.678 4.946 651 HA ALA 88 HA ALA 88 -2.468 -1.404 3.079 652 HB1 ALA 88 1HB ALA 88 -2.540 0.820 2.114 653 HB2 ALA 88 2HB ALA 88 -3.867 1.265 3.189 654 HB3 ALA 88 3HB ALA 88 -4.110 0.036 1.947 655 H VAL 89 HN VAL 89 -0.445 -0.852 3.723 656 HA VAL 89 HA VAL 89 -0.171 1.017 5.979 657 HB VAL 89 HB VAL 89 1.355 -1.589 5.753 658 HG11 VAL 89 1HG1 VAL 89 1.424 0.539 7.886 659 HG12 VAL 89 2HG1 VAL 89 2.700 0.186 6.720 660 HG13 VAL 89 3HG1 VAL 89 2.268 -1.008 7.943 661 HG21 VAL 89 3HG2 VAL 89 0.175 -2.220 7.828 662 HG22 VAL 89 1HG2 VAL 89 -0.917 -2.014 6.458 663 HG23 VAL 89 2HG2 VAL 89 -0.802 -0.758 7.690 664 H ASP 90 HN ASP 90 1.395 2.475 5.741 665 HA ASP 90 HA ASP 90 3.200 2.204 3.430 666 HB2 ASP 90 2HB ASP 90 1.857 4.158 3.201 667 HB3 ASP 90 1HB ASP 90 2.117 4.620 4.879 668 H GLN 91 HN GLN 91 5.359 2.264 3.691 669 HA GLN 91 HA GLN 91 7.410 2.212 4.664 670 HB2 GLN 91 2HB GLN 91 6.010 4.014 6.636 671 HB3 GLN 91 1HB GLN 91 7.715 3.603 6.782 672 HG2 GLN 91 2HG GLN 91 8.232 4.663 4.720 673 HG3 GLN 91 1HG GLN 91 6.525 4.852 4.319 674 HE21 GLN 91 1HE2 GLN 91 5.355 6.503 5.216 675 HE22 GLN 91 2HE2 GLN 91 6.099 7.793 6.109 676 H VAL 92 HN VAL 92 5.841 0.042 5.011 677 HA VAL 92 HA VAL 92 5.232 -0.881 7.551 678 HB VAL 92 HB VAL 92 6.186 -2.607 5.269 679 HG11 VAL 92 1HG1 VAL 92 4.661 -4.271 6.197 680 HG12 VAL 92 2HG1 VAL 92 4.248 -3.166 7.507 681 HG13 VAL 92 3HG1 VAL 92 5.889 -3.800 7.371 682 HG21 VAL 92 3HG2 VAL 92 4.541 -1.074 4.400 683 HG22 VAL 92 1HG2 VAL 92 3.454 -1.430 5.743 684 HG23 VAL 92 2HG2 VAL 92 3.825 -2.678 4.555 685 H GLU 93 HN GLU 93 8.350 -0.848 5.948 686 HA GLU 93 HA GLU 93 9.688 -2.787 7.431 687 HB2 GLU 93 2HB GLU 93 10.766 -1.874 5.516 688 HB3 GLU 93 1HB GLU 93 10.673 -0.239 6.158 689 HG2 GLU 93 2HG GLU 93 12.208 -0.895 7.970 690 HG3 GLU 93 1HG GLU 93 12.353 -2.487 7.236 691 H LYS 94 HN LYS 94 8.773 0.460 8.311 692 HA LYS 94 HA LYS 94 10.721 0.587 10.443 693 HB2 LYS 94 2HB LYS 94 9.183 2.471 8.935 694 HB3 LYS 94 1HB LYS 94 8.910 2.744 10.652 695 HG2 LYS 94 2HG LYS 94 10.752 4.093 9.881 696 HG3 LYS 94 1HG LYS 94 11.331 2.869 11.008 697 HD2 LYS 94 2HD LYS 94 12.906 2.904 9.261 698 HD3 LYS 94 1HD LYS 94 11.916 1.475 8.969 699 HE2 LYS 94 2HE LYS 94 10.704 2.577 7.237 700 HE3 LYS 94 1HE LYS 94 11.425 4.135 7.642 701 HZ1 LYS 94 3HZ LYS 94 13.609 3.153 7.022 702 HZ2 LYS 94 1HZ LYS 94 12.527 3.292 5.721 703 HZ3 LYS 94 2HZ LYS 94 12.796 1.778 6.446 704 H LEU 95 HN LEU 95 8.209 -1.267 10.398 705 HA LEU 95 HA LEU 95 7.008 -0.587 12.927 706 HB2 LEU 95 2HB LEU 95 6.989 -3.180 11.377 707 HB3 LEU 95 1HB LEU 95 6.001 -2.832 12.780 708 HG LEU 95 HG LEU 95 5.844 -1.428 10.114 709 HD11 LEU 95 1HD1 LEU 95 3.991 -3.389 11.452 710 HD12 LEU 95 2HD1 LEU 95 4.938 -3.653 9.988 711 HD13 LEU 95 3HD1 LEU 95 3.622 -2.480 9.986 712 HD21 LEU 95 3HD2 LEU 95 4.171 -1.061 12.596 713 HD22 LEU 95 1HD2 LEU 95 3.886 -0.296 11.032 714 HD23 LEU 95 2HD2 LEU 95 5.340 0.091 11.952 715 H GLY 96 HN GLY 96 7.503 -1.443 14.952 716 HA2 GLY 96 2HA GLY 96 10.284 -2.364 15.097 717 HA3 GLY 96 1HA GLY 96 9.385 -1.599 16.392 718 H ASN 97 HN ASN 97 9.365 -4.568 14.429 719 HA ASN 97 HA ASN 97 9.338 -6.766 15.001 720 HB2 ASN 97 2HB ASN 97 10.965 -6.268 16.731 721 HB3 ASN 97 1HB ASN 97 9.696 -5.728 17.822 722 HD21 ASN 97 1HD2 ASN 97 10.156 -7.175 19.409 723 HD22 ASN 97 2HD2 ASN 97 9.887 -8.880 19.259 724 H GLU 98 HN GLU 98 7.502 -5.031 17.530 725 HA GLU 98 HA GLU 98 5.624 -7.100 17.927 726 HB2 GLU 98 2HB GLU 98 5.350 -4.147 18.501 727 HB3 GLU 98 1HB GLU 98 4.358 -5.428 19.189 728 HG2 GLU 98 2HG GLU 98 6.204 -6.316 20.395 729 HG3 GLU 98 1HG GLU 98 7.334 -5.249 19.560 730 H GLU 99 HN GLU 99 5.275 -3.979 16.231 731 HA GLU 99 HA GLU 99 2.729 -4.605 15.146 732 HB2 GLU 99 2HB GLU 99 4.648 -2.722 13.800 733 HB3 GLU 99 1HB GLU 99 2.896 -2.628 13.891 734 HG2 GLU 99 2HG GLU 99 3.466 -0.975 15.347 735 HG3 GLU 99 1HG GLU 99 3.376 -2.342 16.459 736 H GLN 100 HN GLN 100 5.989 -5.286 14.178 737 HA GLN 100 HA GLN 100 5.470 -5.912 11.462 738 HB2 GLN 100 2HB GLN 100 7.736 -5.447 12.607 739 HB3 GLN 100 1HB GLN 100 7.682 -7.134 13.097 740 HG2 GLN 100 2HG GLN 100 9.004 -6.895 11.104 741 HG3 GLN 100 1HG GLN 100 7.530 -7.797 10.740 742 HE21 GLN 100 1HE2 GLN 100 9.240 -4.798 10.338 743 HE22 GLN 100 2HE2 GLN 100 8.245 -4.169 9.064 744 H ALA 101 HN ALA 101 5.644 -7.849 14.429 745 HA ALA 101 HA ALA 101 5.071 -10.344 13.212 746 HB1 ALA 101 1HB ALA 101 4.539 -9.461 16.049 747 HB2 ALA 101 2HB ALA 101 6.045 -10.164 15.454 748 HB3 ALA 101 3HB ALA 101 4.566 -11.125 15.468 749 H LEU 102 HN LEU 102 3.086 -7.735 14.428 750 HA LEU 102 HA LEU 102 0.573 -9.017 14.217 751 HB2 LEU 102 2HB LEU 102 1.269 -6.752 15.312 752 HB3 LEU 102 1HB LEU 102 0.997 -6.088 13.717 753 HG LEU 102 HG LEU 102 -0.912 -5.784 15.255 754 HD11 LEU 102 1HD1 LEU 102 -1.516 -7.553 12.893 755 HD12 LEU 102 2HD1 LEU 102 -1.302 -5.803 12.850 756 HD13 LEU 102 3HD1 LEU 102 -2.665 -6.505 13.723 757 HD21 LEU 102 3HD2 LEU 102 -2.304 -7.699 15.847 758 HD22 LEU 102 1HD2 LEU 102 -0.686 -7.842 16.535 759 HD23 LEU 102 2HD2 LEU 102 -1.126 -8.786 15.112 760 H LEU 103 HN LEU 103 2.355 -6.888 12.005 761 HA LEU 103 HA LEU 103 0.666 -6.977 9.801 762 HB2 LEU 103 2HB LEU 103 2.702 -5.541 10.131 763 HB3 LEU 103 1HB LEU 103 3.687 -6.935 9.751 764 HG LEU 103 HG LEU 103 3.335 -5.222 7.907 765 HD11 LEU 103 1HD1 LEU 103 4.244 -7.416 7.434 766 HD12 LEU 103 2HD1 LEU 103 3.151 -6.912 6.146 767 HD13 LEU 103 3HD1 LEU 103 2.618 -8.093 7.343 768 HD21 LEU 103 3HD2 LEU 103 0.615 -6.516 7.799 769 HD22 LEU 103 1HD2 LEU 103 1.279 -5.406 6.602 770 HD23 LEU 103 2HD2 LEU 103 0.952 -4.842 8.240 771 H PHE 104 HN PHE 104 3.313 -9.166 10.686 772 HA PHE 104 HA PHE 104 3.206 -10.944 8.560 773 HB2 PHE 104 2HB PHE 104 4.926 -11.002 10.322 774 HB3 PHE 104 1HB PHE 104 3.728 -11.568 11.476 775 HD1 PHE 104 1HD PHE 104 5.207 -12.491 8.180 776 HD2 PHE 104 2HD PHE 104 3.525 -13.829 11.850 777 HE1 PHE 104 1HE PHE 104 5.717 -14.819 7.565 778 HE2 PHE 104 2HE PHE 104 4.035 -16.155 11.245 779 HZ PHE 104 HZ PHE 104 5.134 -16.654 9.102 780 H SER 105 HN SER 105 1.284 -10.874 11.520 781 HA SER 105 HA SER 105 -0.168 -13.260 10.999 782 HB2 SER 105 2HB SER 105 0.145 -12.054 13.233 783 HB3 SER 105 1HB SER 105 -1.131 -10.963 12.703 784 HG SER 105 HG SER 105 -1.271 -13.710 13.315 785 H ILE 106 HN ILE 106 -0.643 -9.881 10.194 786 HA ILE 106 HA ILE 106 -3.249 -10.075 9.146 787 HB ILE 106 HB ILE 106 -0.990 -8.256 8.282 788 HG12 ILE 106 2HG1 ILE 106 -3.317 -7.796 10.162 789 HG13 ILE 106 1HG1 ILE 106 -1.639 -8.007 10.640 790 HG21 ILE 106 1HG2 ILE 106 -3.942 -8.068 7.685 791 HG22 ILE 106 2HG2 ILE 106 -2.655 -8.401 6.525 792 HG23 ILE 106 3HG2 ILE 106 -2.742 -6.830 7.317 793 HD11 ILE 106 3HD1 ILE 106 -2.280 -5.671 10.692 794 HD12 ILE 106 1HD1 ILE 106 -2.716 -5.743 8.985 795 HD13 ILE 106 2HD1 ILE 106 -1.035 -5.957 9.474 796 H PHE 107 HN PHE 107 -0.070 -10.466 7.574 797 HA PHE 107 HA PHE 107 -0.961 -11.255 5.043 798 HB2 PHE 107 2HB PHE 107 1.514 -11.538 6.608 799 HB3 PHE 107 1HB PHE 107 1.261 -12.832 5.445 800 HD1 PHE 107 1HD PHE 107 0.871 -12.201 3.030 801 HD2 PHE 107 2HD PHE 107 2.339 -9.468 5.935 802 HE1 PHE 107 1HE PHE 107 1.755 -10.773 1.230 803 HE2 PHE 107 2HE PHE 107 3.220 -8.029 4.146 804 HZ PHE 107 HZ PHE 107 2.930 -8.681 1.787 805 H ASN 108 HN ASN 108 -0.469 -13.083 8.004 806 HA ASN 108 HA ASN 108 -0.909 -15.657 7.042 807 HB2 ASN 108 2HB ASN 108 -0.013 -15.253 9.263 808 HB3 ASN 108 1HB ASN 108 -1.522 -14.497 9.768 809 HD21 ASN 108 1HD2 ASN 108 -1.928 -15.914 11.415 810 HD22 ASN 108 2HD2 ASN 108 -2.369 -17.569 11.152 811 H ARG 109 HN ARG 109 -3.298 -13.418 8.527 812 HA ARG 109 HA ARG 109 -5.435 -15.238 8.298 813 HB2 ARG 109 2HB ARG 109 -6.924 -13.454 8.848 814 HB3 ARG 109 1HB ARG 109 -5.455 -13.221 9.783 815 HG2 ARG 109 2HG ARG 109 -4.915 -11.297 8.717 816 HG3 ARG 109 1HG ARG 109 -5.638 -11.804 7.190 817 HD2 ARG 109 2HD ARG 109 -7.185 -10.975 9.649 818 HD3 ARG 109 1HD ARG 109 -6.860 -9.934 8.264 819 HE ARG 109 HE ARG 109 -8.341 -12.465 7.937 820 HH11 ARG 109 1HH1 ARG 109 -8.260 -8.963 7.740 821 HH12 ARG 109 2HH1 ARG 109 -9.660 -8.866 6.725 822 HH21 ARG 109 1HH2 ARG 109 -10.191 -12.313 6.598 823 HH22 ARG 109 2HH2 ARG 109 -10.760 -10.749 6.074 824 H PHE 110 HN PHE 110 -4.202 -12.823 6.044 825 HA PHE 110 HA PHE 110 -6.345 -13.020 4.188 826 HB2 PHE 110 2HB PHE 110 -3.477 -12.131 3.844 827 HB3 PHE 110 1HB PHE 110 -4.676 -12.049 2.565 828 HD1 PHE 110 1HD PHE 110 -6.774 -11.345 5.007 829 HD2 PHE 110 2HD PHE 110 -3.227 -9.682 3.349 830 HE1 PHE 110 1HE PHE 110 -7.461 -9.110 5.775 831 HE2 PHE 110 2HE PHE 110 -3.910 -7.450 4.111 832 HZ PHE 110 HZ PHE 110 -6.029 -7.159 5.325 833 H ARG 111 HN ARG 111 -3.078 -14.414 4.210 834 HA ARG 111 HA ARG 111 -3.305 -15.946 1.876 835 HB2 ARG 111 2HB ARG 111 -1.261 -15.330 3.401 836 HB3 ARG 111 1HB ARG 111 -1.656 -16.821 4.231 837 HG2 ARG 111 2HG ARG 111 -0.949 -16.577 1.313 838 HG3 ARG 111 1HG ARG 111 0.135 -17.109 2.597 839 HD2 ARG 111 2HD ARG 111 -1.892 -18.810 2.994 840 HD3 ARG 111 1HD ARG 111 -2.092 -18.530 1.269 841 HE ARG 111 HE ARG 111 0.455 -19.474 2.441 842 HH11 ARG 111 1HH1 ARG 111 -1.969 -19.537 -0.066 843 HH12 ARG 111 2HH1 ARG 111 -1.285 -20.905 -0.887 844 HH21 ARG 111 1HH2 ARG 111 1.401 -21.239 1.373 845 HH22 ARG 111 2HH2 ARG 111 0.658 -21.881 -0.060 846 H ASN 112 HN ASN 112 -4.039 -16.698 5.249 847 HA ASN 112 HA ASN 112 -4.423 -19.473 4.886 848 HB2 ASN 112 2HB ASN 112 -4.381 -17.707 7.046 849 HB3 ASN 112 1HB ASN 112 -6.006 -18.382 7.056 850 HD21 ASN 112 1HD2 ASN 112 -2.669 -18.965 7.562 851 HD22 ASN 112 2HD2 ASN 112 -2.814 -20.591 8.143 852 H SER 113 HN SER 113 -6.732 -16.764 4.964 853 HA SER 113 HA SER 113 -8.971 -18.562 4.706 854 HB2 SER 113 2HB SER 113 -10.328 -16.499 4.720 855 HB3 SER 113 1HB SER 113 -9.188 -16.543 6.064 856 HG SER 113 HG SER 113 -8.028 -14.962 5.169 857 H GLY 114 HN GLY 114 -7.277 -16.237 2.645 858 HA2 GLY 114 2HA GLY 114 -7.175 -16.524 0.264 859 HA3 GLY 114 1HA GLY 114 -8.734 -17.339 0.333 860 H LYS 115 HN LYS 115 -9.048 -14.901 2.424 861 HA LYS 115 HA LYS 115 -10.032 -13.030 0.391 862 HB2 LYS 115 2HB LYS 115 -11.825 -14.052 1.743 863 HB3 LYS 115 1HB LYS 115 -11.028 -13.521 3.215 864 HG2 LYS 115 2HG LYS 115 -11.458 -11.232 2.705 865 HG3 LYS 115 1HG LYS 115 -12.047 -11.653 1.099 866 HD2 LYS 115 2HD LYS 115 -13.335 -12.559 3.670 867 HD3 LYS 115 1HD LYS 115 -13.845 -11.140 2.756 868 HE2 LYS 115 2HE LYS 115 -14.203 -12.638 0.786 869 HE3 LYS 115 1HE LYS 115 -13.880 -14.011 1.841 870 HZ1 LYS 115 3HZ LYS 115 -16.260 -13.520 1.531 871 HZ2 LYS 115 1HZ LYS 115 -16.037 -12.027 2.303 872 HZ3 LYS 115 2HZ LYS 115 -15.783 -13.473 3.158 873 H GLY 116 HN GLY 116 -10.142 -10.730 1.438 874 HA2 GLY 116 2HA GLY 116 -9.100 -9.147 2.902 875 HA3 GLY 116 1HA GLY 116 -7.759 -10.271 3.093 876 H PHE 117 HN PHE 117 -7.956 -7.417 2.212 877 HA PHE 117 HA PHE 117 -6.405 -7.723 -0.272 878 HB2 PHE 117 2HB PHE 117 -8.301 -5.464 0.425 879 HB3 PHE 117 1HB PHE 117 -7.312 -5.564 -1.024 880 HD1 PHE 117 2HD PHE 117 -10.207 -7.004 0.735 881 HD2 PHE 117 1HD PHE 117 -7.973 -6.879 -2.881 882 HE1 PHE 117 2HE PHE 117 -12.026 -8.184 -0.425 883 HE2 PHE 117 1HE PHE 117 -9.791 -8.050 -4.053 884 HZ PHE 117 HZ PHE 117 -11.821 -8.707 -2.822 885 H LEU 118 HN LEU 118 -4.406 -6.838 -0.158 886 HA LEU 118 HA LEU 118 -3.857 -5.073 2.130 887 HB2 LEU 118 2HB LEU 118 -3.086 -7.472 2.434 888 HB3 LEU 118 1HB LEU 118 -1.967 -7.171 1.120 889 HG LEU 118 HG LEU 118 -0.886 -5.394 2.431 890 HD11 LEU 118 1HD1 LEU 118 -2.787 -4.721 3.792 891 HD12 LEU 118 2HD1 LEU 118 -1.404 -5.149 4.802 892 HD13 LEU 118 3HD1 LEU 118 -2.751 -6.275 4.629 893 HD21 LEU 118 3HD2 LEU 118 0.177 -6.866 4.084 894 HD22 LEU 118 1HD2 LEU 118 0.018 -7.635 2.505 895 HD23 LEU 118 2HD2 LEU 118 -1.089 -8.065 3.809 896 H LEU 119 HN LEU 119 -2.591 -3.406 1.784 897 HA LEU 119 HA LEU 119 -1.201 -3.131 -0.795 898 HB2 LEU 119 2HB LEU 119 -3.379 -1.563 0.204 899 HB3 LEU 119 1HB LEU 119 -1.945 -0.558 0.148 900 HG LEU 119 HG LEU 119 -3.309 -0.410 -1.906 901 HD11 LEU 119 1HD1 LEU 119 -0.594 -1.664 -2.287 902 HD12 LEU 119 2HD1 LEU 119 -0.919 0.048 -2.014 903 HD13 LEU 119 3HD1 LEU 119 -1.475 -0.733 -3.495 904 HD21 LEU 119 3HD2 LEU 119 -4.169 -2.689 -1.918 905 HD22 LEU 119 1HD2 LEU 119 -2.549 -3.306 -2.241 906 HD23 LEU 119 2HD2 LEU 119 -3.367 -2.306 -3.441 907 H LEU 120 HN LEU 120 0.898 -2.748 -0.521 908 HA LEU 120 HA LEU 120 1.756 -1.679 2.088 909 HB2 LEU 120 2HB LEU 120 3.145 -3.743 0.388 910 HB3 LEU 120 1HB LEU 120 3.762 -3.078 1.888 911 HG LEU 120 HG LEU 120 1.267 -4.762 1.606 912 HD11 LEU 120 1HD1 LEU 120 3.949 -5.421 2.818 913 HD12 LEU 120 2HD1 LEU 120 3.364 -6.005 1.262 914 HD13 LEU 120 3HD1 LEU 120 2.542 -6.482 2.747 915 HD21 LEU 120 3HD2 LEU 120 1.212 -4.760 4.030 916 HD22 LEU 120 1HD2 LEU 120 1.129 -3.104 3.426 917 HD23 LEU 120 2HD2 LEU 120 2.640 -3.730 4.086 918 H GLY 121 HN GLY 121 2.878 0.125 2.007 919 HA2 GLY 121 2HA GLY 121 4.294 0.795 -0.501 920 HA3 GLY 121 1HA GLY 121 3.689 1.982 0.654 921 H SER 122 HN SER 122 6.450 1.494 -0.388 922 HA SER 122 HA SER 122 7.786 1.689 2.147 923 HB2 SER 122 2HB SER 122 7.569 -0.787 1.823 924 HB3 SER 122 1HB SER 122 8.516 -0.633 0.345 925 HG SER 122 HG SER 122 9.849 -1.211 2.069 926 H GLU 123 HN GLU 123 10.325 1.540 1.579 927 HA GLU 123 HA GLU 123 10.695 3.526 -0.550 928 HB2 GLU 123 2HB GLU 123 12.806 4.055 0.689 929 HB3 GLU 123 1HB GLU 123 11.337 4.334 1.616 930 HG2 GLU 123 2HG GLU 123 11.674 2.151 2.730 931 HG3 GLU 123 1HG GLU 123 13.196 1.979 1.857 932 H TYR 124 HN TYR 124 11.322 0.297 0.238 933 HA TYR 124 HA TYR 124 13.213 0.083 -1.992 934 HB2 TYR 124 2HB TYR 124 13.488 -1.207 0.727 935 HB3 TYR 124 1HB TYR 124 14.346 -1.791 -0.693 936 HD1 TYR 124 2HD TYR 124 15.636 0.198 -1.995 937 HD2 TYR 124 1HD TYR 124 14.655 0.158 2.146 938 HE1 TYR 124 2HE TYR 124 17.463 1.783 -1.553 939 HE2 TYR 124 1HE TYR 124 16.479 1.740 2.599 940 HH TYR 124 HH TYR 124 18.684 2.364 1.483 941 H THR 125 HN THR 125 13.523 -2.496 -2.295 942 HA THR 125 HA THR 125 10.959 -3.511 -3.044 943 HB THR 125 HB THR 125 12.396 -5.602 -3.568 944 HG1 THR 125 1HG THR 125 14.686 -4.909 -3.798 945 HG21 THR 125 3HG2 THR 125 13.004 -2.966 -4.915 946 HG22 THR 125 1HG2 THR 125 11.628 -4.011 -5.266 947 HG23 THR 125 2HG2 THR 125 13.267 -4.563 -5.615 948 HA PRO 126 HA PRO 126 9.598 -5.516 0.491 949 HB2 PRO 126 2HB PRO 126 8.707 -7.948 -0.369 950 HB3 PRO 126 1HB PRO 126 7.875 -6.426 -0.689 951 HG2 PRO 126 2HG PRO 126 9.720 -7.979 -2.461 952 HG3 PRO 126 1HG PRO 126 8.182 -7.191 -2.862 953 HD2 PRO 126 2HD PRO 126 10.542 -6.053 -3.453 954 HD3 PRO 126 1HD PRO 126 9.139 -5.085 -2.955 955 H GLN 127 HN GLN 127 11.886 -7.480 -1.313 956 HA GLN 127 HA GLN 127 12.363 -9.153 1.037 957 HB2 GLN 127 2HB GLN 127 13.461 -9.389 -1.769 958 HB3 GLN 127 1HB GLN 127 13.700 -10.550 -0.470 959 HG2 GLN 127 2HG GLN 127 11.284 -10.973 -0.419 960 HG3 GLN 127 1HG GLN 127 11.068 -9.828 -1.743 961 HE21 GLN 127 1HE2 GLN 127 13.563 -10.677 -3.044 962 HE22 GLN 127 2HE2 GLN 127 13.215 -12.210 -3.771 963 H GLN 128 HN GLN 128 13.483 -6.301 -0.179 964 HA GLN 128 HA GLN 128 16.256 -6.780 0.656 965 HB2 GLN 128 2HB GLN 128 15.579 -5.651 -1.588 966 HB3 GLN 128 1HB GLN 128 15.253 -4.238 -0.593 967 HG2 GLN 128 2HG GLN 128 17.557 -4.226 0.176 968 HG3 GLN 128 1HG GLN 128 17.893 -5.674 -0.773 969 HE21 GLN 128 1HE2 GLN 128 17.389 -2.258 -0.845 970 HE22 GLN 128 2HE2 GLN 128 17.837 -2.013 -2.502 971 H LEU 129 HN LEU 129 13.353 -5.678 1.829 972 HA LEU 129 HA LEU 129 14.230 -3.575 3.527 973 HB2 LEU 129 2HB LEU 129 11.861 -5.430 3.756 974 HB3 LEU 129 1HB LEU 129 12.112 -4.001 4.735 975 HG LEU 129 HG LEU 129 11.699 -4.032 1.745 976 HD11 LEU 129 1HD1 LEU 129 9.891 -3.178 4.000 977 HD12 LEU 129 2HD1 LEU 129 9.671 -4.580 2.952 978 HD13 LEU 129 3HD1 LEU 129 9.564 -2.953 2.281 979 HD21 LEU 129 3HD2 LEU 129 13.170 -2.216 2.483 980 HD22 LEU 129 1HD2 LEU 129 11.952 -1.710 3.654 981 HD23 LEU 129 2HD2 LEU 129 11.611 -1.608 1.927 982 H VAL 130 HN VAL 130 14.982 -3.638 5.614 983 HA VAL 130 HA VAL 130 16.028 -6.194 6.481 984 HB VAL 130 HB VAL 130 16.219 -3.544 7.918 985 HG11 VAL 130 1HG1 VAL 130 18.157 -4.548 9.016 986 HG12 VAL 130 2HG1 VAL 130 17.869 -6.058 8.152 987 HG13 VAL 130 3HG1 VAL 130 16.689 -5.475 9.329 988 HG21 VAL 130 3HG2 VAL 130 18.122 -4.782 5.933 989 HG22 VAL 130 1HG2 VAL 130 18.448 -3.342 6.898 990 HG23 VAL 130 2HG2 VAL 130 17.159 -3.323 5.694 991 H ILE 131 HN ILE 131 14.022 -7.206 6.786 992 HA ILE 131 HA ILE 131 12.750 -6.605 9.370 993 HB ILE 131 HB ILE 131 10.575 -7.355 8.420 994 HG12 ILE 131 2HG1 ILE 131 11.989 -7.112 5.756 995 HG13 ILE 131 1HG1 ILE 131 11.540 -8.635 6.514 996 HG21 ILE 131 1HG2 ILE 131 11.808 -4.973 7.047 997 HG22 ILE 131 2HG2 ILE 131 11.059 -4.981 8.642 998 HG23 ILE 131 3HG2 ILE 131 10.080 -5.283 7.206 999 HD11 ILE 131 3HD1 ILE 131 9.943 -8.061 4.808 1000 HD12 ILE 131 1HD1 ILE 131 9.663 -6.490 5.559 1001 HD13 ILE 131 2HD1 ILE 131 9.174 -7.962 6.394 1002 H ARG 132 HN ARG 132 11.132 -8.697 9.689 1003 HA ARG 132 HA ARG 132 12.640 -10.873 10.409 1004 HB2 ARG 132 2HB ARG 132 9.782 -10.912 9.421 1005 HB3 ARG 132 1HB ARG 132 10.554 -12.200 10.332 1006 HG2 ARG 132 2HG ARG 132 10.242 -9.408 11.399 1007 HG3 ARG 132 1HG ARG 132 9.024 -10.664 11.616 1008 HD2 ARG 132 2HD ARG 132 10.212 -10.910 13.557 1009 HD3 ARG 132 1HD ARG 132 11.074 -12.040 12.519 1010 HE ARG 132 HE ARG 132 12.379 -9.619 12.244 1011 HH11 ARG 132 1HH1 ARG 132 11.635 -11.829 14.874 1012 HH12 ARG 132 2HH1 ARG 132 13.035 -11.371 15.806 1013 HH21 ARG 132 1HH2 ARG 132 14.206 -9.026 13.489 1014 HH22 ARG 132 2HH2 ARG 132 14.491 -9.801 15.019 1015 H GLU 133 HN GLU 133 13.562 -12.569 9.405 1016 HA GLU 133 HA GLU 133 13.979 -12.408 6.612 1017 HB2 GLU 133 2HB GLU 133 15.622 -13.325 8.248 1018 HB3 GLU 133 1HB GLU 133 14.603 -14.747 8.422 1019 HG2 GLU 133 2HG GLU 133 14.933 -15.329 6.114 1020 HG3 GLU 133 1HG GLU 133 15.829 -13.838 5.832 1021 H ASP 134 HN ASP 134 11.835 -14.393 8.581 1022 HA ASP 134 HA ASP 134 10.972 -16.049 6.414 1023 HB2 ASP 134 2HB ASP 134 10.688 -16.712 8.784 1024 HB3 ASP 134 1HB ASP 134 9.540 -15.396 9.005 1025 H LEU 135 HN LEU 135 9.825 -13.065 7.886 1026 HA LEU 135 HA LEU 135 7.352 -12.897 6.582 1027 HB2 LEU 135 2HB LEU 135 8.370 -11.564 8.589 1028 HB3 LEU 135 1HB LEU 135 8.915 -10.460 7.346 1029 HG LEU 135 HG LEU 135 6.015 -11.213 7.699 1030 HD11 LEU 135 1HD1 LEU 135 5.754 -9.087 8.878 1031 HD12 LEU 135 2HD1 LEU 135 7.499 -8.846 8.830 1032 HD13 LEU 135 3HD1 LEU 135 6.820 -10.186 9.753 1033 HD21 LEU 135 3HD2 LEU 135 6.596 -10.289 5.514 1034 HD22 LEU 135 1HD2 LEU 135 7.348 -8.900 6.296 1035 HD23 LEU 135 2HD2 LEU 135 5.608 -9.159 6.441 1036 H ARG 136 HN ARG 136 10.572 -11.761 5.626 1037 HA ARG 136 HA ARG 136 9.712 -10.165 3.478 1038 HB2 ARG 136 2HB ARG 136 12.001 -10.069 2.819 1039 HB3 ARG 136 1HB ARG 136 11.950 -10.031 4.569 1040 HG2 ARG 136 2HG ARG 136 12.529 -12.414 4.615 1041 HG3 ARG 136 1HG ARG 136 12.622 -12.412 2.854 1042 HD2 ARG 136 2HD ARG 136 14.841 -12.206 3.705 1043 HD3 ARG 136 1HD ARG 136 14.376 -10.653 3.017 1044 HE ARG 136 HE ARG 136 13.778 -10.602 5.745 1045 HH11 ARG 136 1HH1 ARG 136 16.572 -10.728 3.642 1046 HH12 ARG 136 2HH1 ARG 136 17.633 -9.975 4.795 1047 HH21 ARG 136 1HH2 ARG 136 15.190 -9.628 7.284 1048 HH22 ARG 136 2HH2 ARG 136 16.857 -9.376 6.858 1049 H THR 137 HN THR 137 10.060 -13.613 3.746 1050 HA THR 137 HA THR 137 10.110 -14.030 0.887 1051 HB THR 137 HB THR 137 9.930 -16.380 1.321 1052 HG1 THR 137 1HG THR 137 9.428 -15.777 4.069 1053 HG21 THR 137 3HG2 THR 137 11.660 -15.071 3.420 1054 HG22 THR 137 1HG2 THR 137 12.122 -15.452 1.762 1055 HG23 THR 137 2HG2 THR 137 11.787 -16.752 2.905 1056 H ARG 138 HN ARG 138 7.749 -13.794 3.442 1057 HA ARG 138 HA ARG 138 5.510 -14.814 2.034 1058 HB2 ARG 138 2HB ARG 138 5.446 -12.706 4.193 1059 HB3 ARG 138 1HB ARG 138 4.188 -13.865 3.788 1060 HG2 ARG 138 2HG ARG 138 6.882 -14.576 4.922 1061 HG3 ARG 138 1HG ARG 138 5.397 -14.422 5.859 1062 HD2 ARG 138 2HD ARG 138 4.391 -16.243 4.618 1063 HD3 ARG 138 1HD ARG 138 5.806 -16.342 3.571 1064 HE ARG 138 HE ARG 138 6.691 -16.669 6.196 1065 HH11 ARG 138 1HH1 ARG 138 4.661 -18.348 3.880 1066 HH12 ARG 138 2HH1 ARG 138 4.977 -19.922 4.552 1067 HH21 ARG 138 1HH2 ARG 138 7.156 -18.706 7.045 1068 HH22 ARG 138 2HH2 ARG 138 6.430 -20.129 6.351 1069 H MET 139 HN MET 139 7.276 -11.921 1.886 1070 HA MET 139 HA MET 139 5.361 -10.117 0.897 1071 HB2 MET 139 2HB MET 139 8.357 -10.288 0.599 1072 HB3 MET 139 1HB MET 139 7.417 -8.959 -0.058 1073 HG2 MET 139 2HG MET 139 7.378 -9.726 2.846 1074 HG3 MET 139 1HG MET 139 8.492 -8.543 2.166 1075 HE1 MET 139 3HE MET 139 6.004 -6.213 4.047 1076 HE2 MET 139 1HE MET 139 7.690 -6.665 3.798 1077 HE3 MET 139 2HE MET 139 6.582 -7.794 4.576 1078 H ALA 140 HN ALA 140 6.866 -12.833 -0.542 1079 HA ALA 140 HA ALA 140 6.676 -11.952 -3.263 1080 HB1 ALA 140 1HB ALA 140 7.022 -14.740 -2.173 1081 HB2 ALA 140 2HB ALA 140 8.335 -13.629 -2.569 1082 HB3 ALA 140 3HB ALA 140 7.275 -14.234 -3.843 1083 H TYR 141 HN TYR 141 4.336 -12.855 -1.052 1084 HA TYR 141 HA TYR 141 2.613 -14.333 -2.793 1085 HB2 TYR 141 2HB TYR 141 2.019 -12.843 -0.227 1086 HB3 TYR 141 1HB TYR 141 0.865 -13.854 -1.079 1087 HD1 TYR 141 1HD TYR 141 2.835 -16.085 -1.825 1088 HD2 TYR 141 2HD TYR 141 2.083 -14.018 1.816 1089 HE1 TYR 141 1HE TYR 141 3.617 -18.041 -0.555 1090 HE2 TYR 141 2HE TYR 141 2.861 -15.965 3.093 1091 HH TYR 141 HH TYR 141 4.515 -18.576 1.621 1092 H CYS 142 HN CYS 142 3.290 -10.984 -2.290 1093 HA CYS 142 HA CYS 142 0.827 -10.195 -3.649 1094 HB2 CYS 142 2HB CYS 142 1.358 -7.905 -2.812 1095 HB3 CYS 142 1HB CYS 142 1.100 -9.082 -1.532 1096 HG CYS 142 HG CYS 142 4.282 -9.141 -2.090 1097 H LEU 143 HN LEU 143 1.025 -8.390 -5.162 1098 HA LEU 143 HA LEU 143 3.145 -8.934 -7.051 1099 HB2 LEU 143 2HB LEU 143 0.753 -7.101 -7.173 1100 HB3 LEU 143 1HB LEU 143 1.908 -7.256 -8.471 1101 HG LEU 143 HG LEU 143 1.283 -9.712 -8.529 1102 HD11 LEU 143 1HD1 LEU 143 -0.908 -10.321 -7.649 1103 HD12 LEU 143 2HD1 LEU 143 -1.050 -8.730 -6.901 1104 HD13 LEU 143 3HD1 LEU 143 0.192 -9.855 -6.351 1105 HD21 LEU 143 3HD2 LEU 143 0.568 -8.129 -10.221 1106 HD22 LEU 143 1HD2 LEU 143 -0.796 -7.649 -9.212 1107 HD23 LEU 143 2HD2 LEU 143 -0.719 -9.282 -9.873 1108 H VAL 144 HN VAL 144 4.496 -7.284 -7.953 1109 HA VAL 144 HA VAL 144 4.990 -5.063 -6.080 1110 HB VAL 144 HB VAL 144 7.061 -6.511 -7.748 1111 HG11 VAL 144 1HG1 VAL 144 8.670 -5.222 -6.411 1112 HG12 VAL 144 2HG1 VAL 144 7.331 -4.376 -5.635 1113 HG13 VAL 144 3HG1 VAL 144 7.614 -4.179 -7.366 1114 HG21 VAL 144 3HG2 VAL 144 6.212 -7.932 -5.938 1115 HG22 VAL 144 1HG2 VAL 144 6.549 -6.652 -4.774 1116 HG23 VAL 144 2HG2 VAL 144 7.877 -7.435 -5.632 1117 H TYR 145 HN TYR 145 4.518 -3.196 -6.947 1118 HA TYR 145 HA TYR 145 4.892 -2.836 -9.848 1119 HB2 TYR 145 2HB TYR 145 2.679 -1.900 -8.046 1120 HB3 TYR 145 1HB TYR 145 3.039 -1.044 -9.542 1121 HD1 TYR 145 2HD TYR 145 2.707 -2.149 -11.704 1122 HD2 TYR 145 1HD TYR 145 1.602 -4.057 -8.067 1123 HE1 TYR 145 2HE TYR 145 1.328 -3.740 -12.965 1124 HE2 TYR 145 1HE TYR 145 0.224 -5.665 -9.323 1125 HH TYR 145 HH TYR 145 0.464 -6.106 -12.621 1126 H GLU 146 HN GLU 146 6.217 -1.289 -10.458 1127 HA GLU 146 HA GLU 146 6.977 0.774 -8.516 1128 HB2 GLU 146 2HB GLU 146 8.803 -0.552 -9.579 1129 HB3 GLU 146 1HB GLU 146 8.282 0.037 -11.149 1130 HG2 GLU 146 2HG GLU 146 8.851 2.134 -9.179 1131 HG3 GLU 146 1HG GLU 146 10.239 1.152 -9.647 1132 H VAL 147 HN VAL 147 6.251 2.803 -8.781 1133 HA VAL 147 HA VAL 147 4.974 3.508 -11.334 1134 HB VAL 147 HB VAL 147 3.204 4.711 -9.974 1135 HG11 VAL 147 1HG1 VAL 147 2.739 2.615 -11.132 1136 HG12 VAL 147 2HG1 VAL 147 1.873 2.686 -9.597 1137 HG13 VAL 147 3HG1 VAL 147 3.331 1.706 -9.744 1138 HG21 VAL 147 3HG2 VAL 147 4.327 2.991 -7.761 1139 HG22 VAL 147 1HG2 VAL 147 2.815 3.894 -7.682 1140 HG23 VAL 147 2HG2 VAL 147 4.349 4.753 -7.826 1141 H LYS 148 HN LYS 148 7.535 4.286 -10.713 1142 HA LYS 148 HA LYS 148 7.322 7.027 -9.695 1143 HB2 LYS 148 2HB LYS 148 9.118 5.828 -8.699 1144 HB3 LYS 148 1HB LYS 148 9.672 5.221 -10.251 1145 HG2 LYS 148 2HG LYS 148 11.145 6.960 -9.381 1146 HG3 LYS 148 1HG LYS 148 10.390 7.447 -10.898 1147 HD2 LYS 148 2HD LYS 148 8.756 8.784 -9.659 1148 HD3 LYS 148 1HD LYS 148 9.502 8.288 -8.139 1149 HE2 LYS 148 2HE LYS 148 10.258 10.510 -8.784 1150 HE3 LYS 148 1HE LYS 148 11.592 9.361 -8.809 1151 HZ1 LYS 148 3HZ LYS 148 10.077 10.219 -11.227 1152 HZ2 LYS 148 1HZ LYS 148 11.482 9.265 -11.185 1153 HZ3 LYS 148 2HZ LYS 148 11.552 10.891 -10.728 1154 HA PRO 149 HA PRO 149 7.449 8.327 -14.015 1155 HB2 PRO 149 2HB PRO 149 6.620 10.911 -13.021 1156 HB3 PRO 149 1HB PRO 149 5.708 9.774 -14.015 1157 HG2 PRO 149 2HG PRO 149 5.071 10.375 -11.426 1158 HG3 PRO 149 1HG PRO 149 4.666 8.837 -12.208 1159 HD2 PRO 149 2HD PRO 149 6.920 9.482 -10.340 1160 HD3 PRO 149 1HD PRO 149 5.887 8.035 -10.401 Start of MODEL 18 1 H1 MET 1 H1 MET 1 2.707 5.314 -16.301 2 H2 MET 1 H2 MET 1 1.891 4.285 -17.371 3 H3 MET 1 H3 MET 1 1.604 5.953 -17.416 4 HA MET 1 HA MET 1 4.060 4.513 -18.205 5 HB2 MET 1 2HB MET 1 2.164 6.340 -19.698 6 HB3 MET 1 1HB MET 1 3.683 5.743 -20.349 7 HG2 MET 1 2HG MET 1 2.853 3.449 -20.173 8 HG3 MET 1 1HG MET 1 1.326 4.057 -19.534 9 HE1 MET 1 2HE MET 1 -0.018 2.747 -21.391 10 HE2 MET 1 3HE MET 1 1.482 2.113 -22.068 11 HE3 MET 1 1HE MET 1 0.296 2.884 -23.120 12 H GLY 2 HN GLY 2 5.925 5.686 -18.546 13 HA2 GLY 2 2HA GLY 2 6.017 8.531 -18.121 14 HA3 GLY 2 1HA GLY 2 6.645 7.611 -16.761 15 H HIS 3 HN HIS 3 8.204 9.384 -18.277 16 HA HIS 3 HA HIS 3 10.064 7.480 -19.546 17 HB2 HIS 3 2HB HIS 3 9.334 10.258 -20.469 18 HB3 HIS 3 1HB HIS 3 10.789 9.430 -21.010 19 HD1 HIS 3 1HD HIS 3 10.473 7.372 -22.580 20 HD2 HIS 3 2HD HIS 3 6.962 9.398 -21.640 21 HE1 HIS 3 1HE HIS 3 8.757 6.563 -24.233 22 HE2 HIS 3 2HE HIS 3 6.681 7.908 -23.742 23 H HIS 4 HN HIS 4 9.568 10.246 -17.511 24 HA HIS 4 HA HIS 4 12.465 10.443 -17.017 25 HB2 HIS 4 2HB HIS 4 10.240 12.406 -16.416 26 HB3 HIS 4 1HB HIS 4 11.929 12.645 -15.985 27 HD1 HIS 4 1HD HIS 4 9.637 13.719 -18.409 28 HD2 HIS 4 2HD HIS 4 13.567 12.375 -18.576 29 HE1 HIS 4 1HE HIS 4 10.548 14.567 -20.584 30 HE2 HIS 4 2HE HIS 4 12.981 13.905 -20.574 31 H HIS 5 HN HIS 5 13.283 10.206 -14.986 32 HA HIS 5 HA HIS 5 11.749 10.470 -12.637 33 HB2 HIS 5 2HB HIS 5 10.860 8.272 -13.237 34 HB3 HIS 5 1HB HIS 5 12.494 7.627 -13.367 35 HD1 HIS 5 1HD HIS 5 10.073 8.970 -10.772 36 HD2 HIS 5 2HD HIS 5 13.603 6.766 -11.003 37 HE1 HIS 5 1HE HIS 5 10.534 8.159 -8.428 38 HE2 HIS 5 2HE HIS 5 12.790 7.039 -8.566 39 H HIS 6 HN HIS 6 13.209 11.501 -11.485 40 HA HIS 6 HA HIS 6 15.959 10.463 -11.385 41 HB2 HIS 6 2HB HIS 6 14.815 13.099 -10.420 42 HB3 HIS 6 1HB HIS 6 16.496 12.612 -10.239 43 HD1 HIS 6 1HD HIS 6 18.011 12.803 -12.288 44 HD2 HIS 6 2HD HIS 6 14.046 13.798 -13.031 45 HE1 HIS 6 1HE HIS 6 17.995 13.874 -14.562 46 HE2 HIS 6 2HE HIS 6 15.621 14.666 -14.887 47 H HIS 7 HN HIS 7 16.950 10.739 -9.074 48 HA HIS 7 HA HIS 7 15.238 9.214 -7.296 49 HB2 HIS 7 2HB HIS 7 17.566 8.529 -7.515 50 HB3 HIS 7 1HB HIS 7 18.111 10.121 -7.002 51 HD1 HIS 7 1HD HIS 7 18.645 10.330 -4.593 52 HD2 HIS 7 2HD HIS 7 16.039 7.175 -5.340 53 HE1 HIS 7 1HE HIS 7 18.341 9.161 -2.385 54 HE2 HIS 7 2HE HIS 7 16.576 7.422 -2.825 55 H HIS 8 HN HIS 8 13.830 10.235 -6.089 56 HA HIS 8 HA HIS 8 14.350 12.916 -5.067 57 HB2 HIS 8 2HB HIS 8 11.998 11.059 -4.619 58 HB3 HIS 8 1HB HIS 8 12.081 12.742 -4.117 59 HD1 HIS 8 1HD HIS 8 11.876 10.607 -7.220 60 HD2 HIS 8 2HD HIS 8 11.349 14.571 -6.055 61 HE1 HIS 8 1HE HIS 8 10.817 11.769 -9.195 62 HE2 HIS 8 2HE HIS 8 10.552 14.173 -8.488 63 H SER 9 HN SER 9 13.616 13.152 -2.612 64 HA SER 9 HA SER 9 15.031 11.052 -1.117 65 HB2 SER 9 2HB SER 9 14.575 13.944 -0.343 66 HB3 SER 9 1HB SER 9 15.465 12.750 0.606 67 HG SER 9 HG SER 9 16.727 12.541 -1.509 68 H HIS 10 HN HIS 10 12.838 13.521 0.152 69 HA HIS 10 HA HIS 10 10.534 11.997 0.468 70 HB2 HIS 10 2HB HIS 10 12.522 10.948 2.082 71 HB3 HIS 10 1HB HIS 10 11.662 12.022 3.177 72 HD1 HIS 10 1HD HIS 10 8.744 11.529 2.345 73 HD2 HIS 10 2HD HIS 10 11.589 8.509 2.722 74 HE1 HIS 10 1HE HIS 10 7.449 9.418 2.757 75 HE2 HIS 10 2HE HIS 10 9.195 7.662 3.218 76 H MET 11 HN MET 11 9.806 14.152 -0.012 77 HA MET 11 HA MET 11 10.107 16.054 2.220 78 HB2 MET 11 2HB MET 11 9.260 16.584 -0.630 79 HB3 MET 11 1HB MET 11 9.430 17.800 0.627 80 HG2 MET 11 2HG MET 11 11.829 17.242 0.791 81 HG3 MET 11 1HG MET 11 11.623 16.121 -0.551 82 HE1 MET 11 3HE MET 11 9.984 19.682 -0.008 83 HE2 MET 11 1HE MET 11 11.148 20.700 -0.858 84 HE3 MET 11 2HE MET 11 11.630 19.845 0.605 85 H ASP 12 HN ASP 12 8.514 15.025 3.494 86 HA ASP 12 HA ASP 12 5.869 15.956 3.176 87 HB2 ASP 12 2HB ASP 12 4.738 13.768 2.854 88 HB3 ASP 12 1HB ASP 12 5.686 14.247 1.448 89 H TYR 13 HN TYR 13 4.361 14.682 4.681 90 HA TYR 13 HA TYR 13 5.304 12.952 6.667 91 HB2 TYR 13 2HB TYR 13 6.442 15.066 7.469 92 HB3 TYR 13 1HB TYR 13 4.842 15.765 7.700 93 HD1 TYR 13 1HD TYR 13 6.803 12.737 8.670 94 HD2 TYR 13 2HD TYR 13 3.874 15.599 9.805 95 HE1 TYR 13 1HE TYR 13 6.709 11.739 10.915 96 HE2 TYR 13 2HE TYR 13 3.770 14.608 12.054 97 HH TYR 13 HH TYR 13 4.261 12.531 13.183 98 HA PRO 14 HA PRO 14 0.897 12.616 6.053 99 HB2 PRO 14 2HB PRO 14 1.128 10.396 7.983 100 HB3 PRO 14 1HB PRO 14 0.542 10.382 6.317 101 HG2 PRO 14 2HG PRO 14 2.904 9.307 6.982 102 HG3 PRO 14 1HG PRO 14 2.665 10.140 5.433 103 HD2 PRO 14 2HD PRO 14 3.992 11.122 7.935 104 HD3 PRO 14 1HD PRO 14 4.475 11.348 6.241 105 H SER 15 HN SER 15 0.393 14.546 7.176 106 HA SER 15 HA SER 15 -1.055 14.057 9.620 107 HB2 SER 15 2HB SER 15 1.210 16.066 9.549 108 HB3 SER 15 1HB SER 15 -0.001 15.966 10.828 109 HG SER 15 HG SER 15 1.123 13.547 10.340 110 H PHE 16 HN PHE 16 -2.798 14.528 8.203 111 HA PHE 16 HA PHE 16 -3.558 17.276 8.257 112 HB2 PHE 16 2HB PHE 16 -2.110 17.158 6.183 113 HB3 PHE 16 1HB PHE 16 -3.287 16.040 5.504 114 HD1 PHE 16 1HD PHE 16 -2.901 19.479 6.838 115 HD2 PHE 16 2HD PHE 16 -5.177 16.842 4.385 116 HE1 PHE 16 1HE PHE 16 -4.188 21.391 5.986 117 HE2 PHE 16 2HE PHE 16 -6.471 18.754 3.529 118 HZ PHE 16 HZ PHE 16 -5.975 21.033 4.331 119 H ASP 17 HN ASP 17 -5.342 16.569 9.375 120 HA ASP 17 HA ASP 17 -7.160 14.768 7.916 121 HB2 ASP 17 2HB ASP 17 -6.475 13.700 9.951 122 HB3 ASP 17 1HB ASP 17 -6.806 15.152 10.891 123 H LYS 18 HN LYS 18 -8.205 16.349 6.787 124 HA LYS 18 HA LYS 18 -10.357 17.606 8.255 125 HB2 LYS 18 2HB LYS 18 -8.421 19.202 6.568 126 HB3 LYS 18 1HB LYS 18 -10.056 19.757 6.902 127 HG2 LYS 18 2HG LYS 18 -9.520 19.616 9.336 128 HG3 LYS 18 1HG LYS 18 -7.850 19.273 8.891 129 HD2 LYS 18 2HD LYS 18 -8.100 21.625 9.401 130 HD3 LYS 18 1HD LYS 18 -7.759 21.421 7.682 131 HE2 LYS 18 2HE LYS 18 -10.060 21.777 7.116 132 HE3 LYS 18 1HE LYS 18 -10.531 21.759 8.814 133 HZ1 LYS 18 3HZ LYS 18 -9.486 23.813 9.188 134 HZ2 LYS 18 1HZ LYS 18 -10.341 24.007 7.738 135 HZ3 LYS 18 2HZ LYS 18 -8.659 23.774 7.705 136 H PHE 19 HN PHE 19 -12.049 16.703 7.258 137 HA PHE 19 HA PHE 19 -12.690 17.179 4.589 138 HB2 PHE 19 2HB PHE 19 -10.849 15.426 4.321 139 HB3 PHE 19 1HB PHE 19 -11.948 14.290 5.080 140 HD1 PHE 19 1HD PHE 19 -11.650 16.612 2.196 141 HD2 PHE 19 2HD PHE 19 -13.517 13.144 3.801 142 HE1 PHE 19 1HE PHE 19 -12.673 16.157 0.006 143 HE2 PHE 19 2HE PHE 19 -14.545 12.679 1.612 144 HZ PHE 19 HZ PHE 19 -14.122 14.187 -0.286 145 H LEU 20 HN LEU 20 -15.412 16.531 6.842 146 HA LEU 20 HA LEU 20 -15.573 18.697 6.236 147 HB2 LEU 20 2HB LEU 20 -12.668 18.585 7.008 148 HB3 LEU 20 1HB LEU 20 -13.749 19.952 7.112 149 HG LEU 20 HG LEU 20 -14.039 17.427 8.723 150 HD11 LEU 20 1HD1 LEU 20 -13.316 18.796 10.619 151 HD12 LEU 20 2HD1 LEU 20 -13.006 20.144 9.524 152 HD13 LEU 20 3HD1 LEU 20 -12.058 18.662 9.390 153 HD21 LEU 20 3HD2 LEU 20 -16.163 18.562 8.288 154 HD22 LEU 20 1HD2 LEU 20 -15.486 20.068 8.908 155 HD23 LEU 20 2HD2 LEU 20 -15.697 18.687 9.985 156 H GLY 21 HN GLY 21 -15.848 18.190 3.909 157 HA2 GLY 21 2HA GLY 21 -13.533 19.198 2.377 158 HA3 GLY 21 1HA GLY 21 -14.451 17.802 1.841 159 H THR 22 HN THR 22 -14.266 21.227 1.931 160 HA THR 22 HA THR 22 -16.816 21.485 0.538 161 HB THR 22 HB THR 22 -16.228 23.224 2.191 162 HG1 THR 22 1HG THR 22 -17.531 24.103 0.707 163 HG21 THR 22 3HG2 THR 22 -14.436 24.826 1.734 164 HG22 THR 22 1HG2 THR 22 -13.952 23.884 0.324 165 HG23 THR 22 2HG2 THR 22 -13.797 23.194 1.939 166 H GLU 23 HN GLU 23 -16.944 22.068 -1.652 167 HA GLU 23 HA GLU 23 -16.438 21.699 -3.827 168 HB2 GLU 23 2HB GLU 23 -14.812 23.508 -3.599 169 HB3 GLU 23 1HB GLU 23 -13.610 22.383 -2.982 170 HG2 GLU 23 2HG GLU 23 -13.535 21.237 -5.105 171 HG3 GLU 23 1HG GLU 23 -14.833 22.253 -5.729 172 H ASN 24 HN ASN 24 -16.506 19.753 -4.740 173 HA ASN 24 HA ASN 24 -15.228 17.563 -3.282 174 HB2 ASN 24 2HB ASN 24 -17.523 17.699 -5.222 175 HB3 ASN 24 1HB ASN 24 -16.791 16.162 -4.769 176 HD21 ASN 24 1HD2 ASN 24 -19.485 17.272 -4.281 177 HD22 ASN 24 2HD2 ASN 24 -19.705 17.197 -2.560 178 H ALA 25 HN ALA 25 -13.833 19.330 -5.298 179 HA ALA 25 HA ALA 25 -13.329 17.801 -7.628 180 HB1 ALA 25 1HB ALA 25 -12.880 20.211 -7.486 181 HB2 ALA 25 2HB ALA 25 -11.455 19.306 -7.995 182 HB3 ALA 25 3HB ALA 25 -11.580 19.893 -6.337 183 H GLU 26 HN GLU 26 -11.498 18.175 -4.592 184 HA GLU 26 HA GLU 26 -9.521 16.267 -5.285 185 HB2 GLU 26 2HB GLU 26 -10.399 17.299 -2.588 186 HB3 GLU 26 1HB GLU 26 -9.011 16.246 -2.832 187 HG2 GLU 26 2HG GLU 26 -8.103 17.993 -4.392 188 HG3 GLU 26 1HG GLU 26 -9.392 19.053 -3.830 189 H LEU 27 HN LEU 27 -12.717 15.994 -3.998 190 HA LEU 27 HA LEU 27 -12.506 13.394 -2.919 191 HB2 LEU 27 2HB LEU 27 -14.343 14.781 -2.280 192 HB3 LEU 27 1HB LEU 27 -14.844 14.990 -3.949 193 HG LEU 27 HG LEU 27 -15.390 12.586 -4.046 194 HD11 LEU 27 1HD1 LEU 27 -13.911 11.757 -2.307 195 HD12 LEU 27 2HD1 LEU 27 -15.581 11.325 -1.940 196 HD13 LEU 27 3HD1 LEU 27 -14.807 12.661 -1.089 197 HD21 LEU 27 3HD2 LEU 27 -16.761 14.163 -1.878 198 HD22 LEU 27 1HD2 LEU 27 -17.427 12.741 -2.681 199 HD23 LEU 27 2HD2 LEU 27 -17.128 14.214 -3.602 200 H VAL 28 HN VAL 28 -13.517 14.622 -6.096 201 HA VAL 28 HA VAL 28 -13.982 12.118 -7.296 202 HB VAL 28 HB VAL 28 -13.033 14.663 -8.633 203 HG11 VAL 28 1HG1 VAL 28 -14.399 12.240 -9.790 204 HG12 VAL 28 2HG1 VAL 28 -12.722 12.716 -10.057 205 HG13 VAL 28 3HG1 VAL 28 -14.033 13.728 -10.662 206 HG21 VAL 28 3HG2 VAL 28 -15.414 15.033 -9.128 207 HG22 VAL 28 1HG2 VAL 28 -15.083 15.038 -7.394 208 HG23 VAL 28 2HG2 VAL 28 -15.821 13.624 -8.149 209 H TYR 29 HN TYR 29 -11.085 14.026 -6.823 210 HA TYR 29 HA TYR 29 -9.288 12.473 -8.331 211 HB2 TYR 29 2HB TYR 29 -8.791 14.726 -7.417 212 HB3 TYR 29 1HB TYR 29 -8.761 14.048 -5.796 213 HD1 TYR 29 1HD TYR 29 -7.006 14.174 -9.033 214 HD2 TYR 29 2HD TYR 29 -6.832 12.871 -4.989 215 HE1 TYR 29 1HE TYR 29 -4.603 13.723 -9.287 216 HE2 TYR 29 2HE TYR 29 -4.427 12.425 -5.230 217 HH TYR 29 HH TYR 29 -2.585 13.571 -7.794 218 H VAL 30 HN VAL 30 -10.617 12.069 -5.119 219 HA VAL 30 HA VAL 30 -8.832 9.985 -4.316 220 HB VAL 30 HB VAL 30 -11.499 10.862 -3.192 221 HG11 VAL 30 1HG1 VAL 30 -10.979 9.547 -1.217 222 HG12 VAL 30 2HG1 VAL 30 -9.481 8.987 -1.959 223 HG13 VAL 30 3HG1 VAL 30 -11.037 8.501 -2.637 224 HG21 VAL 30 3HG2 VAL 30 -9.757 12.547 -2.994 225 HG22 VAL 30 1HG2 VAL 30 -8.667 11.359 -2.278 226 HG23 VAL 30 2HG2 VAL 30 -10.119 11.857 -1.411 227 H LEU 31 HN LEU 31 -11.963 10.109 -5.903 228 HA LEU 31 HA LEU 31 -12.845 7.507 -5.519 229 HB2 LEU 31 2HB LEU 31 -13.196 9.245 -7.965 230 HB3 LEU 31 1HB LEU 31 -14.136 7.809 -7.603 231 HG LEU 31 HG LEU 31 -14.106 10.356 -5.978 232 HD11 LEU 31 1HD1 LEU 31 -16.415 10.588 -6.753 233 HD12 LEU 31 2HD1 LEU 31 -16.212 9.161 -7.770 234 HD13 LEU 31 3HD1 LEU 31 -15.266 10.614 -8.092 235 HD21 LEU 31 3HD2 LEU 31 -15.923 9.327 -4.707 236 HD22 LEU 31 1HD2 LEU 31 -14.432 8.395 -4.567 237 HD23 LEU 31 2HD2 LEU 31 -15.726 7.836 -5.628 238 H ARG 32 HN ARG 32 -11.886 5.652 -5.955 239 HA ARG 32 HA ARG 32 -10.148 5.468 -8.325 240 HB2 ARG 32 2HB ARG 32 -9.425 5.195 -5.619 241 HB3 ARG 32 1HB ARG 32 -9.444 3.563 -6.274 242 HG2 ARG 32 2HG ARG 32 -7.236 4.522 -6.463 243 HG3 ARG 32 1HG ARG 32 -7.932 4.270 -8.065 244 HD2 ARG 32 2HD ARG 32 -8.533 6.629 -8.188 245 HD3 ARG 32 1HD ARG 32 -7.886 6.891 -6.569 246 HE ARG 32 HE ARG 32 -5.869 5.780 -8.171 247 HH11 ARG 32 1HH1 ARG 32 -7.721 8.744 -7.888 248 HH12 ARG 32 2HH1 ARG 32 -6.460 9.743 -8.547 249 HH21 ARG 32 1HH2 ARG 32 -4.195 7.104 -9.012 250 HH22 ARG 32 2HH2 ARG 32 -4.450 8.819 -9.144 251 H HIS 33 HN HIS 33 -9.870 3.236 -9.138 252 HA HIS 33 HA HIS 33 -12.444 1.832 -9.076 253 HB2 HIS 33 2HB HIS 33 -10.101 1.509 -10.969 254 HB3 HIS 33 1HB HIS 33 -11.667 0.722 -11.126 255 HD1 HIS 33 1HD HIS 33 -9.999 3.118 -12.856 256 HD2 HIS 33 2HD HIS 33 -13.673 3.219 -10.900 257 HE1 HIS 33 1HE HIS 33 -11.278 5.014 -13.904 258 HE2 HIS 33 2HE HIS 33 -13.457 5.123 -12.639 259 H LYS 34 HN LYS 34 -10.763 1.531 -6.849 260 HA LYS 34 HA LYS 34 -9.598 0.115 -5.533 261 HB2 LYS 34 2HB LYS 34 -10.538 -2.157 -5.332 262 HB3 LYS 34 1HB LYS 34 -11.758 -0.899 -5.326 263 HG2 LYS 34 2HG LYS 34 -12.407 -1.447 -7.575 264 HG3 LYS 34 1HG LYS 34 -11.071 -2.595 -7.719 265 HD2 LYS 34 2HD LYS 34 -12.039 -4.031 -6.071 266 HD3 LYS 34 1HD LYS 34 -13.263 -2.829 -5.662 267 HE2 LYS 34 2HE LYS 34 -13.004 -4.156 -8.354 268 HE3 LYS 34 1HE LYS 34 -14.104 -4.688 -7.084 269 HZ1 LYS 34 3HZ LYS 34 -14.142 -2.062 -8.472 270 HZ2 LYS 34 1HZ LYS 34 -15.132 -2.466 -7.155 271 HZ3 LYS 34 2HZ LYS 34 -15.283 -3.304 -8.624 272 H HIS 35 HN HIS 35 -8.984 -2.639 -5.825 273 HA HIS 35 HA HIS 35 -7.187 -2.870 -8.084 274 HB2 HIS 35 2HB HIS 35 -6.162 -2.623 -5.245 275 HB3 HIS 35 1HB HIS 35 -5.217 -3.324 -6.547 276 HD1 HIS 35 1HD HIS 35 -5.758 -0.221 -4.851 277 HD2 HIS 35 2HD HIS 35 -4.858 -1.324 -8.757 278 HE1 HIS 35 1HE HIS 35 -4.797 1.838 -5.934 279 HE2 HIS 35 2HE HIS 35 -4.153 1.119 -8.266 280 H GLY 36 HN GLY 36 -5.665 -4.965 -7.303 281 HA2 GLY 36 2HA GLY 36 -7.537 -7.118 -6.931 282 HA3 GLY 36 1HA GLY 36 -5.793 -7.266 -7.102 283 H GLN 37 HN GLN 37 -5.967 -8.879 -5.372 284 HA GLN 37 HA GLN 37 -6.829 -7.978 -2.772 285 HB2 GLN 37 2HB GLN 37 -5.439 -10.534 -3.592 286 HB3 GLN 37 1HB GLN 37 -6.083 -10.200 -1.991 287 HG2 GLN 37 2HG GLN 37 -8.337 -9.970 -3.004 288 HG3 GLN 37 1HG GLN 37 -7.647 -10.467 -4.549 289 HE21 GLN 37 1HE2 GLN 37 -6.689 -11.754 -1.431 290 HE22 GLN 37 2HE2 GLN 37 -7.297 -13.353 -1.696 291 H PHE 38 HN PHE 38 -3.735 -9.475 -3.710 292 HA PHE 38 HA PHE 38 -2.451 -7.809 -1.668 293 HB2 PHE 38 2HB PHE 38 -1.535 -10.387 -2.956 294 HB3 PHE 38 1HB PHE 38 -0.615 -9.484 -1.758 295 HD1 PHE 38 2HD PHE 38 -1.493 -9.276 0.564 296 HD2 PHE 38 1HD PHE 38 -3.301 -11.828 -2.324 297 HE1 PHE 38 2HE PHE 38 -2.658 -10.487 2.365 298 HE2 PHE 38 1HE PHE 38 -4.468 -13.039 -0.530 299 HZ PHE 38 HZ PHE 38 -4.148 -12.371 1.817 300 H ILE 39 HN ILE 39 -1.833 -5.966 -2.604 301 HA ILE 39 HA ILE 39 -0.312 -6.147 -5.127 302 HB ILE 39 HB ILE 39 -2.204 -3.947 -4.276 303 HG12 ILE 39 2HG1 ILE 39 -3.369 -5.963 -5.064 304 HG13 ILE 39 1HG1 ILE 39 -3.558 -4.634 -6.200 305 HG21 ILE 39 1HG2 ILE 39 -0.510 -4.207 -6.755 306 HG22 ILE 39 2HG2 ILE 39 -0.322 -3.017 -5.467 307 HG23 ILE 39 3HG2 ILE 39 -1.752 -2.983 -6.499 308 HD11 ILE 39 3HD1 ILE 39 -3.181 -6.712 -7.371 309 HD12 ILE 39 1HD1 ILE 39 -1.676 -6.965 -6.486 310 HD13 ILE 39 2HD1 ILE 39 -1.818 -5.620 -7.615 311 H TYR 40 HN TYR 40 1.752 -5.625 -4.790 312 HA TYR 40 HA TYR 40 2.373 -3.530 -2.826 313 HB2 TYR 40 2HB TYR 40 3.572 -5.669 -2.524 314 HB3 TYR 40 1HB TYR 40 4.223 -5.530 -4.154 315 HD1 TYR 40 1HD TYR 40 6.009 -3.927 -4.648 316 HD2 TYR 40 2HD TYR 40 4.425 -4.290 -0.717 317 HE1 TYR 40 1HE TYR 40 7.936 -2.683 -3.761 318 HE2 TYR 40 2HE TYR 40 6.347 -3.047 0.179 319 HH TYR 40 HH TYR 40 8.625 -1.440 -1.886 320 H VAL 41 HN VAL 41 2.821 -1.579 -3.560 321 HA VAL 41 HA VAL 41 3.640 -1.291 -6.369 322 HB VAL 41 HB VAL 41 3.010 1.140 -6.073 323 HG11 VAL 41 1HG1 VAL 41 0.624 0.729 -6.360 324 HG12 VAL 41 2HG1 VAL 41 0.810 -0.889 -5.683 325 HG13 VAL 41 3HG1 VAL 41 1.573 -0.485 -7.219 326 HG21 VAL 41 3HG2 VAL 41 1.692 0.108 -3.562 327 HG22 VAL 41 1HG2 VAL 41 1.521 1.728 -4.237 328 HG23 VAL 41 2HG2 VAL 41 3.083 1.189 -3.616 329 H TRP 42 HN TRP 42 5.702 -0.900 -6.740 330 HA TRP 42 HA TRP 42 7.306 0.169 -4.522 331 HB2 TRP 42 2HB TRP 42 9.160 -1.033 -5.284 332 HB3 TRP 42 1HB TRP 42 7.827 -2.141 -5.578 333 HD1 TRP 42 1HD TRP 42 6.951 -2.220 -8.237 334 HE1 TRP 42 1HE TRP 42 8.357 -2.060 -10.386 335 HE3 TRP 42 3HE TRP 42 11.166 -0.083 -6.295 336 HZ2 TRP 42 2HZ TRP 42 10.911 -1.156 -11.157 337 HZ3 TRP 42 3HZ TRP 42 13.049 0.392 -7.806 338 HH2 TRP 42 2HH TRP 42 12.924 -0.135 -10.187 339 H GLY 43 HN GLY 43 8.921 1.740 -4.977 340 HA2 GLY 43 2HA GLY 43 9.634 2.860 -7.343 341 HA3 GLY 43 1HA GLY 43 8.098 3.631 -6.977 342 H GLU 44 HN GLU 44 8.131 5.392 -5.770 343 HA GLU 44 HA GLU 44 10.210 5.959 -3.874 344 HB2 GLU 44 2HB GLU 44 11.058 6.345 -6.339 345 HB3 GLU 44 1HB GLU 44 10.105 7.815 -6.224 346 HG2 GLU 44 2HG GLU 44 11.432 8.616 -4.410 347 HG3 GLU 44 1HG GLU 44 12.276 7.070 -4.285 348 H GLU 45 HN GLU 45 9.932 8.736 -3.737 349 HA GLU 45 HA GLU 45 7.332 8.891 -2.574 350 HB2 GLU 45 2HB GLU 45 7.922 11.024 -1.761 351 HB3 GLU 45 1HB GLU 45 9.404 10.083 -1.716 352 HG2 GLU 45 2HG GLU 45 10.311 11.217 -3.554 353 HG3 GLU 45 1HG GLU 45 8.753 11.909 -4.004 354 H GLY 46 HN GLY 46 5.648 10.337 -3.117 355 HA2 GLY 46 2HA GLY 46 5.316 12.103 -5.099 356 HA3 GLY 46 1HA GLY 46 5.281 10.581 -5.981 357 H ALA 47 HN ALA 47 3.141 10.600 -6.577 358 HA ALA 47 HA ALA 47 1.015 11.305 -4.856 359 HB1 ALA 47 1HB ALA 47 0.907 9.566 -7.315 360 HB2 ALA 47 2HB ALA 47 0.859 11.329 -7.314 361 HB3 ALA 47 3HB ALA 47 -0.446 10.411 -6.562 362 H GLY 48 HN GLY 48 2.935 8.518 -4.994 363 HA2 GLY 48 2HA GLY 48 1.044 6.575 -4.159 364 HA3 GLY 48 1HA GLY 48 2.790 6.441 -4.026 365 H LYS 49 HN LYS 49 2.965 8.936 -2.458 366 HA LYS 49 HA LYS 49 2.915 7.726 0.102 367 HB2 LYS 49 2HB LYS 49 3.160 10.667 -0.549 368 HB3 LYS 49 1HB LYS 49 3.647 9.884 0.947 369 HG2 LYS 49 2HG LYS 49 5.352 8.624 -0.278 370 HG3 LYS 49 1HG LYS 49 4.868 9.439 -1.767 371 HD2 LYS 49 2HD LYS 49 5.960 10.777 0.709 372 HD3 LYS 49 1HD LYS 49 6.851 10.480 -0.785 373 HE2 LYS 49 2HE LYS 49 5.249 11.913 -1.994 374 HE3 LYS 49 1HE LYS 49 4.409 12.230 -0.476 375 HZ1 LYS 49 3HZ LYS 49 6.543 13.162 0.368 376 HZ2 LYS 49 1HZ LYS 49 5.864 14.044 -0.913 377 HZ3 LYS 49 2HZ LYS 49 7.185 13.022 -1.192 378 H SER 50 HN SER 50 1.063 7.213 1.038 379 HA SER 50 HA SER 50 -0.876 7.422 2.175 380 HB2 SER 50 2HB SER 50 -0.589 10.409 1.808 381 HB3 SER 50 1HB SER 50 -1.569 9.580 3.016 382 HG SER 50 HG SER 50 0.335 8.775 3.961 383 H HIS 51 HN HIS 51 -0.790 9.540 -0.680 384 HA HIS 51 HA HIS 51 -3.531 10.010 -0.906 385 HB2 HIS 51 2HB HIS 51 -1.383 9.980 -3.026 386 HB3 HIS 51 1HB HIS 51 -3.036 10.495 -3.339 387 HD1 HIS 51 1HD HIS 51 -3.845 12.631 -1.893 388 HD2 HIS 51 2HD HIS 51 0.253 11.924 -2.055 389 HE1 HIS 51 1HE HIS 51 -2.752 14.797 -1.217 390 HE2 HIS 51 2HE HIS 51 -0.277 14.399 -1.501 391 H LEU 52 HN LEU 52 -1.602 7.543 -2.636 392 HA LEU 52 HA LEU 52 -3.806 6.486 -4.046 393 HB2 LEU 52 2HB LEU 52 -1.160 5.233 -3.330 394 HB3 LEU 52 1HB LEU 52 -2.336 4.480 -4.388 395 HG LEU 52 HG LEU 52 -0.864 7.067 -4.894 396 HD11 LEU 52 1HD1 LEU 52 0.128 5.837 -6.752 397 HD12 LEU 52 2HD1 LEU 52 -0.750 4.386 -6.267 398 HD13 LEU 52 3HD1 LEU 52 0.487 5.064 -5.208 399 HD21 LEU 52 3HD2 LEU 52 -3.142 7.205 -5.750 400 HD22 LEU 52 1HD2 LEU 52 -2.934 5.665 -6.581 401 HD23 LEU 52 2HD2 LEU 52 -1.984 7.066 -7.072 402 H LEU 53 HN LEU 53 -2.480 5.792 -0.894 403 HA LEU 53 HA LEU 53 -3.950 3.388 -0.478 404 HB2 LEU 53 2HB LEU 53 -2.547 5.260 1.417 405 HB3 LEU 53 1HB LEU 53 -3.375 3.813 1.954 406 HG LEU 53 HG LEU 53 -1.834 2.511 0.399 407 HD11 LEU 53 1HD1 LEU 53 0.301 3.581 -0.151 408 HD12 LEU 53 2HD1 LEU 53 -0.332 5.123 0.423 409 HD13 LEU 53 3HD1 LEU 53 -1.052 4.343 -0.985 410 HD21 LEU 53 3HD2 LEU 53 0.005 2.549 2.026 411 HD22 LEU 53 1HD2 LEU 53 -1.578 2.499 2.800 412 HD23 LEU 53 2HD2 LEU 53 -0.678 4.012 2.736 413 H GLN 54 HN GLN 54 -4.397 6.752 0.512 414 HA GLN 54 HA GLN 54 -6.745 6.398 2.008 415 HB2 GLN 54 2HB GLN 54 -5.325 8.434 2.017 416 HB3 GLN 54 1HB GLN 54 -5.898 8.815 0.400 417 HG2 GLN 54 2HG GLN 54 -8.192 8.977 1.282 418 HG3 GLN 54 1HG GLN 54 -7.563 8.676 2.902 419 HE21 GLN 54 1HE2 GLN 54 -8.989 10.990 1.884 420 HE22 GLN 54 2HE2 GLN 54 -7.949 12.345 2.133 421 H ALA 55 HN ALA 55 -6.211 7.102 -1.408 422 HA ALA 55 HA ALA 55 -8.879 7.458 -2.185 423 HB1 ALA 55 1HB ALA 55 -6.970 8.080 -3.576 424 HB2 ALA 55 2HB ALA 55 -8.076 7.020 -4.451 425 HB3 ALA 55 3HB ALA 55 -6.570 6.377 -3.796 426 H TRP 56 HN TRP 56 -6.872 4.568 -1.981 427 HA TRP 56 HA TRP 56 -8.772 2.813 -3.175 428 HB2 TRP 56 2HB TRP 56 -6.366 2.367 -3.188 429 HB3 TRP 56 1HB TRP 56 -6.363 2.249 -1.435 430 HD1 TRP 56 1HD TRP 56 -8.094 0.395 -4.395 431 HE1 TRP 56 1HE TRP 56 -8.156 -2.112 -3.796 432 HE3 TRP 56 3HE TRP 56 -6.030 0.616 0.274 433 HZ2 TRP 56 2HZ TRP 56 -7.429 -3.769 -1.638 434 HZ3 TRP 56 3HZ TRP 56 -5.751 -1.472 1.542 435 HH2 TRP 56 2HH TRP 56 -6.436 -3.618 0.605 436 H VAL 57 HN VAL 57 -7.927 3.636 0.147 437 HA VAL 57 HA VAL 57 -9.575 1.680 1.366 438 HB VAL 57 HB VAL 57 -8.332 4.227 2.392 439 HG11 VAL 57 1HG1 VAL 57 -8.954 3.524 4.655 440 HG12 VAL 57 2HG1 VAL 57 -9.905 2.200 3.983 441 HG13 VAL 57 3HG1 VAL 57 -10.378 3.870 3.674 442 HG21 VAL 57 3HG2 VAL 57 -6.795 2.421 1.902 443 HG22 VAL 57 1HG2 VAL 57 -7.762 1.302 2.867 444 HG23 VAL 57 2HG2 VAL 57 -6.923 2.642 3.647 445 H ALA 58 HN ALA 58 -10.085 5.127 0.649 446 HA ALA 58 HA ALA 58 -12.548 5.365 1.991 447 HB1 ALA 58 1HB ALA 58 -11.560 6.982 -0.360 448 HB2 ALA 58 2HB ALA 58 -11.176 7.287 1.333 449 HB3 ALA 58 3HB ALA 58 -12.838 7.441 0.766 450 H GLN 59 HN GLN 59 -11.840 4.552 -1.404 451 HA GLN 59 HA GLN 59 -14.579 4.602 -2.169 452 HB2 GLN 59 2HB GLN 59 -13.848 3.559 -4.262 453 HB3 GLN 59 1HB GLN 59 -12.835 4.925 -3.835 454 HG2 GLN 59 2HG GLN 59 -11.267 3.427 -4.525 455 HG3 GLN 59 1HG GLN 59 -11.296 3.086 -2.798 456 HE21 GLN 59 1HE2 GLN 59 -13.826 2.112 -4.996 457 HE22 GLN 59 2HE2 GLN 59 -13.520 0.417 -4.901 458 H ALA 60 HN ALA 60 -12.461 2.147 -0.866 459 HA ALA 60 HA ALA 60 -14.256 -0.028 -1.305 460 HB1 ALA 60 1HB ALA 60 -12.027 0.206 0.712 461 HB2 ALA 60 2HB ALA 60 -11.837 -0.335 -0.956 462 HB3 ALA 60 3HB ALA 60 -12.806 -1.283 0.173 463 H LEU 61 HN LEU 61 -13.685 2.255 1.293 464 HA LEU 61 HA LEU 61 -15.307 1.135 3.270 465 HB2 LEU 61 2HB LEU 61 -14.514 3.967 2.643 466 HB3 LEU 61 1HB LEU 61 -15.545 3.597 4.004 467 HG LEU 61 HG LEU 61 -12.750 2.532 3.608 468 HD11 LEU 61 1HD1 LEU 61 -12.790 4.936 4.065 469 HD12 LEU 61 2HD1 LEU 61 -12.145 4.029 5.433 470 HD13 LEU 61 3HD1 LEU 61 -13.796 4.647 5.485 471 HD21 LEU 61 3HD2 LEU 61 -14.640 2.314 5.950 472 HD22 LEU 61 1HD2 LEU 61 -12.975 1.728 5.902 473 HD23 LEU 61 2HD2 LEU 61 -14.197 1.003 4.857 474 H GLU 62 HN GLU 62 -16.131 3.481 0.724 475 HA GLU 62 HA GLU 62 -18.898 3.526 1.478 476 HB2 GLU 62 2HB GLU 62 -17.542 4.547 -1.013 477 HB3 GLU 62 1HB GLU 62 -19.214 4.865 -0.564 478 HG2 GLU 62 2HG GLU 62 -18.378 5.929 1.520 479 HG3 GLU 62 1HG GLU 62 -16.742 5.733 0.897 480 H ALA 63 HN ALA 63 -17.008 1.354 -0.208 481 HA ALA 63 HA ALA 63 -19.109 0.382 -1.953 482 HB1 ALA 63 1HB ALA 63 -16.775 0.256 -2.680 483 HB2 ALA 63 2HB ALA 63 -17.517 -1.343 -2.599 484 HB3 ALA 63 3HB ALA 63 -16.412 -0.818 -1.329 485 H GLY 64 HN GLY 64 -18.458 0.162 1.286 486 HA2 GLY 64 2HA GLY 64 -19.912 -0.960 2.769 487 HA3 GLY 64 1HA GLY 64 -20.297 -2.100 1.490 488 H LYS 65 HN LYS 65 -16.986 -1.476 1.812 489 HA LYS 65 HA LYS 65 -16.632 -3.964 3.332 490 HB2 LYS 65 2HB LYS 65 -14.698 -2.649 1.414 491 HB3 LYS 65 1HB LYS 65 -14.478 -4.194 2.215 492 HG2 LYS 65 2HG LYS 65 -16.613 -3.576 0.180 493 HG3 LYS 65 1HG LYS 65 -15.110 -4.448 -0.133 494 HD2 LYS 65 2HD LYS 65 -15.788 -6.154 1.507 495 HD3 LYS 65 1HD LYS 65 -17.309 -5.292 1.749 496 HE2 LYS 65 2HE LYS 65 -17.856 -5.619 -0.620 497 HE3 LYS 65 1HE LYS 65 -16.343 -6.498 -0.841 498 HZ1 LYS 65 3HZ LYS 65 -18.126 -8.048 -0.562 499 HZ2 LYS 65 1HZ LYS 65 -18.626 -7.310 0.881 500 HZ3 LYS 65 2HZ LYS 65 -17.139 -8.122 0.813 501 H ASN 66 HN ASN 66 -14.759 -3.971 4.772 502 HA ASN 66 HA ASN 66 -14.403 -1.346 5.999 503 HB2 ASN 66 2HB ASN 66 -14.955 -3.467 7.348 504 HB3 ASN 66 1HB ASN 66 -13.283 -3.923 7.079 505 HD21 ASN 66 1HD2 ASN 66 -13.026 -3.811 9.375 506 HD22 ASN 66 2HD2 ASN 66 -12.776 -2.277 10.146 507 H ALA 67 HN ALA 67 -12.538 -0.270 6.005 508 HA ALA 67 HA ALA 67 -10.148 -1.545 4.942 509 HB1 ALA 67 1HB ALA 67 -11.304 -0.706 2.972 510 HB2 ALA 67 2HB ALA 67 -9.829 0.215 3.269 511 HB3 ALA 67 3HB ALA 67 -11.398 0.901 3.697 512 H ALA 68 HN ALA 68 -8.236 -0.468 5.470 513 HA ALA 68 HA ALA 68 -8.374 2.045 6.912 514 HB1 ALA 68 1HB ALA 68 -7.287 -0.431 8.255 515 HB2 ALA 68 2HB ALA 68 -8.782 0.402 8.683 516 HB3 ALA 68 3HB ALA 68 -7.229 1.210 8.898 517 H TYR 69 HN TYR 69 -6.638 3.250 6.456 518 HA TYR 69 HA TYR 69 -4.276 1.896 5.375 519 HB2 TYR 69 2HB TYR 69 -3.704 4.024 4.277 520 HB3 TYR 69 1HB TYR 69 -5.274 3.435 3.761 521 HD1 TYR 69 2HD TYR 69 -7.333 4.569 4.559 522 HD2 TYR 69 1HD TYR 69 -3.461 6.115 5.391 523 HE1 TYR 69 2HE TYR 69 -8.326 6.747 5.108 524 HE2 TYR 69 1HE TYR 69 -4.443 8.301 5.942 525 HH TYR 69 HH TYR 69 -6.441 9.578 5.518 526 H ILE 70 HN ILE 70 -2.417 2.056 6.413 527 HA ILE 70 HA ILE 70 -2.271 3.921 8.687 528 HB ILE 70 HB ILE 70 -1.211 1.093 8.586 529 HG12 ILE 70 2HG1 ILE 70 -3.380 2.343 10.287 530 HG13 ILE 70 1HG1 ILE 70 -3.652 1.262 8.923 531 HG21 ILE 70 1HG2 ILE 70 -0.491 1.458 10.889 532 HG22 ILE 70 2HG2 ILE 70 -1.032 3.134 10.800 533 HG23 ILE 70 3HG2 ILE 70 0.307 2.585 9.791 534 HD11 ILE 70 3HD1 ILE 70 -2.515 -0.530 10.123 535 HD12 ILE 70 1HD1 ILE 70 -3.889 0.097 11.033 536 HD13 ILE 70 2HD1 ILE 70 -2.247 0.552 11.490 537 H ASP 71 HN ASP 71 -0.834 5.404 8.237 538 HA ASP 71 HA ASP 71 1.381 4.961 6.452 539 HB2 ASP 71 2HB ASP 71 0.896 7.351 8.255 540 HB3 ASP 71 1HB ASP 71 1.915 7.292 6.822 541 H ALA 72 HN ALA 72 2.943 3.659 7.246 542 HA ALA 72 HA ALA 72 3.368 3.205 9.983 543 HB1 ALA 72 1HB ALA 72 5.328 1.935 9.319 544 HB2 ALA 72 2HB ALA 72 5.256 2.644 7.706 545 HB3 ALA 72 3HB ALA 72 3.960 1.585 8.260 546 H ALA 73 HN ALA 73 4.516 5.729 7.967 547 HA ALA 73 HA ALA 73 6.679 6.384 9.817 548 HB1 ALA 73 1HB ALA 73 5.906 7.743 7.241 549 HB2 ALA 73 2HB ALA 73 7.122 6.476 7.392 550 HB3 ALA 73 3HB ALA 73 7.370 8.036 8.181 551 H SER 74 HN SER 74 3.815 6.627 10.517 552 HA SER 74 HA SER 74 4.004 9.165 11.824 553 HB2 SER 74 2HB SER 74 3.159 9.835 9.572 554 HB3 SER 74 1HB SER 74 1.749 8.809 9.835 555 HG SER 74 HG SER 74 1.301 10.969 10.391 556 H MET 75 HN MET 75 2.185 6.300 11.008 557 HA MET 75 HA MET 75 0.900 6.374 13.656 558 HB2 MET 75 2HB MET 75 -0.299 5.619 10.992 559 HB3 MET 75 1HB MET 75 -1.023 5.130 12.512 560 HG2 MET 75 2HG MET 75 -1.116 7.566 13.126 561 HG3 MET 75 1HG MET 75 -0.641 7.921 11.466 562 HE1 MET 75 3HE MET 75 -2.152 7.387 9.336 563 HE2 MET 75 1HE MET 75 -3.661 6.476 9.425 564 HE3 MET 75 2HE MET 75 -2.130 5.689 9.811 565 HA PRO 76 HA PRO 76 2.559 2.242 13.881 566 HB2 PRO 76 2HB PRO 76 1.603 1.545 16.268 567 HB3 PRO 76 1HB PRO 76 2.801 2.831 16.111 568 HG2 PRO 76 2HG PRO 76 -0.142 3.029 16.562 569 HG3 PRO 76 1HG PRO 76 1.165 4.023 17.230 570 HD2 PRO 76 2HD PRO 76 -0.452 4.694 15.046 571 HD3 PRO 76 1HD PRO 76 1.092 5.458 15.469 572 H LEU 77 HN LEU 77 1.870 0.008 13.992 573 HA LEU 77 HA LEU 77 -0.763 -0.419 12.858 574 HB2 LEU 77 2HB LEU 77 1.197 -1.582 11.943 575 HB3 LEU 77 1HB LEU 77 1.468 -2.354 13.494 576 HG LEU 77 HG LEU 77 -0.675 -3.557 13.262 577 HD11 LEU 77 1HD1 LEU 77 -0.768 -2.286 10.532 578 HD12 LEU 77 2HD1 LEU 77 -1.859 -1.940 11.875 579 HD13 LEU 77 3HD1 LEU 77 -1.858 -3.538 11.129 580 HD21 LEU 77 3HD2 LEU 77 1.369 -4.628 12.508 581 HD22 LEU 77 1HD2 LEU 77 1.204 -3.869 10.926 582 HD23 LEU 77 2HD2 LEU 77 0.022 -5.065 11.457 583 H THR 78 HN THR 78 -2.399 -1.644 13.809 584 HA THR 78 HA THR 78 -2.048 -2.326 16.633 585 HB THR 78 HB THR 78 -4.398 -1.450 17.013 586 HG1 THR 78 1HG THR 78 -4.326 0.439 15.112 587 HG21 THR 78 3HG2 THR 78 -3.683 0.869 17.319 588 HG22 THR 78 1HG2 THR 78 -2.289 0.586 16.277 589 HG23 THR 78 2HG2 THR 78 -2.418 -0.250 17.825 590 H ASP 79 HN ASP 79 -3.807 -3.722 17.434 591 HA ASP 79 HA ASP 79 -4.266 -5.922 15.701 592 HB2 ASP 79 2HB ASP 79 -5.438 -6.928 17.556 593 HB3 ASP 79 1HB ASP 79 -4.005 -6.116 18.169 594 H ALA 80 HN ALA 80 -5.902 -3.011 16.104 595 HA ALA 80 HA ALA 80 -8.577 -3.759 15.644 596 HB1 ALA 80 1HB ALA 80 -7.203 -1.177 14.899 597 HB2 ALA 80 2HB ALA 80 -7.919 -1.543 16.468 598 HB3 ALA 80 3HB ALA 80 -8.943 -1.431 15.038 599 H ALA 81 HN ALA 81 -5.835 -3.533 13.565 600 HA ALA 81 HA ALA 81 -7.044 -3.058 11.089 601 HB1 ALA 81 1HB ALA 81 -4.622 -2.945 11.487 602 HB2 ALA 81 2HB ALA 81 -5.027 -3.965 10.105 603 HB3 ALA 81 3HB ALA 81 -4.581 -4.703 11.642 604 H PHE 82 HN PHE 82 -7.087 -5.892 13.059 605 HA PHE 82 HA PHE 82 -7.491 -7.819 11.016 606 HB2 PHE 82 2HB PHE 82 -7.956 -7.801 13.981 607 HB3 PHE 82 1HB PHE 82 -8.512 -9.150 12.996 608 HD1 PHE 82 2HD PHE 82 -6.752 -10.254 11.468 609 HD2 PHE 82 1HD PHE 82 -5.793 -7.799 14.811 610 HE1 PHE 82 2HE PHE 82 -4.519 -11.275 11.571 611 HE2 PHE 82 1HE PHE 82 -3.557 -8.821 14.921 612 HZ PHE 82 HZ PHE 82 -2.919 -10.565 13.296 613 H GLU 83 HN GLU 83 -9.522 -5.393 12.220 614 HA GLU 83 HA GLU 83 -12.009 -6.768 11.761 615 HB2 GLU 83 2HB GLU 83 -11.456 -3.825 12.116 616 HB3 GLU 83 1HB GLU 83 -13.034 -4.586 12.152 617 HG2 GLU 83 2HG GLU 83 -12.322 -5.890 14.109 618 HG3 GLU 83 1HG GLU 83 -10.797 -5.010 14.100 619 H ALA 84 HN ALA 84 -9.765 -4.949 9.914 620 HA ALA 84 HA ALA 84 -11.711 -4.178 7.907 621 HB1 ALA 84 1HB ALA 84 -8.747 -3.640 8.038 622 HB2 ALA 84 2HB ALA 84 -10.021 -2.548 8.583 623 HB3 ALA 84 3HB ALA 84 -9.877 -2.951 6.872 624 H GLU 85 HN GLU 85 -11.795 -4.931 5.868 625 HA GLU 85 HA GLU 85 -10.382 -7.414 5.296 626 HB2 GLU 85 2HB GLU 85 -12.828 -7.087 4.788 627 HB3 GLU 85 1HB GLU 85 -12.356 -5.943 3.544 628 HG2 GLU 85 2HG GLU 85 -11.168 -7.666 2.344 629 HG3 GLU 85 1HG GLU 85 -11.509 -8.828 3.625 630 H TYR 86 HN TYR 86 -10.488 -4.088 4.290 631 HA TYR 86 HA TYR 86 -8.340 -4.556 2.330 632 HB2 TYR 86 2HB TYR 86 -10.260 -2.241 2.684 633 HB3 TYR 86 1HB TYR 86 -8.909 -2.216 1.560 634 HD1 TYR 86 2HD TYR 86 -11.845 -4.398 2.386 635 HD2 TYR 86 1HD TYR 86 -9.364 -2.718 -0.630 636 HE1 TYR 86 2HE TYR 86 -13.269 -5.408 0.656 637 HE2 TYR 86 1HE TYR 86 -10.780 -3.720 -2.367 638 HH TYR 86 HH TYR 86 -13.823 -4.928 -1.787 639 H LEU 87 HN LEU 87 -6.419 -4.408 3.352 640 HA LEU 87 HA LEU 87 -6.034 -2.169 5.227 641 HB2 LEU 87 2HB LEU 87 -4.617 -4.811 4.970 642 HB3 LEU 87 1HB LEU 87 -3.919 -3.475 5.858 643 HG LEU 87 HG LEU 87 -4.922 -4.891 7.453 644 HD11 LEU 87 1HD1 LEU 87 -6.770 -2.572 6.923 645 HD12 LEU 87 2HD1 LEU 87 -5.295 -2.546 7.890 646 HD13 LEU 87 3HD1 LEU 87 -6.687 -3.486 8.428 647 HD21 LEU 87 3HD2 LEU 87 -7.251 -5.616 7.358 648 HD22 LEU 87 1HD2 LEU 87 -6.338 -6.192 5.963 649 HD23 LEU 87 2HD2 LEU 87 -7.435 -4.823 5.793 650 H ALA 88 HN ALA 88 -4.588 -0.621 4.801 651 HA ALA 88 HA ALA 88 -2.765 -1.026 2.521 652 HB1 ALA 88 1HB ALA 88 -4.587 0.471 1.869 653 HB2 ALA 88 2HB ALA 88 -3.050 1.336 1.933 654 HB3 ALA 88 3HB ALA 88 -4.223 1.520 3.238 655 H VAL 89 HN VAL 89 -0.680 -0.751 3.026 656 HA VAL 89 HA VAL 89 -0.060 0.666 5.541 657 HB VAL 89 HB VAL 89 1.466 -1.689 4.403 658 HG11 VAL 89 1HG1 VAL 89 2.599 -1.690 6.576 659 HG12 VAL 89 2HG1 VAL 89 1.698 -0.249 7.043 660 HG13 VAL 89 3HG1 VAL 89 2.853 -0.175 5.711 661 HG21 VAL 89 3HG2 VAL 89 0.525 -2.988 6.268 662 HG22 VAL 89 1HG2 VAL 89 -0.737 -2.402 5.182 663 HG23 VAL 89 2HG2 VAL 89 -0.461 -1.600 6.728 664 H ASP 90 HN ASP 90 0.965 2.502 5.143 665 HA ASP 90 HA ASP 90 2.498 2.832 2.685 666 HB2 ASP 90 2HB ASP 90 0.893 4.596 3.434 667 HB3 ASP 90 1HB ASP 90 1.897 4.860 4.852 668 H GLN 91 HN GLN 91 4.601 2.508 2.630 669 HA GLN 91 HA GLN 91 6.776 2.265 3.215 670 HB2 GLN 91 2HB GLN 91 5.925 4.200 5.364 671 HB3 GLN 91 1HB GLN 91 7.589 3.671 5.166 672 HG2 GLN 91 2HG GLN 91 7.708 4.637 2.985 673 HG3 GLN 91 1HG GLN 91 5.980 4.992 2.998 674 HE21 GLN 91 1HE2 GLN 91 5.208 6.708 4.158 675 HE22 GLN 91 2HE2 GLN 91 6.253 7.939 4.807 676 H VAL 92 HN VAL 92 5.554 0.106 3.719 677 HA VAL 92 HA VAL 92 5.115 -0.792 6.321 678 HB VAL 92 HB VAL 92 4.308 -1.952 4.317 679 HG11 VAL 92 1HG1 VAL 92 6.245 -1.723 2.888 680 HG12 VAL 92 2HG1 VAL 92 5.783 -3.419 3.036 681 HG13 VAL 92 3HG1 VAL 92 7.170 -2.802 3.934 682 HG21 VAL 92 3HG2 VAL 92 4.340 -3.196 6.388 683 HG22 VAL 92 1HG2 VAL 92 6.015 -3.675 6.111 684 HG23 VAL 92 2HG2 VAL 92 4.740 -4.268 5.045 685 H GLU 93 HN GLU 93 8.114 -0.381 4.638 686 HA GLU 93 HA GLU 93 9.766 -2.137 6.054 687 HB2 GLU 93 2HB GLU 93 10.589 -1.041 4.090 688 HB3 GLU 93 1HB GLU 93 10.324 0.548 4.795 689 HG2 GLU 93 2HG GLU 93 12.032 -0.025 6.522 690 HG3 GLU 93 1HG GLU 93 12.380 -1.486 5.603 691 H LYS 94 HN LYS 94 8.244 0.783 7.054 692 HA LYS 94 HA LYS 94 10.191 1.313 9.144 693 HB2 LYS 94 2HB LYS 94 8.056 2.823 7.812 694 HB3 LYS 94 1HB LYS 94 8.208 3.146 9.532 695 HG2 LYS 94 2HG LYS 94 9.524 4.714 8.224 696 HG3 LYS 94 1HG LYS 94 10.555 3.711 9.241 697 HD2 LYS 94 2HD LYS 94 11.599 3.900 7.106 698 HD3 LYS 94 1HD LYS 94 10.975 2.260 7.251 699 HE2 LYS 94 2HE LYS 94 9.120 2.757 5.839 700 HE3 LYS 94 1HE LYS 94 9.496 4.478 5.853 701 HZ1 LYS 94 3HZ LYS 94 11.446 4.096 4.581 702 HZ2 LYS 94 1HZ LYS 94 10.185 3.289 3.797 703 HZ3 LYS 94 2HZ LYS 94 11.313 2.413 4.720 704 H LEU 95 HN LEU 95 8.129 -1.015 9.102 705 HA LEU 95 HA LEU 95 6.698 -0.548 11.561 706 HB2 LEU 95 2HB LEU 95 7.174 -3.032 9.922 707 HB3 LEU 95 1HB LEU 95 6.253 -3.029 11.412 708 HG LEU 95 HG LEU 95 5.550 -1.538 8.880 709 HD11 LEU 95 1HD1 LEU 95 4.257 -3.903 10.235 710 HD12 LEU 95 2HD1 LEU 95 5.178 -3.940 8.731 711 HD13 LEU 95 3HD1 LEU 95 3.647 -3.068 8.806 712 HD21 LEU 95 3HD2 LEU 95 3.480 -0.942 10.047 713 HD22 LEU 95 1HD2 LEU 95 4.896 -0.265 10.849 714 HD23 LEU 95 2HD2 LEU 95 4.099 -1.687 11.523 715 H GLY 96 HN GLY 96 7.111 -1.636 13.564 716 HA2 GLY 96 2HA GLY 96 9.984 -1.923 14.010 717 HA3 GLY 96 1HA GLY 96 8.768 -1.644 15.243 718 H ASN 97 HN ASN 97 8.703 -3.293 16.600 719 HA ASN 97 HA ASN 97 9.626 -5.903 15.712 720 HB2 ASN 97 2HB ASN 97 8.883 -4.964 18.489 721 HB3 ASN 97 1HB ASN 97 9.655 -6.494 18.092 722 HD21 ASN 97 1HD2 ASN 97 11.828 -6.491 17.433 723 HD22 ASN 97 2HD2 ASN 97 12.868 -5.139 17.748 724 H GLU 98 HN GLU 98 6.974 -4.918 17.877 725 HA GLU 98 HA GLU 98 5.640 -7.403 17.572 726 HB2 GLU 98 2HB GLU 98 4.611 -4.794 18.696 727 HB3 GLU 98 1HB GLU 98 3.862 -6.371 18.912 728 HG2 GLU 98 2HG GLU 98 5.821 -7.148 20.129 729 HG3 GLU 98 1HG GLU 98 6.600 -5.584 19.891 730 H GLU 99 HN GLU 99 5.289 -4.248 16.124 731 HA GLU 99 HA GLU 99 2.854 -4.601 14.801 732 HB2 GLU 99 2HB GLU 99 5.208 -3.046 13.725 733 HB3 GLU 99 1HB GLU 99 3.506 -2.777 13.381 734 HG2 GLU 99 2HG GLU 99 4.002 -1.085 14.865 735 HG3 GLU 99 1HG GLU 99 3.308 -2.321 15.915 736 H GLN 100 HN GLN 100 6.126 -5.543 13.918 737 HA GLN 100 HA GLN 100 5.552 -6.347 11.274 738 HB2 GLN 100 2HB GLN 100 7.825 -5.866 12.084 739 HB3 GLN 100 1HB GLN 100 7.740 -7.258 13.153 740 HG2 GLN 100 2HG GLN 100 7.622 -8.746 11.256 741 HG3 GLN 100 1HG GLN 100 7.601 -7.373 10.154 742 HE21 GLN 100 1HE2 GLN 100 9.578 -7.417 13.018 743 HE22 GLN 100 2HE2 GLN 100 11.102 -7.574 12.213 744 H ALA 101 HN ALA 101 5.701 -8.097 14.354 745 HA ALA 101 HA ALA 101 5.051 -10.646 13.316 746 HB1 ALA 101 1HB ALA 101 4.558 -11.251 15.628 747 HB2 ALA 101 2HB ALA 101 4.570 -9.548 16.088 748 HB3 ALA 101 3HB ALA 101 6.054 -10.322 15.531 749 H LEU 102 HN LEU 102 3.125 -7.954 14.482 750 HA LEU 102 HA LEU 102 0.591 -9.201 14.412 751 HB2 LEU 102 2HB LEU 102 1.373 -6.930 15.420 752 HB3 LEU 102 1HB LEU 102 1.055 -6.287 13.824 753 HG LEU 102 HG LEU 102 -0.782 -5.905 15.434 754 HD11 LEU 102 1HD1 LEU 102 -1.499 -7.689 13.118 755 HD12 LEU 102 2HD1 LEU 102 -1.299 -5.936 13.071 756 HD13 LEU 102 3HD1 LEU 102 -2.621 -6.651 13.998 757 HD21 LEU 102 3HD2 LEU 102 -0.580 -7.918 16.758 758 HD22 LEU 102 1HD2 LEU 102 -1.039 -8.905 15.371 759 HD23 LEU 102 2HD2 LEU 102 -2.208 -7.796 16.087 760 H LEU 103 HN LEU 103 2.319 -7.184 12.069 761 HA LEU 103 HA LEU 103 0.523 -7.257 9.952 762 HB2 LEU 103 2HB LEU 103 2.623 -5.889 10.147 763 HB3 LEU 103 1HB LEU 103 3.541 -7.327 9.764 764 HG LEU 103 HG LEU 103 3.150 -5.641 7.894 765 HD11 LEU 103 1HD1 LEU 103 3.991 -7.891 7.479 766 HD12 LEU 103 2HD1 LEU 103 2.909 -7.361 6.192 767 HD13 LEU 103 3HD1 LEU 103 2.337 -8.502 7.407 768 HD21 LEU 103 3HD2 LEU 103 0.409 -6.898 7.919 769 HD22 LEU 103 1HD2 LEU 103 1.042 -5.813 6.684 770 HD23 LEU 103 2HD2 LEU 103 0.783 -5.224 8.326 771 H PHE 104 HN PHE 104 3.160 -9.510 10.726 772 HA PHE 104 HA PHE 104 2.824 -11.295 8.616 773 HB2 PHE 104 2HB PHE 104 4.724 -11.388 10.171 774 HB3 PHE 104 1HB PHE 104 3.653 -11.918 11.461 775 HD1 PHE 104 2HD PHE 104 5.006 -12.882 8.148 776 HD2 PHE 104 1HD PHE 104 3.132 -14.180 11.742 777 HE1 PHE 104 2HE PHE 104 5.354 -15.221 7.479 778 HE2 PHE 104 1HE PHE 104 3.480 -16.524 11.078 779 HZ PHE 104 HZ PHE 104 4.590 -17.047 8.946 780 H SER 105 HN SER 105 1.223 -11.171 11.756 781 HA SER 105 HA SER 105 -0.272 -13.524 11.525 782 HB2 SER 105 2HB SER 105 -0.922 -10.986 13.037 783 HB3 SER 105 1HB SER 105 -1.647 -12.562 13.310 784 HG SER 105 HG SER 105 1.034 -11.769 13.758 785 H ILE 106 HN ILE 106 -0.929 -10.206 10.498 786 HA ILE 106 HA ILE 106 -3.580 -10.586 9.629 787 HB ILE 106 HB ILE 106 -1.489 -8.687 8.549 788 HG12 ILE 106 2HG1 ILE 106 -3.671 -8.258 10.603 789 HG13 ILE 106 1HG1 ILE 106 -1.955 -8.410 10.959 790 HG21 ILE 106 1HG2 ILE 106 -4.488 -8.653 8.233 791 HG22 ILE 106 2HG2 ILE 106 -3.304 -8.971 6.963 792 HG23 ILE 106 3HG2 ILE 106 -3.388 -7.376 7.711 793 HD11 ILE 106 3HD1 ILE 106 -2.705 -6.087 10.987 794 HD12 ILE 106 1HD1 ILE 106 -3.192 -6.230 9.299 795 HD13 ILE 106 2HD1 ILE 106 -1.489 -6.371 9.739 796 H PHE 107 HN PHE 107 -0.491 -10.808 7.899 797 HA PHE 107 HA PHE 107 -1.505 -11.549 5.393 798 HB2 PHE 107 2HB PHE 107 1.132 -11.836 6.768 799 HB3 PHE 107 1HB PHE 107 0.860 -12.718 5.272 800 HD1 PHE 107 1HD PHE 107 -0.466 -9.352 6.089 801 HD2 PHE 107 2HD PHE 107 2.366 -11.620 3.863 802 HE1 PHE 107 1HE PHE 107 0.127 -7.344 4.794 803 HE2 PHE 107 2HE PHE 107 2.963 -9.617 2.572 804 HZ PHE 107 HZ PHE 107 1.847 -7.476 3.035 805 H ASN 108 HN ASN 108 -0.356 -13.545 8.088 806 HA ASN 108 HA ASN 108 -0.699 -16.050 6.857 807 HB2 ASN 108 2HB ASN 108 0.541 -15.432 9.031 808 HB3 ASN 108 1HB ASN 108 -1.029 -15.567 9.812 809 HD21 ASN 108 1HD2 ASN 108 1.446 -17.125 10.113 810 HD22 ASN 108 2HD2 ASN 108 1.009 -18.776 9.828 811 H ARG 109 HN ARG 109 -2.886 -14.028 8.731 812 HA ARG 109 HA ARG 109 -5.029 -15.841 8.922 813 HB2 ARG 109 2HB ARG 109 -5.011 -13.932 10.346 814 HB3 ARG 109 1HB ARG 109 -4.884 -12.831 8.983 815 HG2 ARG 109 2HG ARG 109 -7.148 -13.359 8.303 816 HG3 ARG 109 1HG ARG 109 -7.281 -14.545 9.606 817 HD2 ARG 109 2HD ARG 109 -7.158 -12.869 11.267 818 HD3 ARG 109 1HD ARG 109 -6.652 -11.649 10.099 819 HE ARG 109 HE ARG 109 -8.972 -11.996 9.126 820 HH11 ARG 109 1HH1 ARG 109 -8.258 -12.536 12.514 821 HH12 ARG 109 2HH1 ARG 109 -9.831 -12.023 13.059 822 HH21 ARG 109 1HH2 ARG 109 -11.045 -11.318 9.836 823 HH22 ARG 109 2HH2 ARG 109 -11.423 -11.344 11.530 824 H PHE 110 HN PHE 110 -4.391 -13.244 6.559 825 HA PHE 110 HA PHE 110 -6.762 -13.774 5.079 826 HB2 PHE 110 2HB PHE 110 -4.306 -12.133 4.512 827 HB3 PHE 110 1HB PHE 110 -5.598 -12.307 3.329 828 HD1 PHE 110 1HD PHE 110 -7.865 -12.374 5.405 829 HD2 PHE 110 2HD PHE 110 -4.535 -9.783 4.834 830 HE1 PHE 110 1HE PHE 110 -9.109 -10.545 6.476 831 HE2 PHE 110 2HE PHE 110 -5.777 -7.953 5.910 832 HZ PHE 110 HZ PHE 110 -8.065 -8.330 6.734 833 H ARG 111 HN ARG 111 -3.358 -14.663 4.616 834 HA ARG 111 HA ARG 111 -3.721 -15.917 2.109 835 HB2 ARG 111 2HB ARG 111 -1.517 -15.232 2.871 836 HB3 ARG 111 1HB ARG 111 -1.606 -16.348 4.225 837 HG2 ARG 111 2HG ARG 111 -0.170 -17.147 2.387 838 HG3 ARG 111 1HG ARG 111 -1.506 -18.240 2.748 839 HD2 ARG 111 2HD ARG 111 -2.760 -17.355 0.856 840 HD3 ARG 111 1HD ARG 111 -1.457 -16.218 0.508 841 HE ARG 111 HE ARG 111 -0.206 -17.930 -0.407 842 HH11 ARG 111 1HH1 ARG 111 -3.062 -19.246 1.162 843 HH12 ARG 111 2HH1 ARG 111 -2.912 -20.808 0.410 844 HH21 ARG 111 1HH2 ARG 111 -0.001 -19.975 -1.394 845 HH22 ARG 111 2HH2 ARG 111 -1.151 -21.231 -1.031 846 H ASN 112 HN ASN 112 -4.302 -16.948 5.357 847 HA ASN 112 HA ASN 112 -4.363 -19.743 4.981 848 HB2 ASN 112 2HB ASN 112 -4.785 -17.972 7.094 849 HB3 ASN 112 1HB ASN 112 -6.339 -18.774 6.889 850 HD21 ASN 112 1HD2 ASN 112 -3.015 -19.128 7.750 851 HD22 ASN 112 2HD2 ASN 112 -3.133 -20.735 8.393 852 H SER 113 HN SER 113 -6.932 -17.302 4.903 853 HA SER 113 HA SER 113 -8.917 -19.204 4.078 854 HB2 SER 113 2HB SER 113 -9.058 -16.183 4.185 855 HB3 SER 113 1HB SER 113 -10.428 -17.286 4.042 856 HG SER 113 HG SER 113 -9.393 -18.206 6.104 857 H GLY 114 HN GLY 114 -7.010 -16.664 2.517 858 HA2 GLY 114 2HA GLY 114 -6.371 -16.997 0.194 859 HA3 GLY 114 1HA GLY 114 -7.957 -17.702 -0.083 860 H LYS 115 HN LYS 115 -8.698 -15.293 1.869 861 HA LYS 115 HA LYS 115 -9.153 -13.405 -0.327 862 HB2 LYS 115 2HB LYS 115 -10.973 -14.445 1.364 863 HB3 LYS 115 1HB LYS 115 -10.483 -13.045 2.306 864 HG2 LYS 115 2HG LYS 115 -10.957 -11.658 0.247 865 HG3 LYS 115 1HG LYS 115 -11.717 -13.095 -0.430 866 HD2 LYS 115 2HD LYS 115 -13.232 -13.178 1.502 867 HD3 LYS 115 1HD LYS 115 -12.492 -11.706 2.132 868 HE2 LYS 115 2HE LYS 115 -13.181 -10.528 0.061 869 HE3 LYS 115 1HE LYS 115 -14.006 -11.997 -0.462 870 HZ1 LYS 115 3HZ LYS 115 -14.626 -10.378 1.953 871 HZ2 LYS 115 1HZ LYS 115 -15.364 -11.859 1.568 872 HZ3 LYS 115 2HZ LYS 115 -15.577 -10.520 0.553 873 H GLY 116 HN GLY 116 -9.568 -11.100 1.175 874 HA2 GLY 116 2HA GLY 116 -8.494 -9.692 2.782 875 HA3 GLY 116 1HA GLY 116 -7.074 -10.723 2.675 876 H PHE 117 HN PHE 117 -7.864 -7.751 2.137 877 HA PHE 117 HA PHE 117 -6.446 -7.569 -0.438 878 HB2 PHE 117 2HB PHE 117 -8.537 -5.720 0.732 879 HB3 PHE 117 1HB PHE 117 -7.606 -5.372 -0.721 880 HD1 PHE 117 2HD PHE 117 -10.108 -7.670 0.739 881 HD2 PHE 117 1HD PHE 117 -8.211 -6.278 -2.804 882 HE1 PHE 117 2HE PHE 117 -11.774 -8.869 -0.620 883 HE2 PHE 117 1HE PHE 117 -9.872 -7.470 -4.170 884 HZ PHE 117 HZ PHE 117 -11.655 -8.769 -3.079 885 H LEU 118 HN LEU 118 -4.500 -6.728 -0.312 886 HA LEU 118 HA LEU 118 -3.854 -4.943 1.931 887 HB2 LEU 118 2HB LEU 118 -2.722 -7.542 1.281 888 HB3 LEU 118 1HB LEU 118 -1.501 -6.291 1.334 889 HG LEU 118 HG LEU 118 -1.672 -7.412 3.478 890 HD11 LEU 118 1HD1 LEU 118 -2.788 -4.617 3.624 891 HD12 LEU 118 2HD1 LEU 118 -1.086 -5.032 3.428 892 HD13 LEU 118 3HD1 LEU 118 -1.936 -5.477 4.907 893 HD21 LEU 118 3HD2 LEU 118 -3.973 -8.155 3.385 894 HD22 LEU 118 1HD2 LEU 118 -4.542 -6.488 3.467 895 HD23 LEU 118 2HD2 LEU 118 -3.707 -7.204 4.847 896 H LEU 119 HN LEU 119 -3.347 -3.047 1.110 897 HA LEU 119 HA LEU 119 -1.898 -2.910 -1.437 898 HB2 LEU 119 2HB LEU 119 -3.888 -1.456 -1.138 899 HB3 LEU 119 1HB LEU 119 -3.092 -0.680 0.218 900 HG LEU 119 HG LEU 119 -1.320 0.131 -1.304 901 HD11 LEU 119 1HD1 LEU 119 -1.643 -0.022 -3.722 902 HD12 LEU 119 2HD1 LEU 119 -3.054 -1.050 -3.469 903 HD13 LEU 119 3HD1 LEU 119 -1.454 -1.618 -2.996 904 HD21 LEU 119 3HD2 LEU 119 -3.240 1.548 -0.789 905 HD22 LEU 119 1HD2 LEU 119 -4.119 0.858 -2.153 906 HD23 LEU 119 2HD2 LEU 119 -2.668 1.820 -2.436 907 H LEU 120 HN LEU 120 0.201 -3.164 -1.161 908 HA LEU 120 HA LEU 120 1.439 -2.174 1.310 909 HB2 LEU 120 2HB LEU 120 2.443 -4.186 -0.699 910 HB3 LEU 120 1HB LEU 120 3.241 -3.751 0.800 911 HG LEU 120 HG LEU 120 0.500 -5.002 0.691 912 HD11 LEU 120 1HD1 LEU 120 3.170 -6.330 1.143 913 HD12 LEU 120 2HD1 LEU 120 2.155 -6.515 -0.289 914 HD13 LEU 120 3HD1 LEU 120 1.590 -7.100 1.276 915 HD21 LEU 120 3HD2 LEU 120 2.496 -4.639 2.923 916 HD22 LEU 120 1HD2 LEU 120 0.958 -5.493 3.051 917 HD23 LEU 120 2HD2 LEU 120 0.980 -3.759 2.727 918 H GLY 121 HN GLY 121 2.641 -0.400 1.208 919 HA2 GLY 121 2HA GLY 121 4.056 0.174 -1.320 920 HA3 GLY 121 1HA GLY 121 3.260 1.440 -0.393 921 H SER 122 HN SER 122 6.102 1.024 -1.165 922 HA SER 122 HA SER 122 7.284 2.058 1.159 923 HB2 SER 122 2HB SER 122 7.054 -0.389 1.833 924 HB3 SER 122 1HB SER 122 8.197 -0.766 0.545 925 HG SER 122 HG SER 122 9.790 0.181 1.643 926 H GLU 123 HN GLU 123 9.608 2.486 0.801 927 HA GLU 123 HA GLU 123 10.161 3.128 -1.907 928 HB2 GLU 123 2HB GLU 123 12.187 2.973 0.328 929 HB3 GLU 123 1HB GLU 123 12.289 3.930 -1.141 930 HG2 GLU 123 2HG GLU 123 11.644 5.579 0.231 931 HG3 GLU 123 1HG GLU 123 10.034 4.942 -0.105 932 H TYR 124 HN TYR 124 11.143 2.000 -3.455 933 HA TYR 124 HA TYR 124 12.238 0.375 -4.578 934 HB2 TYR 124 2HB TYR 124 13.549 -0.075 -1.894 935 HB3 TYR 124 1HB TYR 124 14.014 -0.932 -3.361 936 HD1 TYR 124 2HD TYR 124 14.987 0.326 -5.269 937 HD2 TYR 124 1HD TYR 124 14.245 2.181 -1.512 938 HE1 TYR 124 2HE TYR 124 16.469 2.181 -5.901 939 HE2 TYR 124 1HE TYR 124 15.722 4.045 -2.137 940 HH TYR 124 HH TYR 124 16.815 4.528 -5.319 941 H THR 125 HN THR 125 12.998 -2.234 -3.773 942 HA THR 125 HA THR 125 10.362 -3.430 -3.993 943 HB THR 125 HB THR 125 11.761 -5.510 -4.495 944 HG1 THR 125 1HG THR 125 13.969 -4.878 -5.183 945 HG21 THR 125 3HG2 THR 125 10.697 -4.168 -6.245 946 HG22 THR 125 1HG2 THR 125 12.271 -4.756 -6.774 947 HG23 THR 125 2HG2 THR 125 12.084 -3.078 -6.264 948 HA PRO 126 HA PRO 126 10.048 -5.157 0.036 949 HB2 PRO 126 2HB PRO 126 9.366 -7.789 -1.092 950 HB3 PRO 126 1HB PRO 126 8.387 -6.703 -0.105 951 HG2 PRO 126 2HG PRO 126 7.889 -7.083 -2.714 952 HG3 PRO 126 1HG PRO 126 7.621 -5.520 -1.920 953 HD2 PRO 126 2HD PRO 126 9.866 -6.386 -3.697 954 HD3 PRO 126 1HD PRO 126 9.035 -4.819 -3.611 955 H GLN 127 HN GLN 127 11.929 -6.892 -2.317 956 HA GLN 127 HA GLN 127 13.144 -8.664 -0.389 957 HB2 GLN 127 2HB GLN 127 13.981 -8.165 -3.253 958 HB3 GLN 127 1HB GLN 127 14.414 -9.542 -2.249 959 HG2 GLN 127 2HG GLN 127 12.001 -10.153 -2.170 960 HG3 GLN 127 1HG GLN 127 11.694 -8.871 -3.339 961 HE21 GLN 127 1HE2 GLN 127 12.493 -9.097 -5.458 962 HE22 GLN 127 2HE2 GLN 127 12.926 -10.643 -6.092 963 H GLN 128 HN GLN 128 13.484 -5.486 -1.110 964 HA GLN 128 HA GLN 128 16.367 -5.441 -0.530 965 HB2 GLN 128 2HB GLN 128 15.416 -4.353 -2.637 966 HB3 GLN 128 1HB GLN 128 14.680 -3.168 -1.571 967 HG2 GLN 128 2HG GLN 128 16.819 -2.412 -0.828 968 HG3 GLN 128 1HG GLN 128 17.634 -3.716 -1.693 969 HE21 GLN 128 1HE2 GLN 128 15.796 -3.445 -3.990 970 HE22 GLN 128 2HE2 GLN 128 16.324 -2.033 -4.837 971 H LEU 129 HN LEU 129 13.348 -5.048 0.836 972 HA LEU 129 HA LEU 129 13.866 -2.830 2.563 973 HB2 LEU 129 2HB LEU 129 11.753 -4.979 2.709 974 HB3 LEU 129 1HB LEU 129 11.782 -3.521 3.678 975 HG LEU 129 HG LEU 129 11.461 -3.643 0.681 976 HD11 LEU 129 1HD1 LEU 129 9.488 -4.404 1.908 977 HD12 LEU 129 2HD1 LEU 129 9.199 -2.855 1.116 978 HD13 LEU 129 3HD1 LEU 129 9.500 -2.914 2.852 979 HD21 LEU 129 3HD2 LEU 129 12.672 -1.648 1.326 980 HD22 LEU 129 1HD2 LEU 129 11.471 -1.291 2.568 981 HD23 LEU 129 2HD2 LEU 129 11.022 -1.226 0.865 982 H VAL 130 HN VAL 130 14.305 -2.839 4.753 983 HA VAL 130 HA VAL 130 15.714 -5.192 5.726 984 HB VAL 130 HB VAL 130 15.434 -2.495 7.065 985 HG11 VAL 130 1HG1 VAL 130 17.355 -4.766 7.554 986 HG12 VAL 130 2HG1 VAL 130 16.022 -4.283 8.605 987 HG13 VAL 130 3HG1 VAL 130 17.390 -3.198 8.355 988 HG21 VAL 130 3HG2 VAL 130 17.681 -2.016 6.206 989 HG22 VAL 130 1HG2 VAL 130 16.523 -2.252 4.896 990 HG23 VAL 130 2HG2 VAL 130 17.659 -3.535 5.311 991 H ILE 131 HN ILE 131 14.114 -6.605 6.175 992 HA ILE 131 HA ILE 131 12.630 -6.174 8.655 993 HB ILE 131 HB ILE 131 10.613 -7.320 7.616 994 HG12 ILE 131 2HG1 ILE 131 12.017 -6.545 5.041 995 HG13 ILE 131 1HG1 ILE 131 11.734 -8.190 5.610 996 HG21 ILE 131 1HG2 ILE 131 10.561 -4.966 8.139 997 HG22 ILE 131 2HG2 ILE 131 9.699 -5.269 6.629 998 HG23 ILE 131 3HG2 ILE 131 11.320 -4.577 6.596 999 HD11 ILE 131 3HD1 ILE 131 9.616 -6.195 4.843 1000 HD12 ILE 131 1HD1 ILE 131 9.330 -7.839 5.410 1001 HD13 ILE 131 2HD1 ILE 131 10.155 -7.568 3.876 1002 H ARG 132 HN ARG 132 11.426 -8.563 9.010 1003 HA ARG 132 HA ARG 132 13.447 -10.500 9.195 1004 HB2 ARG 132 2HB ARG 132 10.474 -11.020 8.911 1005 HB3 ARG 132 1HB ARG 132 11.666 -12.202 9.415 1006 HG2 ARG 132 2HG ARG 132 12.154 -10.446 11.295 1007 HG3 ARG 132 1HG ARG 132 10.516 -9.913 10.911 1008 HD2 ARG 132 2HD ARG 132 11.448 -12.555 11.975 1009 HD3 ARG 132 1HD ARG 132 10.206 -11.482 12.613 1010 HE ARG 132 HE ARG 132 9.634 -12.660 10.026 1011 HH11 ARG 132 1HH1 ARG 132 9.252 -12.902 13.501 1012 HH12 ARG 132 2HH1 ARG 132 7.905 -14.003 13.396 1013 HH21 ARG 132 1HH2 ARG 132 7.903 -14.165 9.891 1014 HH22 ARG 132 2HH2 ARG 132 7.176 -14.751 11.365 1015 H GLU 133 HN GLU 133 14.276 -11.945 7.794 1016 HA GLU 133 HA GLU 133 13.868 -11.600 5.022 1017 HB2 GLU 133 2HB GLU 133 15.932 -12.514 6.165 1018 HB3 GLU 133 1HB GLU 133 15.062 -14.027 6.361 1019 HG2 GLU 133 2HG GLU 133 14.930 -14.334 3.997 1020 HG3 GLU 133 1HG GLU 133 15.584 -12.721 3.707 1021 H ASP 134 HN ASP 134 12.586 -13.838 7.394 1022 HA ASP 134 HA ASP 134 10.989 -15.446 5.777 1023 HB2 ASP 134 2HB ASP 134 11.087 -16.041 8.051 1024 HB3 ASP 134 1HB ASP 134 10.698 -14.409 8.588 1025 H LEU 135 HN LEU 135 10.231 -12.297 7.250 1026 HA LEU 135 HA LEU 135 7.591 -12.135 6.269 1027 HB2 LEU 135 2HB LEU 135 8.571 -10.760 8.135 1028 HB3 LEU 135 1HB LEU 135 9.424 -9.825 6.923 1029 HG LEU 135 HG LEU 135 7.084 -9.355 5.931 1030 HD11 LEU 135 1HD1 LEU 135 5.881 -11.029 7.233 1031 HD12 LEU 135 2HD1 LEU 135 5.258 -9.407 7.533 1032 HD13 LEU 135 3HD1 LEU 135 6.307 -10.182 8.723 1033 HD21 LEU 135 3HD2 LEU 135 8.447 -7.653 6.990 1034 HD22 LEU 135 1HD2 LEU 135 7.913 -8.187 8.583 1035 HD23 LEU 135 2HD2 LEU 135 6.759 -7.464 7.463 1036 H ARG 136 HN ARG 136 10.692 -11.154 4.985 1037 HA ARG 136 HA ARG 136 9.908 -9.565 2.846 1038 HB2 ARG 136 2HB ARG 136 12.212 -9.724 3.498 1039 HB3 ARG 136 1HB ARG 136 12.244 -11.447 3.155 1040 HG2 ARG 136 2HG ARG 136 11.932 -10.977 0.777 1041 HG3 ARG 136 1HG ARG 136 11.922 -9.246 1.126 1042 HD2 ARG 136 2HD ARG 136 14.197 -11.127 1.737 1043 HD3 ARG 136 1HD ARG 136 14.114 -10.064 0.332 1044 HE ARG 136 HE ARG 136 13.837 -8.301 2.296 1045 HH11 ARG 136 1HH1 ARG 136 16.046 -10.992 1.996 1046 HH12 ARG 136 2HH1 ARG 136 17.313 -10.219 2.894 1047 HH21 ARG 136 1HH2 ARG 136 15.515 -7.272 3.492 1048 HH22 ARG 136 2HH2 ARG 136 17.011 -8.126 3.750 1049 H THR 137 HN THR 137 10.329 -13.113 2.948 1050 HA THR 137 HA THR 137 9.648 -13.395 0.189 1051 HB THR 137 HB THR 137 11.087 -15.040 1.389 1052 HG1 THR 137 1HG THR 137 9.556 -15.480 -0.549 1053 HG21 THR 137 3HG2 THR 137 9.861 -15.212 3.482 1054 HG22 THR 137 1HG2 THR 137 10.021 -16.796 2.726 1055 HG23 THR 137 2HG2 THR 137 8.487 -15.927 2.637 1056 H ARG 138 HN ARG 138 7.804 -13.224 3.147 1057 HA ARG 138 HA ARG 138 5.380 -14.280 2.068 1058 HB2 ARG 138 2HB ARG 138 5.542 -12.189 4.234 1059 HB3 ARG 138 1HB ARG 138 4.305 -13.416 3.997 1060 HG2 ARG 138 2HG ARG 138 7.151 -13.925 4.819 1061 HG3 ARG 138 1HG ARG 138 5.754 -13.931 5.884 1062 HD2 ARG 138 2HD ARG 138 4.853 -15.862 4.840 1063 HD3 ARG 138 1HD ARG 138 6.001 -15.751 3.505 1064 HE ARG 138 HE ARG 138 7.063 -16.156 6.200 1065 HH11 ARG 138 1HH1 ARG 138 6.293 -17.535 3.069 1066 HH12 ARG 138 2HH1 ARG 138 7.411 -18.856 3.235 1067 HH21 ARG 138 1HH2 ARG 138 8.525 -17.852 6.424 1068 HH22 ARG 138 2HH2 ARG 138 8.691 -19.038 5.152 1069 H MET 139 HN MET 139 6.828 -11.084 2.301 1070 HA MET 139 HA MET 139 4.755 -9.562 1.164 1071 HB2 MET 139 2HB MET 139 7.754 -9.147 1.061 1072 HB3 MET 139 1HB MET 139 6.560 -7.936 0.628 1073 HG2 MET 139 2HG MET 139 6.730 -9.191 3.351 1074 HG3 MET 139 1HG MET 139 7.568 -7.706 2.902 1075 HE1 MET 139 3HE MET 139 4.650 -5.244 2.186 1076 HE2 MET 139 1HE MET 139 5.554 -6.223 1.031 1077 HE3 MET 139 2HE MET 139 6.396 -5.434 2.365 1078 H ALA 140 HN ALA 140 7.206 -11.611 -0.206 1079 HA ALA 140 HA ALA 140 7.012 -10.621 -2.881 1080 HB1 ALA 140 1HB ALA 140 8.462 -12.500 -3.464 1081 HB2 ALA 140 2HB ALA 140 8.242 -13.175 -1.848 1082 HB3 ALA 140 3HB ALA 140 9.063 -11.627 -2.056 1083 H TYR 141 HN TYR 141 4.918 -12.512 -1.082 1084 HA TYR 141 HA TYR 141 4.031 -14.240 -3.208 1085 HB2 TYR 141 2HB TYR 141 2.866 -13.531 -0.516 1086 HB3 TYR 141 1HB TYR 141 2.042 -14.587 -1.653 1087 HD1 TYR 141 1HD TYR 141 3.882 -16.427 -2.661 1088 HD2 TYR 141 2HD TYR 141 3.857 -14.659 1.210 1089 HE1 TYR 141 1HE TYR 141 5.114 -18.361 -1.773 1090 HE2 TYR 141 2HE TYR 141 5.095 -16.584 2.103 1091 HH TYR 141 HH TYR 141 6.454 -19.017 0.028 1092 H CYS 142 HN CYS 142 3.661 -10.977 -2.526 1093 HA CYS 142 HA CYS 142 1.004 -10.738 -3.645 1094 HB2 CYS 142 2HB CYS 142 2.914 -8.564 -2.771 1095 HB3 CYS 142 1HB CYS 142 1.182 -8.405 -3.052 1096 HG CYS 142 HG CYS 142 2.791 -9.827 -0.424 1097 H LEU 143 HN LEU 143 0.807 -8.867 -5.260 1098 HA LEU 143 HA LEU 143 2.639 -9.381 -7.455 1099 HB2 LEU 143 2HB LEU 143 -0.028 -8.131 -7.178 1100 HB3 LEU 143 1HB LEU 143 0.995 -7.505 -8.456 1101 HG LEU 143 HG LEU 143 0.387 -10.428 -8.154 1102 HD11 LEU 143 1HD1 LEU 143 -1.279 -10.148 -9.924 1103 HD12 LEU 143 2HD1 LEU 143 -1.033 -8.402 -9.878 1104 HD13 LEU 143 3HD1 LEU 143 -1.719 -9.234 -8.482 1105 HD21 LEU 143 3HD2 LEU 143 2.359 -9.936 -9.449 1106 HD22 LEU 143 1HD2 LEU 143 1.459 -8.780 -10.429 1107 HD23 LEU 143 2HD2 LEU 143 1.068 -10.497 -10.513 1108 H VAL 144 HN VAL 144 3.430 -7.530 -8.726 1109 HA VAL 144 HA VAL 144 4.203 -5.284 -6.981 1110 HB VAL 144 HB VAL 144 6.095 -6.772 -8.818 1111 HG11 VAL 144 1HG1 VAL 144 6.599 -4.401 -8.692 1112 HG12 VAL 144 2HG1 VAL 144 7.822 -5.337 -7.832 1113 HG13 VAL 144 3HG1 VAL 144 6.576 -4.472 -6.930 1114 HG21 VAL 144 3HG2 VAL 144 5.618 -8.091 -6.839 1115 HG22 VAL 144 1HG2 VAL 144 5.962 -6.705 -5.806 1116 HG23 VAL 144 2HG2 VAL 144 7.255 -7.440 -6.754 1117 H TYR 145 HN TYR 145 3.506 -3.476 -7.887 1118 HA TYR 145 HA TYR 145 3.431 -3.297 -10.826 1119 HB2 TYR 145 2HB TYR 145 1.883 -1.772 -8.721 1120 HB3 TYR 145 1HB TYR 145 1.876 -1.347 -10.425 1121 HD1 TYR 145 2HD TYR 145 1.956 -4.510 -11.112 1122 HD2 TYR 145 1HD TYR 145 -0.571 -1.954 -8.837 1123 HE1 TYR 145 2HE TYR 145 0.074 -6.048 -11.481 1124 HE2 TYR 145 1HE TYR 145 -2.459 -3.484 -9.201 1125 HH TYR 145 HH TYR 145 -3.180 -5.193 -10.645 1126 H GLU 146 HN GLU 146 4.396 -1.591 -11.871 1127 HA GLU 146 HA GLU 146 6.161 0.085 -10.219 1128 HB2 GLU 146 2HB GLU 146 7.192 -1.357 -12.008 1129 HB3 GLU 146 1HB GLU 146 6.322 -0.399 -13.199 1130 HG2 GLU 146 2HG GLU 146 7.497 1.603 -12.440 1131 HG3 GLU 146 1HG GLU 146 8.377 0.633 -11.260 1132 H VAL 147 HN VAL 147 5.451 2.069 -9.858 1133 HA VAL 147 HA VAL 147 3.180 3.068 -11.306 1134 HB VAL 147 HB VAL 147 3.308 4.997 -9.742 1135 HG11 VAL 147 1HG1 VAL 147 2.730 3.715 -7.730 1136 HG12 VAL 147 2HG1 VAL 147 3.419 2.263 -8.458 1137 HG13 VAL 147 3HG1 VAL 147 1.997 3.022 -9.177 1138 HG21 VAL 147 3HG2 VAL 147 5.667 3.500 -8.589 1139 HG22 VAL 147 1HG2 VAL 147 4.885 4.907 -7.870 1140 HG23 VAL 147 2HG2 VAL 147 5.728 5.061 -9.412 1141 H LYS 148 HN LYS 148 6.604 3.681 -11.345 1142 HA LYS 148 HA LYS 148 7.933 5.216 -12.354 1143 HB2 LYS 148 2HB LYS 148 5.795 4.703 -14.367 1144 HB3 LYS 148 1HB LYS 148 6.946 5.995 -14.678 1145 HG2 LYS 148 2HG LYS 148 8.781 4.338 -14.372 1146 HG3 LYS 148 1HG LYS 148 7.551 3.075 -14.263 1147 HD2 LYS 148 2HD LYS 148 6.781 3.556 -16.491 1148 HD3 LYS 148 1HD LYS 148 7.841 4.960 -16.602 1149 HE2 LYS 148 2HE LYS 148 8.765 3.086 -17.843 1150 HE3 LYS 148 1HE LYS 148 9.797 3.484 -16.470 1151 HZ1 LYS 148 3HZ LYS 148 9.397 1.072 -16.807 1152 HZ2 LYS 148 1HZ LYS 148 7.763 1.326 -16.434 1153 HZ3 LYS 148 2HZ LYS 148 8.960 1.630 -15.266 1154 HA PRO 149 HA PRO 149 5.674 8.985 -11.033 1155 HB2 PRO 149 2HB PRO 149 7.814 9.489 -9.188 1156 HB3 PRO 149 1HB PRO 149 6.137 9.080 -8.825 1157 HG2 PRO 149 2HG PRO 149 8.290 7.439 -8.308 1158 HG3 PRO 149 1HG PRO 149 6.618 6.880 -8.498 1159 HD2 PRO 149 2HD PRO 149 8.872 6.839 -10.468 1160 HD3 PRO 149 1HD PRO 149 7.603 5.630 -10.178 Start of MODEL 19 1 H1 MET 1 H1 MET 1 33.751 -0.486 -0.891 2 H2 MET 1 H2 MET 1 32.249 -0.224 -1.634 3 H3 MET 1 H3 MET 1 32.322 -0.956 -0.105 4 HA MET 1 HA MET 1 33.130 1.048 0.885 5 HB2 MET 1 2HB MET 1 33.006 2.086 -1.954 6 HB3 MET 1 1HB MET 1 33.150 3.125 -0.544 7 HG2 MET 1 2HG MET 1 35.271 2.111 0.027 8 HG3 MET 1 1HG MET 1 35.119 0.987 -1.323 9 HE1 MET 1 2HE MET 1 37.576 1.719 -2.064 10 HE2 MET 1 3HE MET 1 37.658 2.893 -0.752 11 HE3 MET 1 1HE MET 1 38.040 3.387 -2.400 12 H GLY 2 HN GLY 2 31.723 3.138 1.091 13 HA2 GLY 2 2HA GLY 2 29.457 3.975 0.366 14 HA3 GLY 2 1HA GLY 2 28.922 2.322 0.623 15 H HIS 3 HN HIS 3 30.086 5.243 2.173 16 HA HIS 3 HA HIS 3 28.856 4.261 4.654 17 HB2 HIS 3 2HB HIS 3 30.478 5.730 5.914 18 HB3 HIS 3 1HB HIS 3 31.166 4.299 5.162 19 HD1 HIS 3 1HD HIS 3 32.840 4.654 3.239 20 HD2 HIS 3 2HD HIS 3 31.389 8.187 4.894 21 HE1 HIS 3 1HE HIS 3 34.362 6.474 2.403 22 HE2 HIS 3 2HE HIS 3 33.453 8.604 3.386 23 H HIS 4 HN HIS 4 27.100 5.313 3.228 24 HA HIS 4 HA HIS 4 26.770 8.073 4.228 25 HB2 HIS 4 2HB HIS 4 25.486 6.743 1.826 26 HB3 HIS 4 1HB HIS 4 25.049 8.335 2.433 27 HD1 HIS 4 1HD HIS 4 27.298 6.649 0.126 28 HD2 HIS 4 2HD HIS 4 27.248 10.259 2.203 29 HE1 HIS 4 1HE HIS 4 28.969 8.128 -1.034 30 HE2 HIS 4 2HE HIS 4 28.945 10.296 0.245 31 H HIS 5 HN HIS 5 25.533 8.028 6.027 32 HA HIS 5 HA HIS 5 23.078 6.498 5.950 33 HB2 HIS 5 2HB HIS 5 23.471 5.297 8.045 34 HB3 HIS 5 1HB HIS 5 24.646 4.841 6.823 35 HD1 HIS 5 1HD HIS 5 24.366 5.954 10.263 36 HD2 HIS 5 2HD HIS 5 27.266 6.100 7.287 37 HE1 HIS 5 1HE HIS 5 26.533 6.437 11.450 38 HE2 HIS 5 2HE HIS 5 28.299 6.310 9.649 39 H HIS 6 HN HIS 6 21.788 8.175 6.215 40 HA HIS 6 HA HIS 6 21.599 9.212 8.893 41 HB2 HIS 6 2HB HIS 6 21.529 11.571 8.304 42 HB3 HIS 6 1HB HIS 6 23.077 10.894 7.822 43 HD1 HIS 6 1HD HIS 6 20.057 12.572 6.502 44 HD2 HIS 6 2HD HIS 6 23.432 10.663 4.998 45 HE1 HIS 6 1HE HIS 6 20.176 13.219 4.076 46 HE2 HIS 6 2HE HIS 6 22.360 12.258 3.262 47 H HIS 7 HN HIS 7 19.514 9.283 9.460 48 HA HIS 7 HA HIS 7 17.489 9.586 7.401 49 HB2 HIS 7 2HB HIS 7 16.273 7.526 8.398 50 HB3 HIS 7 1HB HIS 7 17.565 7.269 7.235 51 HD1 HIS 7 1HD HIS 7 16.776 6.886 10.905 52 HD2 HIS 7 2HD HIS 7 19.765 5.893 8.185 53 HE1 HIS 7 1HE HIS 7 18.262 5.247 12.097 54 HE2 HIS 7 2HE HIS 7 19.933 4.507 10.361 55 H HIS 8 HN HIS 8 15.907 10.799 8.042 56 HA HIS 8 HA HIS 8 14.792 10.595 10.690 57 HB2 HIS 8 2HB HIS 8 16.729 12.216 10.926 58 HB3 HIS 8 1HB HIS 8 15.866 13.289 9.830 59 HD1 HIS 8 1HD HIS 8 14.093 14.769 10.830 60 HD2 HIS 8 2HD HIS 8 15.385 11.793 13.439 61 HE1 HIS 8 1HE HIS 8 13.039 15.306 13.055 62 HE2 HIS 8 2HE HIS 8 13.984 13.595 14.654 63 H SER 9 HN SER 9 12.968 9.963 9.496 64 HA SER 9 HA SER 9 11.999 11.800 7.441 65 HB2 SER 9 2HB SER 9 12.237 9.358 6.928 66 HB3 SER 9 1HB SER 9 10.969 9.032 8.108 67 HG SER 9 HG SER 9 10.297 9.238 5.839 68 H HIS 10 HN HIS 10 11.457 13.306 9.228 69 HA HIS 10 HA HIS 10 8.598 13.169 9.660 70 HB2 HIS 10 2HB HIS 10 10.545 13.277 11.968 71 HB3 HIS 10 1HB HIS 10 8.918 13.924 12.105 72 HD1 HIS 10 1HD HIS 10 10.709 11.032 12.966 73 HD2 HIS 10 2HD HIS 10 6.981 11.680 11.227 74 HE1 HIS 10 1HE HIS 10 9.414 8.901 13.312 75 HE2 HIS 10 2HE HIS 10 7.209 9.274 12.153 76 H MET 11 HN MET 11 8.033 15.041 8.720 77 HA MET 11 HA MET 11 9.203 17.520 9.597 78 HB2 MET 11 2HB MET 11 9.936 18.237 7.352 79 HB3 MET 11 1HB MET 11 10.864 16.871 7.958 80 HG2 MET 11 2HG MET 11 9.635 15.356 6.544 81 HG3 MET 11 1HG MET 11 8.580 16.660 6.004 82 HE1 MET 11 3HE MET 11 10.714 15.793 2.814 83 HE2 MET 11 1HE MET 11 9.087 15.935 3.480 84 HE3 MET 11 2HE MET 11 10.166 14.662 4.051 85 H ASP 12 HN ASP 12 6.515 16.375 9.564 86 HA ASP 12 HA ASP 12 5.236 18.678 8.333 87 HB2 ASP 12 2HB ASP 12 5.105 17.025 6.533 88 HB3 ASP 12 1HB ASP 12 4.362 15.867 7.634 89 H TYR 13 HN TYR 13 3.849 19.518 9.676 90 HA TYR 13 HA TYR 13 2.284 17.764 11.434 91 HB2 TYR 13 2HB TYR 13 4.044 20.029 12.218 92 HB3 TYR 13 1HB TYR 13 2.488 19.905 13.034 93 HD1 TYR 13 2HD TYR 13 1.950 17.894 14.356 94 HD2 TYR 13 1HD TYR 13 5.824 18.507 12.714 95 HE1 TYR 13 2HE TYR 13 2.857 16.201 15.889 96 HE2 TYR 13 1HE TYR 13 6.745 16.811 14.238 97 HH TYR 13 HH TYR 13 4.825 14.651 15.957 98 HA PRO 14 HA PRO 14 -0.806 20.295 9.329 99 HB2 PRO 14 2HB PRO 14 -2.660 18.482 10.716 100 HB3 PRO 14 1HB PRO 14 -2.470 18.777 8.985 101 HG2 PRO 14 2HG PRO 14 -1.698 16.467 10.129 102 HG3 PRO 14 1HG PRO 14 -0.826 17.177 8.758 103 HD2 PRO 14 2HD PRO 14 -0.136 17.221 11.672 104 HD3 PRO 14 1HD PRO 14 0.926 16.994 10.265 105 H SER 15 HN SER 15 -1.100 22.206 10.291 106 HA SER 15 HA SER 15 -1.971 22.244 13.103 107 HB2 SER 15 2HB SER 15 -1.104 24.613 13.075 108 HB3 SER 15 1HB SER 15 0.130 23.374 12.841 109 HG SER 15 HG SER 15 -1.155 24.682 10.678 110 H PHE 16 HN PHE 16 -4.078 22.490 13.286 111 HA PHE 16 HA PHE 16 -6.171 23.361 13.146 112 HB2 PHE 16 2HB PHE 16 -4.846 25.639 11.657 113 HB3 PHE 16 1HB PHE 16 -6.490 25.650 12.282 114 HD1 PHE 16 1HD PHE 16 -6.762 25.305 14.828 115 HD2 PHE 16 2HD PHE 16 -3.099 26.415 12.959 116 HE1 PHE 16 1HE PHE 16 -5.938 26.186 16.971 117 HE2 PHE 16 2HE PHE 16 -2.269 27.295 15.102 118 HZ PHE 16 HZ PHE 16 -3.689 27.182 17.109 119 H ASP 17 HN ASP 17 -4.868 21.742 10.968 120 HA ASP 17 HA ASP 17 -6.117 22.567 8.517 121 HB2 ASP 17 2HB ASP 17 -3.990 21.420 8.392 122 HB3 ASP 17 1HB ASP 17 -4.634 20.042 9.280 123 H LYS 18 HN LYS 18 -7.921 21.819 7.587 124 HA LYS 18 HA LYS 18 -9.798 20.638 7.149 125 HB2 LYS 18 2HB LYS 18 -8.301 18.665 7.550 126 HB3 LYS 18 1HB LYS 18 -8.860 18.645 9.213 127 HG2 LYS 18 2HG LYS 18 -10.996 17.958 8.614 128 HG3 LYS 18 1HG LYS 18 -10.793 18.475 6.939 129 HD2 LYS 18 2HD LYS 18 -9.325 16.191 8.261 130 HD3 LYS 18 1HD LYS 18 -10.688 16.030 7.151 131 HE2 LYS 18 2HE LYS 18 -9.398 17.078 5.376 132 HE3 LYS 18 1HE LYS 18 -8.048 17.329 6.478 133 HZ1 LYS 18 3HZ LYS 18 -7.783 15.397 4.995 134 HZ2 LYS 18 1HZ LYS 18 -9.123 14.661 5.727 135 HZ3 LYS 18 2HZ LYS 18 -7.725 14.974 6.638 136 H PHE 19 HN PHE 19 -11.906 20.828 7.816 137 HA PHE 19 HA PHE 19 -12.327 21.478 10.624 138 HB2 PHE 19 2HB PHE 19 -13.642 22.883 8.285 139 HB3 PHE 19 1HB PHE 19 -13.878 23.230 9.986 140 HD1 PHE 19 2HD PHE 19 -11.957 24.173 11.315 141 HD2 PHE 19 1HD PHE 19 -11.896 23.860 7.072 142 HE1 PHE 19 2HE PHE 19 -10.129 25.817 11.224 143 HE2 PHE 19 1HE PHE 19 -10.064 25.500 6.973 144 HZ PHE 19 HZ PHE 19 -9.180 26.482 9.052 145 H LEU 20 HN LEU 20 -14.945 19.449 8.224 146 HA LEU 20 HA LEU 20 -13.275 21.653 7.287 147 HB2 LEU 20 2HB LEU 20 -14.437 19.216 6.030 148 HB3 LEU 20 1HB LEU 20 -14.244 20.631 5.017 149 HG LEU 20 HG LEU 20 -12.005 19.301 6.546 150 HD11 LEU 20 1HD1 LEU 20 -12.859 17.859 4.770 151 HD12 LEU 20 2HD1 LEU 20 -11.265 18.493 4.360 152 HD13 LEU 20 3HD1 LEU 20 -12.706 19.184 3.614 153 HD21 LEU 20 3HD2 LEU 20 -11.624 21.680 6.178 154 HD22 LEU 20 1HD2 LEU 20 -11.995 21.487 4.464 155 HD23 LEU 20 2HD2 LEU 20 -10.565 20.716 5.147 156 H GLY 21 HN GLY 21 -16.565 20.608 7.674 157 HA2 GLY 21 2HA GLY 21 -18.462 21.969 7.665 158 HA3 GLY 21 1HA GLY 21 -17.511 23.253 6.932 159 H THR 22 HN THR 22 -16.847 22.878 4.646 160 HA THR 22 HA THR 22 -18.787 21.256 3.160 161 HB THR 22 HB THR 22 -18.743 23.304 1.488 162 HG1 THR 22 1HG THR 22 -17.386 24.653 2.680 163 HG21 THR 22 3HG2 THR 22 -20.438 23.261 3.987 164 HG22 THR 22 1HG2 THR 22 -20.765 22.372 2.500 165 HG23 THR 22 2HG2 THR 22 -20.817 24.136 2.504 166 H GLU 23 HN GLU 23 -18.165 21.605 0.665 167 HA GLU 23 HA GLU 23 -16.724 21.284 -1.032 168 HB2 GLU 23 2HB GLU 23 -15.395 23.147 -0.202 169 HB3 GLU 23 1HB GLU 23 -14.557 22.077 0.914 170 HG2 GLU 23 2HG GLU 23 -13.444 20.963 -0.832 171 HG3 GLU 23 1HG GLU 23 -14.507 21.653 -2.056 172 H ASN 24 HN ASN 24 -16.700 19.310 -1.663 173 HA ASN 24 HA ASN 24 -15.404 17.239 0.002 174 HB2 ASN 24 2HB ASN 24 -17.927 17.138 -0.279 175 HB3 ASN 24 1HB ASN 24 -17.654 16.846 -1.991 176 HD21 ASN 24 1HD2 ASN 24 -17.384 15.547 1.219 177 HD22 ASN 24 2HD2 ASN 24 -17.155 13.899 0.747 178 H ALA 25 HN ALA 25 -14.432 19.063 -2.180 179 HA ALA 25 HA ALA 25 -14.182 17.754 -4.632 180 HB1 ALA 25 1HB ALA 25 -13.836 20.152 -4.333 181 HB2 ALA 25 2HB ALA 25 -12.465 19.397 -5.143 182 HB3 ALA 25 3HB ALA 25 -12.353 19.828 -3.436 183 H GLU 26 HN GLU 26 -12.129 17.565 -1.747 184 HA GLU 26 HA GLU 26 -9.974 16.280 -3.058 185 HB2 GLU 26 2HB GLU 26 -10.800 16.325 -0.168 186 HB3 GLU 26 1HB GLU 26 -9.393 15.431 -0.729 187 HG2 GLU 26 2HG GLU 26 -8.710 17.709 -1.786 188 HG3 GLU 26 1HG GLU 26 -9.845 18.373 -0.615 189 H LEU 27 HN LEU 27 -12.901 15.076 -1.552 190 HA LEU 27 HA LEU 27 -12.217 12.339 -1.634 191 HB2 LEU 27 2HB LEU 27 -14.794 13.852 -1.417 192 HB3 LEU 27 1HB LEU 27 -14.796 12.116 -1.600 193 HG LEU 27 HG LEU 27 -15.032 12.623 0.716 194 HD11 LEU 27 1HD1 LEU 27 -13.679 10.687 0.236 195 HD12 LEU 27 2HD1 LEU 27 -13.061 11.506 1.670 196 HD13 LEU 27 3HD1 LEU 27 -12.232 11.689 0.124 197 HD21 LEU 27 3HD2 LEU 27 -14.123 14.895 0.696 198 HD22 LEU 27 1HD2 LEU 27 -12.495 14.243 0.499 199 HD23 LEU 27 2HD2 LEU 27 -13.401 13.921 1.977 200 H VAL 28 HN VAL 28 -13.669 14.549 -3.927 201 HA VAL 28 HA VAL 28 -14.450 12.674 -5.882 202 HB VAL 28 HB VAL 28 -13.476 15.506 -6.333 203 HG11 VAL 28 1HG1 VAL 28 -14.822 15.434 -8.362 204 HG12 VAL 28 2HG1 VAL 28 -15.239 13.753 -8.031 205 HG13 VAL 28 3HG1 VAL 28 -13.569 14.193 -8.381 206 HG21 VAL 28 3HG2 VAL 28 -15.845 16.136 -6.249 207 HG22 VAL 28 1HG2 VAL 28 -15.276 15.481 -4.713 208 HG23 VAL 28 2HG2 VAL 28 -16.258 14.485 -5.788 209 H TYR 29 HN TYR 29 -11.400 14.348 -5.262 210 HA TYR 29 HA TYR 29 -10.015 13.232 -7.490 211 HB2 TYR 29 2HB TYR 29 -9.252 15.290 -6.396 212 HB3 TYR 29 1HB TYR 29 -8.937 14.399 -4.911 213 HD1 TYR 29 1HD TYR 29 -7.941 14.557 -8.498 214 HD2 TYR 29 2HD TYR 29 -6.821 13.476 -4.537 215 HE1 TYR 29 1HE TYR 29 -5.658 14.088 -9.277 216 HE2 TYR 29 2HE TYR 29 -4.533 13.006 -5.308 217 HH TYR 29 HH TYR 29 -3.401 13.942 -8.397 218 H VAL 30 HN VAL 30 -10.566 12.239 -4.186 219 HA VAL 30 HA VAL 30 -8.699 10.120 -4.070 220 HB VAL 30 HB VAL 30 -11.281 10.560 -2.555 221 HG11 VAL 30 1HG1 VAL 30 -9.094 8.553 -2.003 222 HG12 VAL 30 2HG1 VAL 30 -10.730 8.179 -2.548 223 HG13 VAL 30 3HG1 VAL 30 -10.471 8.892 -0.956 224 HG21 VAL 30 3HG2 VAL 30 -9.563 12.246 -2.162 225 HG22 VAL 30 1HG2 VAL 30 -8.397 10.982 -1.777 226 HG23 VAL 30 2HG2 VAL 30 -9.794 11.237 -0.733 227 H LEU 31 HN LEU 31 -11.999 10.328 -5.278 228 HA LEU 31 HA LEU 31 -12.495 7.571 -5.556 229 HB2 LEU 31 2HB LEU 31 -13.551 9.895 -7.169 230 HB3 LEU 31 1HB LEU 31 -14.178 8.261 -7.251 231 HG LEU 31 HG LEU 31 -14.213 10.017 -4.794 232 HD11 LEU 31 1HD1 LEU 31 -16.429 9.198 -6.667 233 HD12 LEU 31 2HD1 LEU 31 -15.751 10.817 -6.497 234 HD13 LEU 31 3HD1 LEU 31 -16.636 10.085 -5.158 235 HD21 LEU 31 3HD2 LEU 31 -15.392 7.286 -5.293 236 HD22 LEU 31 1HD2 LEU 31 -15.645 8.268 -3.848 237 HD23 LEU 31 2HD2 LEU 31 -14.035 7.658 -4.231 238 H ARG 32 HN ARG 32 -11.085 6.277 -6.550 239 HA ARG 32 HA ARG 32 -10.487 6.764 -9.365 240 HB2 ARG 32 2HB ARG 32 -8.623 7.682 -7.842 241 HB3 ARG 32 1HB ARG 32 -8.276 6.005 -7.457 242 HG2 ARG 32 2HG ARG 32 -7.776 5.542 -9.782 243 HG3 ARG 32 1HG ARG 32 -8.209 7.194 -10.222 244 HD2 ARG 32 2HD ARG 32 -6.395 8.025 -8.768 245 HD3 ARG 32 1HD ARG 32 -5.939 6.358 -8.421 246 HE ARG 32 HE ARG 32 -5.968 6.676 -11.194 247 HH11 ARG 32 1HH1 ARG 32 -4.142 7.824 -8.432 248 HH12 ARG 32 2HH1 ARG 32 -2.693 8.089 -9.346 249 HH21 ARG 32 1HH2 ARG 32 -4.061 7.027 -12.386 250 HH22 ARG 32 2HH2 ARG 32 -2.643 7.640 -11.585 251 H HIS 33 HN HIS 33 -9.234 4.715 -10.200 252 HA HIS 33 HA HIS 33 -10.953 2.493 -9.616 253 HB2 HIS 33 2HB HIS 33 -10.196 3.086 -11.911 254 HB3 HIS 33 1HB HIS 33 -8.557 2.625 -11.464 255 HD1 HIS 33 1HD HIS 33 -8.034 0.440 -12.484 256 HD2 HIS 33 2HD HIS 33 -11.983 0.630 -11.190 257 HE1 HIS 33 1HE HIS 33 -9.023 -1.822 -12.975 258 HE2 HIS 33 2HE HIS 33 -11.452 -1.620 -12.340 259 H LYS 34 HN LYS 34 -10.544 0.695 -8.459 260 HA LYS 34 HA LYS 34 -8.236 0.713 -6.741 261 HB2 LYS 34 2HB LYS 34 -9.294 -1.369 -5.780 262 HB3 LYS 34 1HB LYS 34 -10.273 0.085 -5.709 263 HG2 LYS 34 2HG LYS 34 -11.735 -1.647 -6.309 264 HG3 LYS 34 1HG LYS 34 -11.441 -0.746 -7.791 265 HD2 LYS 34 2HD LYS 34 -9.859 -2.430 -8.537 266 HD3 LYS 34 1HD LYS 34 -10.052 -3.312 -7.022 267 HE2 LYS 34 2HE LYS 34 -12.314 -2.760 -8.935 268 HE3 LYS 34 1HE LYS 34 -11.348 -4.234 -8.964 269 HZ1 LYS 34 3HZ LYS 34 -12.772 -3.332 -6.526 270 HZ2 LYS 34 1HZ LYS 34 -12.146 -4.869 -6.869 271 HZ3 LYS 34 2HZ LYS 34 -13.519 -4.311 -7.692 272 H HIS 35 HN HIS 35 -7.446 -1.749 -6.269 273 HA HIS 35 HA HIS 35 -6.646 -2.958 -8.818 274 HB2 HIS 35 2HB HIS 35 -4.857 -1.908 -6.663 275 HB3 HIS 35 1HB HIS 35 -4.361 -3.353 -7.540 276 HD1 HIS 35 1HD HIS 35 -3.743 -3.078 -10.030 277 HD2 HIS 35 2HD HIS 35 -4.754 0.482 -8.127 278 HE1 HIS 35 1HE HIS 35 -2.995 -1.242 -11.583 279 HE2 HIS 35 2HE HIS 35 -3.412 0.893 -10.308 280 H GLY 36 HN GLY 36 -5.034 -4.974 -7.831 281 HA2 GLY 36 2HA GLY 36 -7.042 -6.829 -7.035 282 HA3 GLY 36 1HA GLY 36 -5.342 -7.182 -7.282 283 H GLN 37 HN GLN 37 -5.699 -8.628 -5.442 284 HA GLN 37 HA GLN 37 -6.466 -7.585 -2.902 285 HB2 GLN 37 2HB GLN 37 -5.125 -10.217 -3.542 286 HB3 GLN 37 1HB GLN 37 -5.929 -9.803 -2.033 287 HG2 GLN 37 2HG GLN 37 -8.043 -9.541 -3.290 288 HG3 GLN 37 1HG GLN 37 -7.207 -10.097 -4.738 289 HE21 GLN 37 1HE2 GLN 37 -6.656 -11.347 -1.494 290 HE22 GLN 37 2HE2 GLN 37 -7.300 -12.925 -1.804 291 H PHE 38 HN PHE 38 -3.411 -9.248 -3.700 292 HA PHE 38 HA PHE 38 -2.108 -7.581 -1.668 293 HB2 PHE 38 2HB PHE 38 -1.096 -10.086 -3.033 294 HB3 PHE 38 1HB PHE 38 -0.306 -9.240 -1.707 295 HD1 PHE 38 2HD PHE 38 -1.627 -9.036 0.492 296 HD2 PHE 38 1HD PHE 38 -2.583 -11.801 -2.597 297 HE1 PHE 38 2HE PHE 38 -2.878 -10.403 2.111 298 HE2 PHE 38 1HE PHE 38 -3.840 -13.173 -0.987 299 HZ PHE 38 HZ PHE 38 -3.987 -12.474 1.374 300 H ILE 39 HN ILE 39 -1.433 -5.724 -2.566 301 HA ILE 39 HA ILE 39 -0.006 -5.884 -5.148 302 HB ILE 39 HB ILE 39 -1.720 -3.589 -4.180 303 HG12 ILE 39 2HG1 ILE 39 -3.123 -5.487 -4.796 304 HG13 ILE 39 1HG1 ILE 39 -3.258 -4.217 -6.008 305 HG21 ILE 39 1HG2 ILE 39 -0.318 -4.021 -6.810 306 HG22 ILE 39 2HG2 ILE 39 0.128 -2.850 -5.568 307 HG23 ILE 39 3HG2 ILE 39 -1.402 -2.683 -6.430 308 HD11 ILE 39 3HD1 ILE 39 -3.149 -6.452 -6.993 309 HD12 ILE 39 1HD1 ILE 39 -1.562 -6.690 -6.262 310 HD13 ILE 39 2HD1 ILE 39 -1.793 -5.443 -7.487 311 H TYR 40 HN TYR 40 2.003 -5.148 -5.139 312 HA TYR 40 HA TYR 40 2.842 -3.310 -2.989 313 HB2 TYR 40 2HB TYR 40 3.894 -5.625 -3.039 314 HB3 TYR 40 1HB TYR 40 4.626 -5.171 -4.574 315 HD1 TYR 40 1HD TYR 40 4.560 -4.479 -0.958 316 HD2 TYR 40 2HD TYR 40 6.558 -3.739 -4.646 317 HE1 TYR 40 1HE TYR 40 6.454 -3.509 0.269 318 HE2 TYR 40 2HE TYR 40 8.459 -2.762 -3.425 319 HH TYR 40 HH TYR 40 9.039 -1.841 -1.334 320 H VAL 41 HN VAL 41 3.517 -1.355 -3.621 321 HA VAL 41 HA VAL 41 4.095 -0.958 -6.481 322 HB VAL 41 HB VAL 41 3.052 1.343 -6.170 323 HG11 VAL 41 1HG1 VAL 41 1.955 -0.387 -7.461 324 HG12 VAL 41 2HG1 VAL 41 0.759 0.492 -6.505 325 HG13 VAL 41 3HG1 VAL 41 1.298 -1.106 -5.991 326 HG21 VAL 41 3HG2 VAL 41 1.391 1.568 -4.398 327 HG22 VAL 41 1HG2 VAL 41 3.003 1.333 -3.722 328 HG23 VAL 41 2HG2 VAL 41 1.855 -0.005 -3.749 329 H TRP 42 HN TRP 42 5.784 0.338 -6.997 330 HA TRP 42 HA TRP 42 7.060 1.944 -4.930 331 HB2 TRP 42 2HB TRP 42 9.237 0.950 -5.189 332 HB3 TRP 42 1HB TRP 42 8.100 -0.339 -4.811 333 HD1 TRP 42 1HD TRP 42 7.164 -1.667 -7.186 334 HE1 TRP 42 1HE TRP 42 8.606 -2.469 -9.162 335 HE3 TRP 42 3HE TRP 42 11.274 1.279 -6.443 336 HZ2 TRP 42 2HZ TRP 42 11.156 -1.929 -10.258 337 HZ3 TRP 42 3HZ TRP 42 13.173 1.073 -7.993 338 HH2 TRP 42 2HH TRP 42 13.117 -0.497 -9.859 339 H GLY 43 HN GLY 43 8.374 3.602 -5.746 340 HA2 GLY 43 2HA GLY 43 9.550 4.216 -7.972 341 HA3 GLY 43 1HA GLY 43 7.907 4.149 -8.592 342 H GLU 44 HN GLU 44 9.050 6.426 -9.026 343 HA GLU 44 HA GLU 44 8.867 8.322 -6.915 344 HB2 GLU 44 2HB GLU 44 9.000 8.706 -9.913 345 HB3 GLU 44 1HB GLU 44 9.157 9.995 -8.728 346 HG2 GLU 44 2HG GLU 44 11.344 9.530 -9.266 347 HG3 GLU 44 1HG GLU 44 11.106 8.602 -7.791 348 H GLU 45 HN GLU 45 6.961 8.503 -5.990 349 HA GLU 45 HA GLU 45 4.764 8.808 -5.592 350 HB2 GLU 45 2HB GLU 45 3.805 10.833 -6.422 351 HB3 GLU 45 1HB GLU 45 5.515 11.105 -6.137 352 HG2 GLU 45 2HG GLU 45 5.979 11.398 -8.356 353 HG3 GLU 45 1HG GLU 45 4.635 10.382 -8.886 354 H GLY 46 HN GLY 46 2.730 9.764 -7.486 355 HA2 GLY 46 2HA GLY 46 1.096 8.852 -8.802 356 HA3 GLY 46 1HA GLY 46 2.345 7.842 -9.517 357 H ALA 47 HN ALA 47 2.699 5.799 -8.747 358 HA ALA 47 HA ALA 47 0.588 4.714 -7.035 359 HB1 ALA 47 1HB ALA 47 2.617 3.266 -8.740 360 HB2 ALA 47 2HB ALA 47 0.964 3.646 -9.223 361 HB3 ALA 47 3HB ALA 47 1.257 2.536 -7.885 362 H GLY 48 HN GLY 48 3.969 5.444 -7.091 363 HA2 GLY 48 2HA GLY 48 4.676 3.468 -5.090 364 HA3 GLY 48 1HA GLY 48 5.761 4.612 -5.858 365 H LYS 49 HN LYS 49 2.861 5.858 -4.477 366 HA LYS 49 HA LYS 49 4.115 6.392 -1.915 367 HB2 LYS 49 2HB LYS 49 3.264 8.584 -3.811 368 HB3 LYS 49 1HB LYS 49 3.397 8.840 -2.076 369 HG2 LYS 49 2HG LYS 49 5.783 8.157 -2.209 370 HG3 LYS 49 1HG LYS 49 5.616 8.063 -3.964 371 HD2 LYS 49 2HD LYS 49 5.000 10.435 -4.025 372 HD3 LYS 49 1HD LYS 49 5.177 10.525 -2.272 373 HE2 LYS 49 2HE LYS 49 7.378 9.820 -4.212 374 HE3 LYS 49 1HE LYS 49 7.139 11.410 -3.492 375 HZ1 LYS 49 3HZ LYS 49 7.874 8.889 -2.098 376 HZ2 LYS 49 1HZ LYS 49 7.415 10.306 -1.284 377 HZ3 LYS 49 2HZ LYS 49 8.799 10.294 -2.254 378 H SER 50 HN SER 50 2.337 8.017 -0.753 379 HA SER 50 HA SER 50 0.285 6.158 -0.162 380 HB2 SER 50 2HB SER 50 0.122 8.950 0.841 381 HB3 SER 50 1HB SER 50 -0.003 7.425 1.722 382 HG SER 50 HG SER 50 2.219 7.201 1.660 383 H HIS 51 HN HIS 51 0.205 7.605 -2.888 384 HA HIS 51 HA HIS 51 -2.129 9.260 -2.803 385 HB2 HIS 51 2HB HIS 51 -0.557 8.057 -5.076 386 HB3 HIS 51 1HB HIS 51 -2.017 9.005 -5.340 387 HD1 HIS 51 1HD HIS 51 -1.909 11.543 -4.524 388 HD2 HIS 51 2HD HIS 51 1.726 9.522 -4.683 389 HE1 HIS 51 1HE HIS 51 -0.136 13.326 -4.481 390 HE2 HIS 51 2HE HIS 51 2.052 12.093 -4.689 391 H LEU 52 HN LEU 52 -1.525 6.044 -4.235 392 HA LEU 52 HA LEU 52 -4.279 5.580 -4.785 393 HB2 LEU 52 2HB LEU 52 -1.928 3.697 -4.654 394 HB3 LEU 52 1HB LEU 52 -3.530 3.223 -5.179 395 HG LEU 52 HG LEU 52 -1.743 5.237 -6.544 396 HD11 LEU 52 1HD1 LEU 52 -2.621 2.466 -7.350 397 HD12 LEU 52 2HD1 LEU 52 -1.002 2.931 -6.825 398 HD13 LEU 52 3HD1 LEU 52 -1.657 3.571 -8.333 399 HD21 LEU 52 3HD2 LEU 52 -4.485 4.223 -7.287 400 HD22 LEU 52 1HD2 LEU 52 -3.463 5.246 -8.296 401 HD23 LEU 52 2HD2 LEU 52 -4.084 5.858 -6.763 402 H LEU 53 HN LEU 53 -2.257 5.130 -2.059 403 HA LEU 53 HA LEU 53 -3.386 2.972 -0.751 404 HB2 LEU 53 2HB LEU 53 -1.345 4.580 -0.233 405 HB3 LEU 53 1HB LEU 53 -2.515 5.336 0.830 406 HG LEU 53 HG LEU 53 -2.875 3.046 1.858 407 HD11 LEU 53 1HD1 LEU 53 -0.319 2.466 0.368 408 HD12 LEU 53 2HD1 LEU 53 -1.892 1.740 0.038 409 HD13 LEU 53 3HD1 LEU 53 -1.082 1.428 1.573 410 HD21 LEU 53 3HD2 LEU 53 -0.148 4.293 2.078 411 HD22 LEU 53 1HD2 LEU 53 -0.911 3.242 3.270 412 HD23 LEU 53 2HD2 LEU 53 -1.597 4.832 2.929 413 H GLN 54 HN GLN 54 -4.217 6.412 -0.384 414 HA GLN 54 HA GLN 54 -6.356 5.874 1.436 415 HB2 GLN 54 2HB GLN 54 -6.857 8.292 1.179 416 HB3 GLN 54 1HB GLN 54 -5.191 7.958 1.607 417 HG2 GLN 54 2HG GLN 54 -4.497 8.319 -0.691 418 HG3 GLN 54 1HG GLN 54 -6.172 8.617 -1.155 419 HE21 GLN 54 1HE2 GLN 54 -3.400 9.857 0.533 420 HE22 GLN 54 2HE2 GLN 54 -3.957 11.494 0.669 421 H ALA 55 HN ALA 55 -6.106 6.644 -1.968 422 HA ALA 55 HA ALA 55 -8.787 7.003 -2.618 423 HB1 ALA 55 1HB ALA 55 -6.601 5.788 -4.310 424 HB2 ALA 55 2HB ALA 55 -6.958 7.509 -4.153 425 HB3 ALA 55 3HB ALA 55 -8.130 6.428 -4.909 426 H TRP 56 HN TRP 56 -6.860 4.062 -2.512 427 HA TRP 56 HA TRP 56 -8.783 2.294 -3.560 428 HB2 TRP 56 2HB TRP 56 -6.396 1.811 -3.498 429 HB3 TRP 56 1HB TRP 56 -6.411 1.830 -1.742 430 HD1 TRP 56 1HD TRP 56 -8.045 -0.233 -4.599 431 HE1 TRP 56 1HE TRP 56 -8.154 -2.686 -3.812 432 HE3 TRP 56 3HE TRP 56 -6.188 0.355 0.118 433 HZ2 TRP 56 2HZ TRP 56 -7.526 -4.163 -1.500 434 HZ3 TRP 56 3HZ TRP 56 -5.965 -1.628 1.557 435 HH2 TRP 56 2HH TRP 56 -6.623 -3.842 0.764 436 H VAL 57 HN VAL 57 -7.999 3.267 -0.256 437 HA VAL 57 HA VAL 57 -9.657 1.360 1.022 438 HB VAL 57 HB VAL 57 -8.466 3.953 2.007 439 HG11 VAL 57 1HG1 VAL 57 -10.516 3.509 3.270 440 HG12 VAL 57 2HG1 VAL 57 -9.083 3.262 4.268 441 HG13 VAL 57 3HG1 VAL 57 -9.952 1.874 3.613 442 HG21 VAL 57 3HG2 VAL 57 -6.851 2.240 1.553 443 HG22 VAL 57 1HG2 VAL 57 -7.801 1.050 2.440 444 HG23 VAL 57 2HG2 VAL 57 -7.041 2.386 3.300 445 H ALA 58 HN ALA 58 -10.179 4.783 0.184 446 HA ALA 58 HA ALA 58 -12.704 5.007 1.427 447 HB1 ALA 58 1HB ALA 58 -11.640 6.558 -0.932 448 HB2 ALA 58 2HB ALA 58 -11.359 6.946 0.765 449 HB3 ALA 58 3HB ALA 58 -12.991 7.027 0.101 450 H GLN 59 HN GLN 59 -11.749 3.972 -1.801 451 HA GLN 59 HA GLN 59 -14.302 3.832 -2.969 452 HB2 GLN 59 2HB GLN 59 -12.054 3.612 -4.128 453 HB3 GLN 59 1HB GLN 59 -11.971 1.973 -3.504 454 HG2 GLN 59 2HG GLN 59 -14.254 2.908 -5.210 455 HG3 GLN 59 1HG GLN 59 -12.754 2.302 -5.905 456 HE21 GLN 59 1HE2 GLN 59 -15.454 1.248 -6.101 457 HE22 GLN 59 2HE2 GLN 59 -15.385 -0.369 -5.490 458 H ALA 60 HN ALA 60 -12.391 1.423 -1.205 459 HA ALA 60 HA ALA 60 -14.279 -0.666 -1.353 460 HB1 ALA 60 1HB ALA 60 -12.111 -0.240 0.697 461 HB2 ALA 60 2HB ALA 60 -11.892 -1.002 -0.878 462 HB3 ALA 60 3HB ALA 60 -12.925 -1.762 0.332 463 H LEU 61 HN LEU 61 -13.824 1.969 0.917 464 HA LEU 61 HA LEU 61 -15.468 1.027 2.995 465 HB2 LEU 61 2HB LEU 61 -14.716 3.814 2.140 466 HB3 LEU 61 1HB LEU 61 -15.686 3.497 3.562 467 HG LEU 61 HG LEU 61 -12.861 2.541 3.106 468 HD11 LEU 61 1HD1 LEU 61 -12.278 4.109 4.866 469 HD12 LEU 61 2HD1 LEU 61 -13.958 4.624 4.987 470 HD13 LEU 61 3HD1 LEU 61 -13.042 4.951 3.517 471 HD21 LEU 61 3HD2 LEU 61 -12.967 1.804 5.446 472 HD22 LEU 61 1HD2 LEU 61 -14.131 0.945 4.436 473 HD23 LEU 61 2HD2 LEU 61 -14.674 2.242 5.499 474 H GLU 62 HN GLU 62 -16.220 2.981 0.133 475 HA GLU 62 HA GLU 62 -18.984 3.236 0.868 476 HB2 GLU 62 2HB GLU 62 -17.575 3.832 -1.736 477 HB3 GLU 62 1HB GLU 62 -19.260 4.215 -1.401 478 HG2 GLU 62 2HG GLU 62 -18.481 5.570 0.542 479 HG3 GLU 62 1HG GLU 62 -16.833 5.298 -0.017 480 H ALA 63 HN ALA 63 -17.174 0.756 -0.401 481 HA ALA 63 HA ALA 63 -19.351 -0.515 -1.841 482 HB1 ALA 63 1HB ALA 63 -17.827 -2.424 -2.057 483 HB2 ALA 63 2HB ALA 63 -16.676 -1.627 -0.983 484 HB3 ALA 63 3HB ALA 63 -17.046 -0.923 -2.557 485 H GLY 64 HN GLY 64 -18.805 0.104 1.320 486 HA2 GLY 64 2HA GLY 64 -20.032 -0.638 3.146 487 HA3 GLY 64 1HA GLY 64 -20.709 -1.908 2.135 488 H LYS 65 HN LYS 65 -17.320 -1.642 2.096 489 HA LYS 65 HA LYS 65 -17.115 -4.084 3.705 490 HB2 LYS 65 2HB LYS 65 -15.210 -3.033 1.601 491 HB3 LYS 65 1HB LYS 65 -15.125 -4.593 2.408 492 HG2 LYS 65 2HG LYS 65 -17.366 -3.720 0.596 493 HG3 LYS 65 1HG LYS 65 -16.001 -4.725 0.107 494 HD2 LYS 65 2HD LYS 65 -16.664 -6.461 1.639 495 HD3 LYS 65 1HD LYS 65 -17.939 -5.439 2.305 496 HE2 LYS 65 2HE LYS 65 -17.821 -6.279 -0.582 497 HE3 LYS 65 1HE LYS 65 -18.690 -7.182 0.651 498 HZ1 LYS 65 3HZ LYS 65 -20.091 -5.288 1.063 499 HZ2 LYS 65 1HZ LYS 65 -20.126 -5.656 -0.590 500 HZ3 LYS 65 2HZ LYS 65 -19.216 -4.343 -0.038 501 H ASN 66 HN ASN 66 -14.860 -4.262 4.745 502 HA ASN 66 HA ASN 66 -14.413 -1.687 6.086 503 HB2 ASN 66 2HB ASN 66 -14.997 -3.879 7.362 504 HB3 ASN 66 1HB ASN 66 -13.307 -4.281 7.104 505 HD21 ASN 66 1HD2 ASN 66 -13.038 -4.204 9.400 506 HD22 ASN 66 2HD2 ASN 66 -12.849 -2.675 10.197 507 H ALA 67 HN ALA 67 -12.546 -0.671 6.053 508 HA ALA 67 HA ALA 67 -10.120 -1.929 5.110 509 HB1 ALA 67 1HB ALA 67 -11.283 -1.350 3.020 510 HB2 ALA 67 2HB ALA 67 -9.803 -0.415 3.233 511 HB3 ALA 67 3HB ALA 67 -11.370 0.332 3.546 512 H ALA 68 HN ALA 68 -8.272 -0.448 5.268 513 HA ALA 68 HA ALA 68 -8.636 2.093 6.565 514 HB1 ALA 68 1HB ALA 68 -7.333 -0.138 8.125 515 HB2 ALA 68 2HB ALA 68 -8.911 0.567 8.477 516 HB3 ALA 68 3HB ALA 68 -7.453 1.550 8.622 517 H TYR 69 HN TYR 69 -6.993 3.399 5.998 518 HA TYR 69 HA TYR 69 -4.536 2.158 4.986 519 HB2 TYR 69 2HB TYR 69 -4.105 4.185 3.750 520 HB3 TYR 69 1HB TYR 69 -5.749 3.671 3.409 521 HD1 TYR 69 2HD TYR 69 -7.629 4.853 4.833 522 HD2 TYR 69 1HD TYR 69 -3.688 6.385 4.333 523 HE1 TYR 69 2HE TYR 69 -8.426 7.101 5.430 524 HE2 TYR 69 1HE TYR 69 -4.483 8.634 4.923 525 HH TYR 69 HH TYR 69 -7.401 9.217 6.397 526 H ILE 70 HN ILE 70 -2.767 2.311 6.128 527 HA ILE 70 HA ILE 70 -2.632 4.310 8.283 528 HB ILE 70 HB ILE 70 -1.693 1.438 8.400 529 HG12 ILE 70 2HG1 ILE 70 -3.852 2.901 9.943 530 HG13 ILE 70 1HG1 ILE 70 -4.129 1.720 8.668 531 HG21 ILE 70 1HG2 ILE 70 -1.481 3.622 10.466 532 HG22 ILE 70 2HG2 ILE 70 -0.144 2.931 9.548 533 HG23 ILE 70 3HG2 ILE 70 -1.030 1.932 10.701 534 HD11 ILE 70 3HD1 ILE 70 -3.131 -0.016 10.027 535 HD12 ILE 70 1HD1 ILE 70 -4.445 0.774 10.899 536 HD13 ILE 70 2HD1 ILE 70 -2.769 1.158 11.293 537 H ASP 71 HN ASP 71 -1.054 5.672 7.976 538 HA ASP 71 HA ASP 71 1.254 4.894 6.383 539 HB2 ASP 71 2HB ASP 71 1.829 7.344 6.527 540 HB3 ASP 71 1HB ASP 71 0.322 6.992 5.688 541 H ALA 72 HN ALA 72 2.922 4.103 7.394 542 HA ALA 72 HA ALA 72 3.140 3.917 10.180 543 HB1 ALA 72 1HB ALA 72 5.322 3.563 8.129 544 HB2 ALA 72 2HB ALA 72 4.174 2.327 8.643 545 HB3 ALA 72 3HB ALA 72 5.347 2.973 9.790 546 H ALA 73 HN ALA 73 4.061 6.453 8.078 547 HA ALA 73 HA ALA 73 6.141 7.582 9.610 548 HB1 ALA 73 1HB ALA 73 5.732 8.137 7.243 549 HB2 ALA 73 2HB ALA 73 5.850 9.564 8.272 550 HB3 ALA 73 3HB ALA 73 4.272 9.001 7.726 551 H SER 74 HN SER 74 2.644 7.847 9.857 552 HA SER 74 HA SER 74 3.079 9.604 12.182 553 HB2 SER 74 2HB SER 74 2.157 10.865 10.236 554 HB3 SER 74 1HB SER 74 0.747 9.809 10.263 555 HG SER 74 HG SER 74 0.565 10.546 12.557 556 H MET 75 HN MET 75 1.814 6.691 11.074 557 HA MET 75 HA MET 75 0.249 6.374 13.539 558 HB2 MET 75 2HB MET 75 -0.743 5.795 10.745 559 HB3 MET 75 1HB MET 75 -1.504 5.145 12.185 560 HG2 MET 75 2HG MET 75 -1.771 7.547 12.949 561 HG3 MET 75 1HG MET 75 -1.308 8.008 11.314 562 HE1 MET 75 3HE MET 75 -2.716 7.277 9.126 563 HE2 MET 75 1HE MET 75 -4.169 6.282 9.218 564 HE3 MET 75 2HE MET 75 -2.606 5.598 9.659 565 HA PRO 76 HA PRO 76 2.063 2.277 13.221 566 HB2 PRO 76 2HB PRO 76 1.399 1.431 15.667 567 HB3 PRO 76 1HB PRO 76 2.587 2.719 15.439 568 HG2 PRO 76 2HG PRO 76 -0.202 2.878 16.404 569 HG3 PRO 76 1HG PRO 76 1.167 3.949 16.739 570 HD2 PRO 76 2HD PRO 76 -0.939 4.312 14.820 571 HD3 PRO 76 1HD PRO 76 0.442 5.379 15.139 572 H LEU 77 HN LEU 77 1.341 -0.008 13.495 573 HA LEU 77 HA LEU 77 -1.440 -0.329 12.652 574 HB2 LEU 77 2HB LEU 77 0.344 -1.390 11.313 575 HB3 LEU 77 1HB LEU 77 0.842 -2.314 12.717 576 HG LEU 77 HG LEU 77 -1.324 -3.487 12.713 577 HD11 LEU 77 1HD1 LEU 77 -2.859 -3.240 10.850 578 HD12 LEU 77 2HD1 LEU 77 -1.854 -1.964 10.165 579 HD13 LEU 77 3HD1 LEU 77 -2.677 -1.708 11.703 580 HD21 LEU 77 3HD2 LEU 77 0.568 -4.437 11.515 581 HD22 LEU 77 1HD2 LEU 77 0.118 -3.537 10.068 582 HD23 LEU 77 2HD2 LEU 77 -0.947 -4.799 10.688 583 H THR 78 HN THR 78 -2.892 -1.681 13.778 584 HA THR 78 HA THR 78 -2.061 -2.595 16.426 585 HB THR 78 HB THR 78 -4.243 -1.603 17.319 586 HG1 THR 78 1HG THR 78 -4.077 0.406 15.415 587 HG21 THR 78 3HG2 THR 78 -3.236 0.597 17.737 588 HG22 THR 78 1HG2 THR 78 -2.043 0.291 16.477 589 HG23 THR 78 2HG2 THR 78 -2.058 -0.700 17.938 590 H ASP 79 HN ASP 79 -3.817 -3.862 17.489 591 HA ASP 79 HA ASP 79 -4.914 -5.814 15.724 592 HB2 ASP 79 2HB ASP 79 -4.221 -6.425 17.978 593 HB3 ASP 79 1HB ASP 79 -5.392 -5.308 18.668 594 H ALA 80 HN ALA 80 -6.082 -2.874 17.142 595 HA ALA 80 HA ALA 80 -8.843 -3.227 16.669 596 HB1 ALA 80 1HB ALA 80 -7.233 -0.673 16.624 597 HB2 ALA 80 2HB ALA 80 -7.954 -1.414 18.051 598 HB3 ALA 80 3HB ALA 80 -8.986 -0.790 16.766 599 H ALA 81 HN ALA 81 -6.172 -2.560 14.570 600 HA ALA 81 HA ALA 81 -7.848 -1.754 12.343 601 HB1 ALA 81 1HB ALA 81 -4.887 -2.319 12.454 602 HB2 ALA 81 2HB ALA 81 -5.648 -0.735 12.608 603 HB3 ALA 81 3HB ALA 81 -5.755 -1.620 11.088 604 H PHE 82 HN PHE 82 -6.984 -4.633 13.781 605 HA PHE 82 HA PHE 82 -6.580 -6.300 11.509 606 HB2 PHE 82 2HB PHE 82 -6.066 -6.685 14.066 607 HB3 PHE 82 1HB PHE 82 -7.702 -7.325 14.096 608 HD1 PHE 82 1HD PHE 82 -8.249 -9.261 12.532 609 HD2 PHE 82 2HD PHE 82 -4.280 -7.981 13.367 610 HE1 PHE 82 1HE PHE 82 -7.389 -11.443 11.786 611 HE2 PHE 82 2HE PHE 82 -3.415 -10.157 12.623 612 HZ PHE 82 HZ PHE 82 -4.968 -11.890 11.830 613 H GLU 83 HN GLU 83 -9.313 -4.840 12.918 614 HA GLU 83 HA GLU 83 -11.315 -6.697 12.189 615 HB2 GLU 83 2HB GLU 83 -11.488 -3.718 12.601 616 HB3 GLU 83 1HB GLU 83 -12.863 -4.797 12.469 617 HG2 GLU 83 2HG GLU 83 -11.968 -6.019 14.459 618 HG3 GLU 83 1HG GLU 83 -10.803 -4.714 14.639 619 H ALA 84 HN ALA 84 -9.502 -4.396 10.421 620 HA ALA 84 HA ALA 84 -11.368 -3.993 8.298 621 HB1 ALA 84 1HB ALA 84 -9.675 -2.319 8.863 622 HB2 ALA 84 2HB ALA 84 -9.556 -2.836 7.181 623 HB3 ALA 84 3HB ALA 84 -8.406 -3.442 8.374 624 H GLU 85 HN GLU 85 -11.539 -4.991 6.409 625 HA GLU 85 HA GLU 85 -10.174 -7.527 6.064 626 HB2 GLU 85 2HB GLU 85 -12.604 -7.192 5.597 627 HB3 GLU 85 1HB GLU 85 -12.161 -6.163 4.249 628 HG2 GLU 85 2HG GLU 85 -11.130 -7.976 3.101 629 HG3 GLU 85 1HG GLU 85 -11.323 -9.040 4.497 630 H TYR 86 HN TYR 86 -10.191 -4.331 4.686 631 HA TYR 86 HA TYR 86 -8.036 -5.133 2.842 632 HB2 TYR 86 2HB TYR 86 -9.719 -2.632 2.668 633 HB3 TYR 86 1HB TYR 86 -8.649 -3.289 1.435 634 HD1 TYR 86 1HD TYR 86 -9.438 -6.114 1.371 635 HD2 TYR 86 2HD TYR 86 -11.837 -2.629 1.734 636 HE1 TYR 86 1HE TYR 86 -11.335 -7.324 0.386 637 HE2 TYR 86 2HE TYR 86 -13.740 -3.829 0.748 638 HH TYR 86 HH TYR 86 -13.844 -7.157 0.439 639 H LEU 87 HN LEU 87 -6.115 -4.710 3.738 640 HA LEU 87 HA LEU 87 -5.843 -2.298 5.395 641 HB2 LEU 87 2HB LEU 87 -4.234 -4.832 5.247 642 HB3 LEU 87 1HB LEU 87 -3.592 -3.388 5.997 643 HG LEU 87 HG LEU 87 -4.425 -4.776 7.732 644 HD11 LEU 87 1HD1 LEU 87 -6.432 -2.595 7.192 645 HD12 LEU 87 2HD1 LEU 87 -4.881 -2.404 8.008 646 HD13 LEU 87 3HD1 LEU 87 -6.152 -3.381 8.746 647 HD21 LEU 87 3HD2 LEU 87 -6.718 -5.598 7.818 648 HD22 LEU 87 1HD2 LEU 87 -5.870 -6.214 6.399 649 HD23 LEU 87 2HD2 LEU 87 -7.034 -4.901 6.229 650 H ALA 88 HN ALA 88 -4.695 -0.631 4.745 651 HA ALA 88 HA ALA 88 -2.853 -0.981 2.469 652 HB1 ALA 88 1HB ALA 88 -4.491 1.448 3.185 653 HB2 ALA 88 2HB ALA 88 -4.796 0.344 1.844 654 HB3 ALA 88 3HB ALA 88 -3.338 1.335 1.853 655 H VAL 89 HN VAL 89 -0.783 -0.737 3.064 656 HA VAL 89 HA VAL 89 -0.257 0.794 5.529 657 HB VAL 89 HB VAL 89 1.326 -1.565 4.496 658 HG11 VAL 89 1HG1 VAL 89 2.391 -1.480 6.724 659 HG12 VAL 89 2HG1 VAL 89 1.506 0.006 7.067 660 HG13 VAL 89 3HG1 VAL 89 2.700 -0.033 5.768 661 HG21 VAL 89 3HG2 VAL 89 -0.646 -1.408 6.774 662 HG22 VAL 89 1HG2 VAL 89 0.379 -2.792 6.399 663 HG23 VAL 89 2HG2 VAL 89 -0.868 -2.285 5.259 664 H ASP 90 HN ASP 90 0.912 2.539 5.292 665 HA ASP 90 HA ASP 90 2.581 2.876 2.903 666 HB2 ASP 90 2HB ASP 90 0.971 4.675 3.437 667 HB3 ASP 90 1HB ASP 90 1.741 4.893 5.001 668 H GLN 91 HN GLN 91 4.712 2.671 3.016 669 HA GLN 91 HA GLN 91 6.834 2.523 3.802 670 HB2 GLN 91 2HB GLN 91 5.678 4.540 5.714 671 HB3 GLN 91 1HB GLN 91 7.374 4.084 5.759 672 HG2 GLN 91 2HG GLN 91 7.674 4.839 3.483 673 HG3 GLN 91 1HG GLN 91 5.956 5.205 3.352 674 HE21 GLN 91 1HE2 GLN 91 5.120 6.996 4.404 675 HE22 GLN 91 2HE2 GLN 91 6.147 8.265 5.005 676 H VAL 92 HN VAL 92 5.546 0.340 4.414 677 HA VAL 92 HA VAL 92 5.167 -0.388 7.079 678 HB VAL 92 HB VAL 92 4.339 -1.696 5.163 679 HG11 VAL 92 1HG1 VAL 92 7.212 -2.526 4.802 680 HG12 VAL 92 2HG1 VAL 92 6.259 -1.538 3.697 681 HG13 VAL 92 3HG1 VAL 92 5.829 -3.229 3.962 682 HG21 VAL 92 3HG2 VAL 92 4.802 -3.942 6.053 683 HG22 VAL 92 1HG2 VAL 92 4.423 -2.776 7.322 684 HG23 VAL 92 2HG2 VAL 92 6.095 -3.263 7.043 685 H GLU 93 HN GLU 93 8.072 0.040 5.304 686 HA GLU 93 HA GLU 93 9.810 -1.630 6.766 687 HB2 GLU 93 2HB GLU 93 10.421 -0.781 4.586 688 HB3 GLU 93 1HB GLU 93 10.311 0.877 5.155 689 HG2 GLU 93 2HG GLU 93 12.193 -0.746 6.677 690 HG3 GLU 93 1HG GLU 93 12.598 -0.608 4.966 691 H LYS 94 HN LYS 94 8.382 1.443 7.509 692 HA LYS 94 HA LYS 94 10.510 2.241 9.284 693 HB2 LYS 94 2HB LYS 94 7.821 3.549 9.003 694 HB3 LYS 94 1HB LYS 94 9.297 4.255 9.623 695 HG2 LYS 94 2HG LYS 94 8.548 3.647 6.798 696 HG3 LYS 94 1HG LYS 94 9.103 5.163 7.506 697 HD2 LYS 94 2HD LYS 94 10.808 2.698 7.208 698 HD3 LYS 94 1HD LYS 94 10.782 4.025 6.063 699 HE2 LYS 94 2HE LYS 94 11.516 5.550 7.859 700 HE3 LYS 94 1HE LYS 94 11.609 4.166 8.953 701 HZ1 LYS 94 3HZ LYS 94 13.214 4.612 6.491 702 HZ2 LYS 94 1HZ LYS 94 13.208 3.155 7.366 703 HZ3 LYS 94 2HZ LYS 94 13.779 4.580 8.087 704 H LEU 95 HN LEU 95 8.091 0.052 9.582 705 HA LEU 95 HA LEU 95 6.973 0.745 12.110 706 HB2 LEU 95 2HB LEU 95 7.051 -1.896 10.653 707 HB3 LEU 95 1HB LEU 95 6.095 -1.571 12.084 708 HG LEU 95 HG LEU 95 5.755 -0.221 9.404 709 HD11 LEU 95 1HD1 LEU 95 4.052 -2.268 10.819 710 HD12 LEU 95 2HD1 LEU 95 5.020 -2.537 9.369 711 HD13 LEU 95 3HD1 LEU 95 3.638 -1.444 9.316 712 HD21 LEU 95 3HD2 LEU 95 5.202 1.264 11.258 713 HD22 LEU 95 1HD2 LEU 95 4.148 0.028 11.944 714 HD23 LEU 95 2HD2 LEU 95 3.748 0.764 10.392 715 H GLY 96 HN GLY 96 7.333 -0.237 14.141 716 HA2 GLY 96 2HA GLY 96 10.157 -1.004 14.460 717 HA3 GLY 96 1HA GLY 96 9.141 -0.294 15.704 718 H ASN 97 HN ASN 97 9.355 -3.201 13.676 719 HA ASN 97 HA ASN 97 9.306 -5.412 14.168 720 HB2 ASN 97 2HB ASN 97 10.840 -5.019 15.981 721 HB3 ASN 97 1HB ASN 97 9.541 -4.448 17.022 722 HD21 ASN 97 1HD2 ASN 97 8.209 -5.924 18.032 723 HD22 ASN 97 2HD2 ASN 97 8.513 -7.624 18.034 724 H GLU 98 HN GLU 98 7.308 -3.839 16.691 725 HA GLU 98 HA GLU 98 5.604 -6.054 16.984 726 HB2 GLU 98 2HB GLU 98 5.947 -4.259 18.669 727 HB3 GLU 98 1HB GLU 98 5.018 -3.168 17.652 728 HG2 GLU 98 2HG GLU 98 3.047 -4.525 17.923 729 HG3 GLU 98 1HG GLU 98 3.964 -5.726 18.832 730 H GLU 99 HN GLU 99 5.076 -2.969 15.281 731 HA GLU 99 HA GLU 99 2.502 -3.539 14.353 732 HB2 GLU 99 2HB GLU 99 4.552 -1.864 12.899 733 HB3 GLU 99 1HB GLU 99 2.807 -1.772 12.732 734 HG2 GLU 99 2HG GLU 99 3.248 0.037 14.065 735 HG3 GLU 99 1HG GLU 99 2.858 -1.197 15.262 736 H GLN 100 HN GLN 100 5.652 -4.251 12.862 737 HA GLN 100 HA GLN 100 4.439 -5.212 10.451 738 HB2 GLN 100 2HB GLN 100 6.684 -5.866 9.772 739 HB3 GLN 100 1HB GLN 100 6.672 -4.224 10.393 740 HG2 GLN 100 2HG GLN 100 7.531 -5.077 12.547 741 HG3 GLN 100 1HG GLN 100 7.637 -6.682 11.829 742 HE21 GLN 100 1HE2 GLN 100 8.331 -3.745 10.071 743 HE22 GLN 100 2HE2 GLN 100 10.032 -4.006 9.925 744 H ALA 101 HN ALA 101 5.411 -6.627 13.478 745 HA ALA 101 HA ALA 101 5.229 -9.343 12.663 746 HB1 ALA 101 1HB ALA 101 6.330 -8.663 14.754 747 HB2 ALA 101 2HB ALA 101 5.064 -9.858 15.036 748 HB3 ALA 101 3HB ALA 101 4.769 -8.159 15.402 749 H LEU 102 HN LEU 102 2.954 -6.982 13.931 750 HA LEU 102 HA LEU 102 0.664 -8.618 14.049 751 HB2 LEU 102 2HB LEU 102 1.148 -6.173 14.884 752 HB3 LEU 102 1HB LEU 102 0.570 -5.711 13.299 753 HG LEU 102 HG LEU 102 -1.146 -5.539 15.054 754 HD11 LEU 102 1HD1 LEU 102 -2.937 -6.704 13.865 755 HD12 LEU 102 2HD1 LEU 102 -1.730 -7.612 12.955 756 HD13 LEU 102 3HD1 LEU 102 -1.849 -5.863 12.758 757 HD21 LEU 102 3HD2 LEU 102 -0.453 -7.376 16.473 758 HD22 LEU 102 1HD2 LEU 102 -0.870 -8.532 15.207 759 HD23 LEU 102 2HD2 LEU 102 -2.134 -7.580 15.981 760 H LEU 103 HN LEU 103 1.940 -6.486 11.525 761 HA LEU 103 HA LEU 103 0.081 -6.919 9.517 762 HB2 LEU 103 2HB LEU 103 1.925 -5.253 9.475 763 HB3 LEU 103 1HB LEU 103 3.068 -6.548 9.199 764 HG LEU 103 HG LEU 103 2.355 -5.124 7.196 765 HD11 LEU 103 1HD1 LEU 103 2.368 -7.052 5.665 766 HD12 LEU 103 2HD1 LEU 103 2.159 -8.124 7.051 767 HD13 LEU 103 3HD1 LEU 103 3.621 -7.149 6.903 768 HD21 LEU 103 3HD2 LEU 103 -0.107 -6.842 7.456 769 HD22 LEU 103 1HD2 LEU 103 0.317 -5.879 6.040 770 HD23 LEU 103 2HD2 LEU 103 -0.031 -5.084 7.576 771 H PHE 104 HN PHE 104 3.005 -8.785 10.274 772 HA PHE 104 HA PHE 104 2.924 -10.686 8.276 773 HB2 PHE 104 2HB PHE 104 4.735 -10.552 9.922 774 HB3 PHE 104 1HB PHE 104 3.649 -11.106 11.187 775 HD1 PHE 104 1HD PHE 104 5.484 -12.095 8.161 776 HD2 PHE 104 2HD PHE 104 3.100 -13.417 11.428 777 HE1 PHE 104 1HE PHE 104 6.085 -14.424 7.653 778 HE2 PHE 104 2HE PHE 104 3.699 -15.749 10.926 779 HZ PHE 104 HZ PHE 104 5.194 -16.254 9.034 780 H SER 105 HN SER 105 1.199 -10.705 11.368 781 HA SER 105 HA SER 105 -0.011 -13.223 11.051 782 HB2 SER 105 2HB SER 105 0.176 -11.918 13.204 783 HB3 SER 105 1HB SER 105 -1.123 -10.883 12.617 784 HG SER 105 HG SER 105 -1.570 -12.885 14.014 785 H ILE 106 HN ILE 106 -1.157 -9.955 10.291 786 HA ILE 106 HA ILE 106 -3.698 -10.622 9.321 787 HB ILE 106 HB ILE 106 -1.882 -8.409 8.335 788 HG12 ILE 106 2HG1 ILE 106 -4.000 -8.380 10.495 789 HG13 ILE 106 1HG1 ILE 106 -2.262 -8.304 10.762 790 HG21 ILE 106 1HG2 ILE 106 -3.702 -8.813 6.791 791 HG22 ILE 106 2HG2 ILE 106 -3.976 -7.302 7.659 792 HG23 ILE 106 3HG2 ILE 106 -4.871 -8.753 8.110 793 HD11 ILE 106 3HD1 ILE 106 -3.898 -6.249 9.297 794 HD12 ILE 106 1HD1 ILE 106 -2.166 -6.167 9.608 795 HD13 ILE 106 2HD1 ILE 106 -3.306 -6.114 10.952 796 H PHE 107 HN PHE 107 -0.620 -10.273 7.616 797 HA PHE 107 HA PHE 107 -1.607 -10.752 5.023 798 HB2 PHE 107 2HB PHE 107 0.712 -9.832 5.953 799 HB3 PHE 107 1HB PHE 107 1.195 -11.506 5.726 800 HD1 PHE 107 1HD PHE 107 0.973 -12.526 3.426 801 HD2 PHE 107 2HD PHE 107 0.589 -8.354 4.160 802 HE1 PHE 107 1HE PHE 107 1.405 -12.069 1.045 803 HE2 PHE 107 2HE PHE 107 1.010 -7.887 1.784 804 HZ PHE 107 HZ PHE 107 1.422 -9.743 0.223 805 H ASN 108 HN ASN 108 -0.188 -12.878 7.452 806 HA ASN 108 HA ASN 108 -0.007 -15.195 5.861 807 HB2 ASN 108 2HB ASN 108 1.178 -14.911 8.008 808 HB3 ASN 108 1HB ASN 108 -0.361 -14.977 8.859 809 HD21 ASN 108 1HD2 ASN 108 0.158 -16.781 10.048 810 HD22 ASN 108 2HD2 ASN 108 0.304 -18.355 9.340 811 H ARG 109 HN ARG 109 -2.524 -14.128 8.135 812 HA ARG 109 HA ARG 109 -4.122 -16.442 7.836 813 HB2 ARG 109 2HB ARG 109 -4.808 -13.686 8.844 814 HB3 ARG 109 1HB ARG 109 -5.920 -15.047 8.890 815 HG2 ARG 109 2HG ARG 109 -4.290 -16.279 10.279 816 HG3 ARG 109 1HG ARG 109 -3.275 -14.834 10.305 817 HD2 ARG 109 2HD ARG 109 -5.103 -13.582 11.341 818 HD3 ARG 109 1HD ARG 109 -6.107 -15.028 11.324 819 HE ARG 109 HE ARG 109 -3.646 -15.488 12.678 820 HH11 ARG 109 1HH1 ARG 109 -6.803 -14.025 13.039 821 HH12 ARG 109 2HH1 ARG 109 -6.810 -14.159 14.770 822 HH21 ARG 109 1HH2 ARG 109 -3.662 -15.704 14.964 823 HH22 ARG 109 2HH2 ARG 109 -5.034 -15.125 15.864 824 H PHE 110 HN PHE 110 -4.095 -13.338 6.161 825 HA PHE 110 HA PHE 110 -6.544 -13.618 4.818 826 HB2 PHE 110 2HB PHE 110 -4.051 -12.046 4.258 827 HB3 PHE 110 1HB PHE 110 -5.349 -12.091 3.069 828 HD1 PHE 110 1HD PHE 110 -6.853 -12.412 6.185 829 HD2 PHE 110 2HD PHE 110 -4.953 -9.526 3.703 830 HE1 PHE 110 1HE PHE 110 -8.031 -10.617 7.381 831 HE2 PHE 110 2HE PHE 110 -6.127 -7.724 4.896 832 HZ PHE 110 HZ PHE 110 -7.671 -8.264 6.738 833 H ARG 111 HN ARG 111 -3.252 -14.481 3.760 834 HA ARG 111 HA ARG 111 -4.108 -15.509 1.260 835 HB2 ARG 111 2HB ARG 111 -1.663 -14.937 2.408 836 HB3 ARG 111 1HB ARG 111 -1.645 -16.693 2.304 837 HG2 ARG 111 2HG ARG 111 -2.173 -14.819 0.005 838 HG3 ARG 111 1HG ARG 111 -0.643 -15.634 0.338 839 HD2 ARG 111 2HD ARG 111 -1.572 -17.762 -0.099 840 HD3 ARG 111 1HD ARG 111 -3.219 -17.135 -0.059 841 HE ARG 111 HE ARG 111 -1.656 -15.926 -2.127 842 HH11 ARG 111 1HH1 ARG 111 -3.410 -18.835 -1.295 843 HH12 ARG 111 2HH1 ARG 111 -3.883 -19.181 -2.930 844 HH21 ARG 111 1HH2 ARG 111 -2.228 -16.369 -4.271 845 HH22 ARG 111 2HH2 ARG 111 -3.194 -17.766 -4.649 846 H ASN 112 HN ASN 112 -3.873 -16.879 4.460 847 HA ASN 112 HA ASN 112 -4.120 -19.601 3.612 848 HB2 ASN 112 2HB ASN 112 -4.159 -18.179 6.229 849 HB3 ASN 112 1HB ASN 112 -4.902 -19.771 6.152 850 HD21 ASN 112 1HD2 ASN 112 -1.951 -17.972 5.945 851 HD22 ASN 112 2HD2 ASN 112 -0.881 -19.333 5.997 852 H SER 113 HN SER 113 -6.363 -17.131 4.801 853 HA SER 113 HA SER 113 -8.664 -18.787 4.789 854 HB2 SER 113 2HB SER 113 -8.473 -15.776 4.494 855 HB3 SER 113 1HB SER 113 -9.934 -16.678 4.893 856 HG SER 113 HG SER 113 -7.586 -16.336 6.438 857 H GLY 114 HN GLY 114 -7.280 -16.565 2.400 858 HA2 GLY 114 2HA GLY 114 -7.371 -17.485 0.074 859 HA3 GLY 114 1HA GLY 114 -9.079 -17.766 0.385 860 H LYS 115 HN LYS 115 -9.455 -15.310 1.847 861 HA LYS 115 HA LYS 115 -9.332 -13.424 -0.392 862 HB2 LYS 115 2HB LYS 115 -11.600 -14.280 0.228 863 HB3 LYS 115 1HB LYS 115 -11.393 -13.575 1.820 864 HG2 LYS 115 2HG LYS 115 -11.600 -11.410 1.029 865 HG3 LYS 115 1HG LYS 115 -11.170 -11.867 -0.620 866 HD2 LYS 115 2HD LYS 115 -13.554 -11.337 -0.419 867 HD3 LYS 115 1HD LYS 115 -13.297 -13.022 -0.872 868 HE2 LYS 115 2HE LYS 115 -15.013 -13.003 0.765 869 HE3 LYS 115 1HE LYS 115 -13.559 -13.610 1.555 870 HZ1 LYS 115 3HZ LYS 115 -13.228 -11.507 2.601 871 HZ2 LYS 115 1HZ LYS 115 -14.829 -11.979 2.884 872 HZ3 LYS 115 2HZ LYS 115 -14.486 -10.792 1.719 873 H GLY 116 HN GLY 116 -9.626 -11.091 0.553 874 HA2 GLY 116 2HA GLY 116 -8.971 -9.691 2.498 875 HA3 GLY 116 1HA GLY 116 -7.660 -10.840 2.740 876 H PHE 117 HN PHE 117 -7.821 -7.871 2.080 877 HA PHE 117 HA PHE 117 -6.101 -7.955 -0.310 878 HB2 PHE 117 2HB PHE 117 -8.160 -5.911 0.504 879 HB3 PHE 117 1HB PHE 117 -6.906 -5.565 -0.675 880 HD1 PHE 117 1HD PHE 117 -9.218 -8.468 -0.134 881 HD2 PHE 117 2HD PHE 117 -7.773 -5.470 -2.786 882 HE1 PHE 117 1HE PHE 117 -10.662 -9.353 -1.913 883 HE2 PHE 117 2HE PHE 117 -9.218 -6.354 -4.570 884 HZ PHE 117 HZ PHE 117 -10.663 -8.299 -4.134 885 H LEU 118 HN LEU 118 -4.238 -6.795 -0.266 886 HA LEU 118 HA LEU 118 -3.635 -5.164 2.089 887 HB2 LEU 118 2HB LEU 118 -2.660 -7.783 1.741 888 HB3 LEU 118 1HB LEU 118 -1.338 -6.714 1.315 889 HG LEU 118 HG LEU 118 -1.137 -7.317 3.628 890 HD11 LEU 118 1HD1 LEU 118 -1.158 -5.107 4.682 891 HD12 LEU 118 2HD1 LEU 118 -2.122 -4.485 3.344 892 HD13 LEU 118 3HD1 LEU 118 -0.478 -5.054 3.056 893 HD21 LEU 118 3HD2 LEU 118 -3.454 -7.918 4.066 894 HD22 LEU 118 1HD2 LEU 118 -3.923 -6.220 3.977 895 HD23 LEU 118 2HD2 LEU 118 -2.860 -6.776 5.271 896 H LEU 119 HN LEU 119 -2.994 -3.286 1.341 897 HA LEU 119 HA LEU 119 -1.585 -3.169 -1.237 898 HB2 LEU 119 2HB LEU 119 -3.722 -1.904 -1.061 899 HB3 LEU 119 1HB LEU 119 -3.020 -0.956 0.235 900 HG LEU 119 HG LEU 119 -1.337 -0.065 -1.320 901 HD11 LEU 119 1HD1 LEU 119 -1.552 -0.467 -3.719 902 HD12 LEU 119 2HD1 LEU 119 -2.850 -1.621 -3.416 903 HD13 LEU 119 3HD1 LEU 119 -1.215 -1.965 -2.852 904 HD21 LEU 119 3HD2 LEU 119 -4.181 0.228 -2.283 905 HD22 LEU 119 1HD2 LEU 119 -2.850 1.329 -2.639 906 HD23 LEU 119 2HD2 LEU 119 -3.423 1.146 -0.982 907 H LEU 120 HN LEU 120 0.534 -3.085 -0.997 908 HA LEU 120 HA LEU 120 1.625 -1.852 1.437 909 HB2 LEU 120 2HB LEU 120 2.880 -3.775 -0.519 910 HB3 LEU 120 1HB LEU 120 3.689 -3.101 0.880 911 HG LEU 120 HG LEU 120 1.232 -4.851 1.018 912 HD11 LEU 120 1HD1 LEU 120 3.169 -6.079 0.160 913 HD12 LEU 120 2HD1 LEU 120 2.744 -6.597 1.790 914 HD13 LEU 120 3HD1 LEU 120 4.125 -5.529 1.538 915 HD21 LEU 120 3HD2 LEU 120 1.759 -4.975 3.398 916 HD22 LEU 120 1HD2 LEU 120 1.477 -3.305 2.902 917 HD23 LEU 120 2HD2 LEU 120 3.123 -3.882 3.162 918 H GLY 121 HN GLY 121 2.260 0.163 1.213 919 HA2 GLY 121 2HA GLY 121 3.372 1.028 -1.375 920 HA3 GLY 121 1HA GLY 121 2.719 2.093 -0.136 921 H SER 122 HN SER 122 5.502 0.882 -1.491 922 HA SER 122 HA SER 122 7.116 2.222 0.495 923 HB2 SER 122 2HB SER 122 7.525 -0.720 -0.102 924 HB3 SER 122 1HB SER 122 8.668 0.293 0.780 925 HG SER 122 HG SER 122 6.054 0.352 1.691 926 H GLU 123 HN GLU 123 8.898 3.133 -0.408 927 HA GLU 123 HA GLU 123 8.652 3.507 -3.197 928 HB2 GLU 123 2HB GLU 123 10.785 4.512 -1.316 929 HB3 GLU 123 1HB GLU 123 10.480 5.112 -2.942 930 HG2 GLU 123 2HG GLU 123 8.144 5.661 -2.173 931 HG3 GLU 123 1HG GLU 123 8.698 5.321 -0.536 932 H TYR 124 HN TYR 124 10.837 1.525 -1.304 933 HA TYR 124 HA TYR 124 12.012 0.704 -3.859 934 HB2 TYR 124 2HB TYR 124 14.115 0.110 -2.656 935 HB3 TYR 124 1HB TYR 124 13.779 1.828 -2.736 936 HD1 TYR 124 2HD TYR 124 12.660 2.868 -0.600 937 HD2 TYR 124 1HD TYR 124 14.720 -0.856 -0.643 938 HE1 TYR 124 2HE TYR 124 13.040 3.054 1.824 939 HE2 TYR 124 1HE TYR 124 15.111 -0.674 1.779 940 HH TYR 124 HH TYR 124 13.531 1.643 3.749 941 H THR 125 HN THR 125 13.159 -1.568 -3.505 942 HA THR 125 HA THR 125 10.857 -3.233 -3.310 943 HB THR 125 HB THR 125 12.600 -5.040 -3.896 944 HG1 THR 125 1HG THR 125 14.470 -3.749 -4.942 945 HG21 THR 125 3HG2 THR 125 12.688 -4.285 -6.224 946 HG22 THR 125 1HG2 THR 125 12.204 -2.666 -5.720 947 HG23 THR 125 2HG2 THR 125 11.090 -4.020 -5.527 948 HA PRO 126 HA PRO 126 11.149 -4.963 0.723 949 HB2 PRO 126 2HB PRO 126 10.559 -7.622 -0.392 950 HB3 PRO 126 1HB PRO 126 9.606 -6.630 0.711 951 HG2 PRO 126 2HG PRO 126 8.869 -7.009 -1.844 952 HG3 PRO 126 1HG PRO 126 8.573 -5.476 -1.001 953 HD2 PRO 126 2HD PRO 126 10.708 -6.178 -2.981 954 HD3 PRO 126 1HD PRO 126 9.753 -4.686 -2.831 955 H GLN 127 HN GLN 127 12.921 -6.462 -1.868 956 HA GLN 127 HA GLN 127 14.457 -8.262 -0.318 957 HB2 GLN 127 2HB GLN 127 15.037 -6.987 -2.988 958 HB3 GLN 127 1HB GLN 127 16.008 -8.264 -2.270 959 HG2 GLN 127 2HG GLN 127 14.685 -9.554 -3.552 960 HG3 GLN 127 1HG GLN 127 13.632 -9.450 -2.149 961 HE21 GLN 127 1HE2 GLN 127 12.950 -9.926 -4.939 962 HE22 GLN 127 2HE2 GLN 127 11.852 -8.661 -5.380 963 H GLN 128 HN GLN 128 14.636 -4.858 -0.861 964 HA GLN 128 HA GLN 128 17.328 -4.752 0.283 965 HB2 GLN 128 2HB GLN 128 15.652 -2.671 -1.118 966 HB3 GLN 128 1HB GLN 128 17.181 -2.305 -0.327 967 HG2 GLN 128 2HG GLN 128 18.303 -3.925 -1.801 968 HG3 GLN 128 1HG GLN 128 16.770 -4.209 -2.622 969 HE21 GLN 128 1HE2 GLN 128 17.653 -3.543 -4.573 970 HE22 GLN 128 2HE2 GLN 128 17.949 -1.871 -4.923 971 H LEU 129 HN LEU 129 14.327 -4.937 1.447 972 HA LEU 129 HA LEU 129 14.534 -2.893 3.491 973 HB2 LEU 129 2HB LEU 129 12.601 -5.200 3.192 974 HB3 LEU 129 1HB LEU 129 12.481 -3.930 4.387 975 HG LEU 129 HG LEU 129 12.214 -3.582 1.403 976 HD11 LEU 129 1HD1 LEU 129 10.295 -4.680 2.415 977 HD12 LEU 129 2HD1 LEU 129 9.887 -3.032 1.939 978 HD13 LEU 129 3HD1 LEU 129 10.193 -3.410 3.635 979 HD21 LEU 129 3HD2 LEU 129 13.253 -1.633 2.429 980 HD22 LEU 129 1HD2 LEU 129 11.962 -1.565 3.629 981 HD23 LEU 129 2HD2 LEU 129 11.600 -1.278 1.927 982 H VAL 130 HN VAL 130 15.351 -3.186 5.511 983 HA VAL 130 HA VAL 130 16.573 -5.781 6.061 984 HB VAL 130 HB VAL 130 16.779 -3.291 7.759 985 HG11 VAL 130 1HG1 VAL 130 18.831 -4.357 8.590 986 HG12 VAL 130 2HG1 VAL 130 18.499 -5.764 7.579 987 HG13 VAL 130 3HG1 VAL 130 17.401 -5.346 8.895 988 HG21 VAL 130 3HG2 VAL 130 18.934 -2.881 6.622 989 HG22 VAL 130 1HG2 VAL 130 17.557 -2.751 5.526 990 HG23 VAL 130 2HG2 VAL 130 18.571 -4.194 5.502 991 H ILE 131 HN ILE 131 14.387 -6.666 6.225 992 HA ILE 131 HA ILE 131 13.260 -6.302 8.926 993 HB ILE 131 HB ILE 131 11.093 -7.072 8.002 994 HG12 ILE 131 2HG1 ILE 131 12.489 -6.811 5.324 995 HG13 ILE 131 1HG1 ILE 131 11.976 -8.322 6.067 996 HG21 ILE 131 1HG2 ILE 131 10.542 -4.993 6.793 997 HG22 ILE 131 2HG2 ILE 131 12.264 -4.629 6.676 998 HG23 ILE 131 3HG2 ILE 131 11.482 -4.701 8.255 999 HD11 ILE 131 3HD1 ILE 131 9.654 -7.639 5.880 1000 HD12 ILE 131 1HD1 ILE 131 10.453 -7.591 4.310 1001 HD13 ILE 131 2HD1 ILE 131 10.151 -6.093 5.192 1002 H ARG 132 HN ARG 132 11.871 -8.349 9.471 1003 HA ARG 132 HA ARG 132 13.525 -10.546 9.835 1004 HB2 ARG 132 2HB ARG 132 10.502 -10.484 9.717 1005 HB3 ARG 132 1HB ARG 132 11.462 -11.790 10.396 1006 HG2 ARG 132 2HG ARG 132 11.470 -8.960 11.422 1007 HG3 ARG 132 1HG ARG 132 10.511 -10.277 12.099 1008 HD2 ARG 132 2HD ARG 132 13.520 -10.251 11.880 1009 HD3 ARG 132 1HD ARG 132 12.607 -9.878 13.342 1010 HE ARG 132 HE ARG 132 11.722 -12.361 12.553 1011 HH11 ARG 132 1HH1 ARG 132 14.803 -10.934 13.409 1012 HH12 ARG 132 2HH1 ARG 132 15.461 -12.412 14.034 1013 HH21 ARG 132 1HH2 ARG 132 12.588 -14.320 13.383 1014 HH22 ARG 132 2HH2 ARG 132 14.207 -14.332 14.029 1015 H GLU 133 HN GLU 133 13.886 -12.437 8.726 1016 HA GLU 133 HA GLU 133 13.513 -12.321 5.902 1017 HB2 GLU 133 2HB GLU 133 14.716 -14.415 5.809 1018 HB3 GLU 133 1HB GLU 133 15.514 -13.342 6.945 1019 HG2 GLU 133 2HG GLU 133 13.689 -15.625 7.679 1020 HG3 GLU 133 1HG GLU 133 15.449 -15.657 7.732 1021 H ASP 134 HN ASP 134 11.964 -14.020 8.541 1022 HA ASP 134 HA ASP 134 10.351 -15.749 6.982 1023 HB2 ASP 134 2HB ASP 134 10.811 -15.990 9.433 1024 HB3 ASP 134 1HB ASP 134 9.742 -14.622 9.722 1025 H LEU 135 HN LEU 135 10.066 -12.426 7.923 1026 HA LEU 135 HA LEU 135 7.336 -12.139 7.038 1027 HB2 LEU 135 2HB LEU 135 8.195 -10.721 8.818 1028 HB3 LEU 135 1HB LEU 135 9.462 -10.119 7.769 1029 HG LEU 135 HG LEU 135 7.691 -9.085 6.329 1030 HD11 LEU 135 1HD1 LEU 135 5.459 -8.791 7.293 1031 HD12 LEU 135 2HD1 LEU 135 5.892 -9.874 8.616 1032 HD13 LEU 135 3HD1 LEU 135 5.814 -10.488 6.963 1033 HD21 LEU 135 3HD2 LEU 135 7.241 -7.228 7.867 1034 HD22 LEU 135 1HD2 LEU 135 8.921 -7.761 7.944 1035 HD23 LEU 135 2HD2 LEU 135 7.790 -8.224 9.215 1036 H ARG 136 HN ARG 136 10.555 -11.578 5.806 1037 HA ARG 136 HA ARG 136 9.954 -10.021 3.552 1038 HB2 ARG 136 2HB ARG 136 12.208 -10.506 4.666 1039 HB3 ARG 136 1HB ARG 136 12.223 -11.997 3.737 1040 HG2 ARG 136 2HG ARG 136 12.131 -10.705 1.665 1041 HG3 ARG 136 1HG ARG 136 12.126 -9.209 2.604 1042 HD2 ARG 136 2HD ARG 136 14.311 -11.270 2.421 1043 HD3 ARG 136 1HD ARG 136 14.372 -9.585 1.902 1044 HE ARG 136 HE ARG 136 13.859 -9.408 4.559 1045 HH11 ARG 136 1HH1 ARG 136 16.328 -11.036 2.684 1046 HH12 ARG 136 2HH1 ARG 136 17.516 -10.967 3.952 1047 HH21 ARG 136 1HH2 ARG 136 15.422 -9.360 6.253 1048 HH22 ARG 136 2HH2 ARG 136 17.001 -10.033 5.963 1049 H THR 137 HN THR 137 10.080 -13.528 3.995 1050 HA THR 137 HA THR 137 9.852 -14.229 1.274 1051 HB THR 137 HB THR 137 8.961 -16.419 2.186 1052 HG1 THR 137 1HG THR 137 9.481 -16.436 4.622 1053 HG21 THR 137 3HG2 THR 137 11.338 -16.078 1.743 1054 HG22 THR 137 1HG2 THR 137 11.111 -17.063 3.187 1055 HG23 THR 137 2HG2 THR 137 11.546 -15.360 3.340 1056 H ARG 138 HN ARG 138 7.457 -13.533 3.767 1057 HA ARG 138 HA ARG 138 5.181 -14.322 2.272 1058 HB2 ARG 138 2HB ARG 138 5.423 -12.375 4.569 1059 HB3 ARG 138 1HB ARG 138 3.921 -13.080 3.983 1060 HG2 ARG 138 2HG ARG 138 6.221 -14.712 5.024 1061 HG3 ARG 138 1HG ARG 138 4.894 -14.144 6.031 1062 HD2 ARG 138 2HD ARG 138 3.303 -15.350 4.602 1063 HD3 ARG 138 1HD ARG 138 4.639 -15.911 3.597 1064 HE ARG 138 HE ARG 138 5.347 -16.792 6.041 1065 HH11 ARG 138 1HH1 ARG 138 2.377 -17.083 4.201 1066 HH12 ARG 138 2HH1 ARG 138 1.922 -18.594 4.928 1067 HH21 ARG 138 1HH2 ARG 138 4.769 -18.757 6.988 1068 HH22 ARG 138 2HH2 ARG 138 3.283 -19.546 6.529 1069 H MET 139 HN MET 139 7.194 -11.558 2.166 1070 HA MET 139 HA MET 139 5.312 -9.686 1.149 1071 HB2 MET 139 2HB MET 139 8.326 -9.796 1.024 1072 HB3 MET 139 1HB MET 139 7.383 -8.449 0.408 1073 HG2 MET 139 2HG MET 139 7.366 -9.406 3.257 1074 HG3 MET 139 1HG MET 139 8.312 -8.055 2.644 1075 HE1 MET 139 3HE MET 139 5.569 -6.229 4.732 1076 HE2 MET 139 1HE MET 139 7.299 -6.369 4.406 1077 HE3 MET 139 2HE MET 139 6.419 -7.724 5.116 1078 H ALA 140 HN ALA 140 6.950 -12.344 -0.224 1079 HA ALA 140 HA ALA 140 6.877 -11.339 -2.943 1080 HB1 ALA 140 1HB ALA 140 7.843 -13.496 -3.547 1081 HB2 ALA 140 2HB ALA 140 7.601 -14.073 -1.898 1082 HB3 ALA 140 3HB ALA 140 8.727 -12.754 -2.213 1083 H TYR 141 HN TYR 141 4.443 -12.184 -1.078 1084 HA TYR 141 HA TYR 141 3.113 -14.025 -2.913 1085 HB2 TYR 141 2HB TYR 141 2.425 -12.976 -0.176 1086 HB3 TYR 141 1HB TYR 141 1.260 -13.860 -1.150 1087 HD1 TYR 141 2HD TYR 141 4.691 -14.162 0.274 1088 HD2 TYR 141 1HD TYR 141 1.181 -16.178 -1.029 1089 HE1 TYR 141 2HE TYR 141 5.601 -16.278 1.126 1090 HE2 TYR 141 1HE TYR 141 2.082 -18.303 -0.177 1091 HH TYR 141 HH TYR 141 4.305 -19.293 0.333 1092 H CYS 142 HN CYS 142 3.671 -10.949 -3.198 1093 HA CYS 142 HA CYS 142 0.912 -10.209 -3.888 1094 HB2 CYS 142 2HB CYS 142 1.581 -7.868 -3.525 1095 HB3 CYS 142 1HB CYS 142 1.829 -8.832 -2.072 1096 HG CYS 142 HG CYS 142 4.507 -8.818 -2.074 1097 H LEU 143 HN LEU 143 1.203 -8.153 -5.496 1098 HA LEU 143 HA LEU 143 2.971 -9.044 -7.681 1099 HB2 LEU 143 2HB LEU 143 0.452 -7.387 -7.747 1100 HB3 LEU 143 1HB LEU 143 1.503 -7.581 -9.126 1101 HG LEU 143 HG LEU 143 1.079 -10.086 -8.852 1102 HD11 LEU 143 1HD1 LEU 143 -1.066 -10.676 -7.826 1103 HD12 LEU 143 2HD1 LEU 143 -1.221 -9.023 -7.232 1104 HD13 LEU 143 3HD1 LEU 143 0.084 -10.053 -6.644 1105 HD21 LEU 143 3HD2 LEU 143 -1.162 -8.264 -9.685 1106 HD22 LEU 143 1HD2 LEU 143 -0.980 -9.952 -10.155 1107 HD23 LEU 143 2HD2 LEU 143 0.202 -8.757 -10.688 1108 H VAL 144 HN VAL 144 4.111 -7.352 -8.867 1109 HA VAL 144 HA VAL 144 4.638 -5.030 -7.138 1110 HB VAL 144 HB VAL 144 6.611 -6.538 -8.865 1111 HG11 VAL 144 1HG1 VAL 144 7.126 -4.176 -8.882 1112 HG12 VAL 144 2HG1 VAL 144 8.294 -5.026 -7.870 1113 HG13 VAL 144 3HG1 VAL 144 6.988 -4.104 -7.125 1114 HG21 VAL 144 3HG2 VAL 144 6.026 -7.714 -6.792 1115 HG22 VAL 144 1HG2 VAL 144 6.431 -6.273 -5.860 1116 HG23 VAL 144 2HG2 VAL 144 7.690 -7.129 -6.752 1117 H TYR 145 HN TYR 145 3.948 -3.237 -8.023 1118 HA TYR 145 HA TYR 145 4.041 -2.957 -10.951 1119 HB2 TYR 145 2HB TYR 145 2.327 -1.560 -8.892 1120 HB3 TYR 145 1HB TYR 145 2.429 -1.044 -10.572 1121 HD1 TYR 145 2HD TYR 145 1.627 -2.587 -12.380 1122 HD2 TYR 145 1HD TYR 145 0.984 -3.405 -8.256 1123 HE1 TYR 145 2HE TYR 145 -0.138 -4.191 -12.982 1124 HE2 TYR 145 1HE TYR 145 -0.773 -5.016 -8.847 1125 HH TYR 145 HH TYR 145 -1.219 -6.240 -11.925 1126 H GLU 146 HN GLU 146 5.296 -1.500 -11.858 1127 HA GLU 146 HA GLU 146 7.011 0.116 -10.114 1128 HB2 GLU 146 2HB GLU 146 8.472 0.253 -12.147 1129 HB3 GLU 146 1HB GLU 146 8.210 -1.391 -11.576 1130 HG2 GLU 146 2HG GLU 146 6.386 -1.580 -13.297 1131 HG3 GLU 146 1HG GLU 146 6.944 -0.039 -13.943 1132 H VAL 147 HN VAL 147 7.456 2.322 -10.651 1133 HA VAL 147 HA VAL 147 5.270 3.585 -12.153 1134 HB VAL 147 HB VAL 147 7.097 4.839 -10.095 1135 HG11 VAL 147 1HG1 VAL 147 5.526 6.725 -10.175 1136 HG12 VAL 147 2HG1 VAL 147 4.649 5.928 -11.481 1137 HG13 VAL 147 3HG1 VAL 147 6.311 6.457 -11.732 1138 HG21 VAL 147 3HG2 VAL 147 5.112 4.851 -8.649 1139 HG22 VAL 147 1HG2 VAL 147 5.606 3.214 -9.080 1140 HG23 VAL 147 2HG2 VAL 147 4.222 3.957 -9.881 1141 H LYS 148 HN LYS 148 8.455 4.876 -11.322 1142 HA LYS 148 HA LYS 148 10.122 5.813 -12.520 1143 HB2 LYS 148 2HB LYS 148 10.164 3.650 -13.761 1144 HB3 LYS 148 1HB LYS 148 9.034 4.334 -14.923 1145 HG2 LYS 148 2HG LYS 148 10.712 6.129 -15.376 1146 HG3 LYS 148 1HG LYS 148 11.848 5.239 -14.365 1147 HD2 LYS 148 2HD LYS 148 12.284 4.675 -16.644 1148 HD3 LYS 148 1HD LYS 148 11.537 3.275 -15.874 1149 HE2 LYS 148 2HE LYS 148 9.436 3.739 -16.898 1150 HE3 LYS 148 1HE LYS 148 9.995 5.311 -17.466 1151 HZ1 LYS 148 3HZ LYS 148 10.021 3.755 -19.271 1152 HZ2 LYS 148 1HZ LYS 148 10.967 2.662 -18.381 1153 HZ3 LYS 148 2HZ LYS 148 11.618 4.148 -18.861 1154 HA PRO 149 HA PRO 149 7.934 9.298 -14.273 1155 HB2 PRO 149 2HB PRO 149 10.247 10.909 -13.940 1156 HB3 PRO 149 1HB PRO 149 8.847 10.816 -12.871 1157 HG2 PRO 149 2HG PRO 149 11.435 9.963 -12.257 1158 HG3 PRO 149 1HG PRO 149 9.964 9.530 -11.374 1159 HD2 PRO 149 2HD PRO 149 11.486 7.972 -13.406 1160 HD3 PRO 149 1HD PRO 149 10.587 7.405 -11.983 Start of MODEL 20 1 H1 MET 1 H1 MET 1 -63.755 36.752 44.994 2 H2 MET 1 H2 MET 1 -64.646 36.085 43.719 3 H3 MET 1 H3 MET 1 -62.953 36.168 43.619 4 HA MET 1 HA MET 1 -62.725 34.618 45.432 5 HB2 MET 1 2HB MET 1 -65.750 34.537 45.307 6 HB3 MET 1 1HB MET 1 -64.761 33.398 46.203 7 HG2 MET 1 2HG MET 1 -65.622 34.989 47.735 8 HG3 MET 1 1HG MET 1 -63.897 35.294 47.549 9 HE1 MET 1 2HE MET 1 -65.592 38.836 48.161 10 HE2 MET 1 3HE MET 1 -64.478 37.638 48.819 11 HE3 MET 1 1HE MET 1 -66.208 37.304 48.777 12 H GLY 2 HN GLY 2 -62.504 32.403 44.926 13 HA2 GLY 2 2HA GLY 2 -62.590 30.525 43.551 14 HA3 GLY 2 1HA GLY 2 -63.787 31.346 42.556 15 H HIS 3 HN HIS 3 -60.343 31.163 43.291 16 HA HIS 3 HA HIS 3 -59.808 32.447 40.688 17 HB2 HIS 3 2HB HIS 3 -59.217 33.847 42.671 18 HB3 HIS 3 1HB HIS 3 -58.080 32.599 43.167 19 HD1 HIS 3 1HD HIS 3 -55.761 32.756 42.229 20 HD2 HIS 3 2HD HIS 3 -58.492 35.090 40.120 21 HE1 HIS 3 1HE HIS 3 -54.391 34.134 40.628 22 HE2 HIS 3 2HE HIS 3 -56.043 35.677 39.515 23 H HIS 4 HN HIS 4 -59.939 30.184 39.919 24 HA HIS 4 HA HIS 4 -57.246 29.013 40.017 25 HB2 HIS 4 2HB HIS 4 -59.851 27.484 40.233 26 HB3 HIS 4 1HB HIS 4 -58.308 26.727 39.858 27 HD1 HIS 4 1HD HIS 4 -60.384 26.808 42.546 28 HD2 HIS 4 2HD HIS 4 -56.405 27.935 42.124 29 HE1 HIS 4 1HE HIS 4 -59.416 26.765 44.868 30 HE2 HIS 4 2HE HIS 4 -57.089 27.696 44.606 31 H HIS 5 HN HIS 5 -57.834 26.906 38.226 32 HA HIS 5 HA HIS 5 -58.021 26.401 36.015 33 HB2 HIS 5 2HB HIS 5 -59.667 28.935 35.823 34 HB3 HIS 5 1HB HIS 5 -59.483 27.750 34.538 35 HD1 HIS 5 1HD HIS 5 -61.877 28.737 36.849 36 HD2 HIS 5 2HD HIS 5 -60.333 25.020 35.787 37 HE1 HIS 5 1HE HIS 5 -63.611 27.052 37.554 38 HE2 HIS 5 2HE HIS 5 -62.645 24.806 36.938 39 H HIS 6 HN HIS 6 -55.935 28.149 37.185 40 HA HIS 6 HA HIS 6 -55.230 29.788 34.848 41 HB2 HIS 6 2HB HIS 6 -55.433 30.937 37.068 42 HB3 HIS 6 1HB HIS 6 -54.071 29.975 37.634 43 HD1 HIS 6 1HD HIS 6 -51.802 30.927 37.227 44 HD2 HIS 6 2HD HIS 6 -54.713 32.656 34.802 45 HE1 HIS 6 1HE HIS 6 -50.647 32.799 35.997 46 HE2 HIS 6 2HE HIS 6 -52.375 33.673 34.381 47 H HIS 7 HN HIS 7 -54.134 28.501 33.507 48 HA HIS 7 HA HIS 7 -51.428 27.958 33.996 49 HB2 HIS 7 2HB HIS 7 -52.422 26.096 35.387 50 HB3 HIS 7 1HB HIS 7 -53.095 25.433 33.901 51 HD1 HIS 7 1HD HIS 7 -51.493 24.215 32.308 52 HD2 HIS 7 2HD HIS 7 -49.627 25.828 35.663 53 HE1 HIS 7 1HE HIS 7 -49.179 23.225 32.344 54 HE2 HIS 7 2HE HIS 7 -48.012 24.344 34.282 55 H HIS 8 HN HIS 8 -50.680 28.406 32.038 56 HA HIS 8 HA HIS 8 -51.707 26.901 29.779 57 HB2 HIS 8 2HB HIS 8 -52.013 28.873 28.341 58 HB3 HIS 8 1HB HIS 8 -53.120 28.888 29.705 59 HD1 HIS 8 1HD HIS 8 -50.907 31.028 27.884 60 HD2 HIS 8 2HD HIS 8 -52.058 30.693 31.869 61 HE1 HIS 8 1HE HIS 8 -50.340 33.241 28.945 62 HE2 HIS 8 2HE HIS 8 -50.974 32.988 31.372 63 H SER 9 HN SER 9 -50.009 26.028 28.880 64 HA SER 9 HA SER 9 -47.789 27.515 27.938 65 HB2 SER 9 2HB SER 9 -46.075 26.283 29.394 66 HB3 SER 9 1HB SER 9 -46.966 27.595 30.162 67 HG SER 9 HG SER 9 -47.381 26.117 31.610 68 H HIS 10 HN HIS 10 -47.045 26.475 26.210 69 HA HIS 10 HA HIS 10 -46.931 23.547 26.241 70 HB2 HIS 10 2HB HIS 10 -48.197 25.234 24.080 71 HB3 HIS 10 1HB HIS 10 -47.618 23.600 23.779 72 HD1 HIS 10 1HD HIS 10 -50.589 25.355 24.591 73 HD2 HIS 10 2HD HIS 10 -48.944 21.708 25.737 74 HE1 HIS 10 1HE HIS 10 -52.511 23.984 25.466 75 HE2 HIS 10 2HE HIS 10 -51.521 21.728 26.004 76 H MET 11 HN MET 11 -44.873 23.050 25.965 77 HA MET 11 HA MET 11 -43.284 24.727 24.132 78 HB2 MET 11 2HB MET 11 -42.355 23.071 26.487 79 HB3 MET 11 1HB MET 11 -41.288 23.924 25.378 80 HG2 MET 11 2HG MET 11 -42.347 26.050 26.045 81 HG3 MET 11 1HG MET 11 -43.331 25.167 27.208 82 HE1 MET 11 3HE MET 11 -39.677 26.238 26.206 83 HE2 MET 11 1HE MET 11 -39.599 24.474 26.250 84 HE3 MET 11 2HE MET 11 -38.731 25.430 27.453 85 H ASP 12 HN ASP 12 -43.747 23.653 22.281 86 HA ASP 12 HA ASP 12 -43.009 20.799 22.131 87 HB2 ASP 12 2HB ASP 12 -45.342 21.326 21.483 88 HB3 ASP 12 1HB ASP 12 -44.744 22.442 20.260 89 H TYR 13 HN TYR 13 -41.415 20.174 20.731 90 HA TYR 13 HA TYR 13 -39.996 22.374 19.392 91 HB2 TYR 13 2HB TYR 13 -37.903 21.111 19.828 92 HB3 TYR 13 1HB TYR 13 -38.720 21.614 21.302 93 HD1 TYR 13 1HD TYR 13 -40.041 19.901 22.604 94 HD2 TYR 13 2HD TYR 13 -37.466 18.832 19.389 95 HE1 TYR 13 1HE TYR 13 -40.018 17.577 23.403 96 HE2 TYR 13 2HE TYR 13 -37.446 16.503 20.175 97 HH TYR 13 HH TYR 13 -37.798 15.304 22.366 98 HA PRO 14 HA PRO 14 -40.430 19.915 15.683 99 HB2 PRO 14 2HB PRO 14 -38.554 21.768 14.449 100 HB3 PRO 14 1HB PRO 14 -40.276 21.560 14.127 101 HG2 PRO 14 2HG PRO 14 -39.242 23.774 15.318 102 HG3 PRO 14 1HG PRO 14 -40.883 23.181 15.632 103 HD2 PRO 14 2HD PRO 14 -38.399 22.852 17.274 104 HD3 PRO 14 1HD PRO 14 -40.063 23.191 17.800 105 H SER 15 HN SER 15 -38.985 18.711 14.230 106 HA SER 15 HA SER 15 -36.206 18.555 14.968 107 HB2 SER 15 2HB SER 15 -36.507 15.983 15.314 108 HB3 SER 15 1HB SER 15 -36.833 17.088 16.653 109 HG SER 15 HG SER 15 -39.085 17.016 15.863 110 H PHE 16 HN PHE 16 -35.418 18.786 13.017 111 HA PHE 16 HA PHE 16 -35.773 16.670 11.079 112 HB2 PHE 16 2HB PHE 16 -37.573 18.281 10.502 113 HB3 PHE 16 1HB PHE 16 -36.369 19.554 10.357 114 HD1 PHE 16 1HD PHE 16 -37.293 16.236 8.960 115 HD2 PHE 16 2HD PHE 16 -35.386 19.981 8.306 116 HE1 PHE 16 1HE PHE 16 -36.996 15.668 6.583 117 HE2 PHE 16 2HE PHE 16 -35.087 19.421 5.932 118 HZ PHE 16 HZ PHE 16 -35.892 17.260 5.066 119 H ASP 17 HN ASP 17 -33.867 16.329 9.977 120 HA ASP 17 HA ASP 17 -31.824 18.409 10.160 121 HB2 ASP 17 2HB ASP 17 -30.145 16.862 11.041 122 HB3 ASP 17 1HB ASP 17 -31.492 17.030 12.159 123 H LYS 18 HN LYS 18 -30.373 18.451 8.572 124 HA LYS 18 HA LYS 18 -29.500 16.267 7.054 125 HB2 LYS 18 2HB LYS 18 -30.364 16.881 4.832 126 HB3 LYS 18 1HB LYS 18 -31.653 16.394 5.918 127 HG2 LYS 18 2HG LYS 18 -32.181 18.783 6.296 128 HG3 LYS 18 1HG LYS 18 -30.956 19.205 5.094 129 HD2 LYS 18 2HD LYS 18 -32.159 17.923 3.401 130 HD3 LYS 18 1HD LYS 18 -33.368 17.461 4.599 131 HE2 LYS 18 2HE LYS 18 -34.309 19.236 3.364 132 HE3 LYS 18 1HE LYS 18 -33.824 19.918 4.914 133 HZ1 LYS 18 3HZ LYS 18 -33.177 21.408 3.203 134 HZ2 LYS 18 1HZ LYS 18 -32.410 20.183 2.318 135 HZ3 LYS 18 2HZ LYS 18 -31.762 20.699 3.800 136 H PHE 19 HN PHE 19 -28.412 17.456 4.846 137 HA PHE 19 HA PHE 19 -27.202 19.936 5.731 138 HB2 PHE 19 2HB PHE 19 -25.855 18.046 6.741 139 HB3 PHE 19 1HB PHE 19 -25.445 17.555 5.102 140 HD1 PHE 19 2HD PHE 19 -25.047 20.178 7.641 141 HD2 PHE 19 1HD PHE 19 -23.811 18.745 3.829 142 HE1 PHE 19 2HE PHE 19 -23.157 21.752 7.666 143 HE2 PHE 19 1HE PHE 19 -21.916 20.313 3.851 144 HZ PHE 19 HZ PHE 19 -21.586 21.821 5.770 145 H LEU 20 HN LEU 20 -27.183 18.385 1.952 146 HA LEU 20 HA LEU 20 -26.859 16.826 4.402 147 HB2 LEU 20 2HB LEU 20 -27.901 14.985 2.948 148 HB3 LEU 20 1HB LEU 20 -28.946 16.249 3.557 149 HG LEU 20 HG LEU 20 -28.680 17.369 1.283 150 HD11 LEU 20 1HD1 LEU 20 -28.067 15.947 -0.585 151 HD12 LEU 20 2HD1 LEU 20 -27.658 14.641 0.526 152 HD13 LEU 20 3HD1 LEU 20 -26.712 16.129 0.531 153 HD21 LEU 20 3HD2 LEU 20 -30.709 16.234 1.968 154 HD22 LEU 20 1HD2 LEU 20 -30.035 14.687 1.457 155 HD23 LEU 20 2HD2 LEU 20 -30.382 15.936 0.261 156 H GLY 21 HN GLY 21 -25.041 17.996 2.087 157 HA2 GLY 21 2HA GLY 21 -22.747 16.840 2.178 158 HA3 GLY 21 1HA GLY 21 -23.624 15.504 1.440 159 H THR 22 HN THR 22 -23.059 15.386 -0.625 160 HA THR 22 HA THR 22 -23.088 15.890 -2.837 161 HB THR 22 HB THR 22 -24.093 18.633 -2.060 162 HG1 THR 22 1HG THR 22 -25.350 16.139 -2.406 163 HG21 THR 22 3HG2 THR 22 -24.968 18.692 -4.361 164 HG22 THR 22 1HG2 THR 22 -24.197 17.141 -4.688 165 HG23 THR 22 2HG2 THR 22 -23.209 18.560 -4.338 166 H GLU 23 HN GLU 23 -21.537 18.143 -0.632 167 HA GLU 23 HA GLU 23 -19.786 19.157 -2.721 168 HB2 GLU 23 2HB GLU 23 -19.751 19.739 0.246 169 HB3 GLU 23 1HB GLU 23 -18.866 20.614 -0.998 170 HG2 GLU 23 2HG GLU 23 -21.143 21.124 -2.019 171 HG3 GLU 23 1HG GLU 23 -21.818 20.556 -0.496 172 H ASN 24 HN ASN 24 -19.724 16.327 -1.970 173 HA ASN 24 HA ASN 24 -17.221 15.935 -0.566 174 HB2 ASN 24 2HB ASN 24 -19.026 13.963 -1.988 175 HB3 ASN 24 1HB ASN 24 -17.630 13.529 -1.012 176 HD21 ASN 24 1HD2 ASN 24 -18.177 15.593 0.994 177 HD22 ASN 24 2HD2 ASN 24 -19.537 15.030 1.901 178 H ALA 25 HN ALA 25 -17.303 17.431 -3.111 179 HA ALA 25 HA ALA 25 -16.506 15.954 -5.330 180 HB1 ALA 25 1HB ALA 25 -15.731 18.053 -6.251 181 HB2 ALA 25 2HB ALA 25 -15.748 18.789 -4.649 182 HB3 ALA 25 3HB ALA 25 -17.260 18.289 -5.407 183 H GLU 26 HN GLU 26 -14.573 17.320 -2.707 184 HA GLU 26 HA GLU 26 -12.053 16.902 -3.883 185 HB2 GLU 26 2HB GLU 26 -12.800 17.030 -0.957 186 HB3 GLU 26 1HB GLU 26 -11.157 17.104 -1.581 187 HG2 GLU 26 2HG GLU 26 -11.880 19.124 -2.903 188 HG3 GLU 26 1HG GLU 26 -13.364 19.102 -1.954 189 H LEU 27 HN LEU 27 -14.188 14.793 -2.111 190 HA LEU 27 HA LEU 27 -12.274 12.735 -1.650 191 HB2 LEU 27 2HB LEU 27 -15.282 12.838 -1.560 192 HB3 LEU 27 1HB LEU 27 -14.399 11.356 -1.295 193 HG LEU 27 HG LEU 27 -14.953 12.228 0.841 194 HD11 LEU 27 1HD1 LEU 27 -12.754 12.619 1.848 195 HD12 LEU 27 2HD1 LEU 27 -12.070 12.856 0.239 196 HD13 LEU 27 3HD1 LEU 27 -12.728 11.287 0.694 197 HD21 LEU 27 3HD2 LEU 27 -15.441 14.522 0.217 198 HD22 LEU 27 1HD2 LEU 27 -13.725 14.833 -0.047 199 HD23 LEU 27 2HD2 LEU 27 -14.318 14.474 1.576 200 H VAL 28 HN VAL 28 -14.682 13.431 -4.118 201 HA VAL 28 HA VAL 28 -14.381 11.037 -5.599 202 HB VAL 28 HB VAL 28 -15.195 13.757 -6.647 203 HG11 VAL 28 1HG1 VAL 28 -16.448 12.442 -8.324 204 HG12 VAL 28 2HG1 VAL 28 -15.734 10.968 -7.672 205 HG13 VAL 28 3HG1 VAL 28 -14.706 12.186 -8.425 206 HG21 VAL 28 3HG2 VAL 28 -17.500 13.076 -6.199 207 HG22 VAL 28 1HG2 VAL 28 -16.555 13.140 -4.712 208 HG23 VAL 28 2HG2 VAL 28 -16.923 11.583 -5.460 209 H TYR 29 HN TYR 29 -12.677 14.064 -5.509 210 HA TYR 29 HA TYR 29 -11.197 13.831 -7.901 211 HB2 TYR 29 2HB TYR 29 -11.552 15.906 -6.474 212 HB3 TYR 29 1HB TYR 29 -10.346 15.256 -5.371 213 HD1 TYR 29 2HD TYR 29 -7.987 15.135 -6.045 214 HD2 TYR 29 1HD TYR 29 -10.930 16.858 -8.583 215 HE1 TYR 29 2HE TYR 29 -6.212 16.207 -7.366 216 HE2 TYR 29 1HE TYR 29 -9.166 17.930 -9.915 217 HH TYR 29 HH TYR 29 -5.985 17.054 -9.799 218 H VAL 30 HN VAL 30 -10.689 12.659 -4.635 219 HA VAL 30 HA VAL 30 -7.948 11.946 -5.034 220 HB VAL 30 HB VAL 30 -9.852 11.174 -2.818 221 HG11 VAL 30 1HG1 VAL 30 -6.846 10.910 -2.956 222 HG12 VAL 30 2HG1 VAL 30 -8.002 9.579 -2.997 223 HG13 VAL 30 3HG1 VAL 30 -7.849 10.569 -1.547 224 HG21 VAL 30 3HG2 VAL 30 -7.706 13.292 -2.936 225 HG22 VAL 30 1HG2 VAL 30 -8.694 12.896 -1.530 226 HG23 VAL 30 2HG2 VAL 30 -9.446 13.581 -2.971 227 H LEU 31 HN LEU 31 -11.010 10.136 -5.039 228 HA LEU 31 HA LEU 31 -9.915 7.586 -4.823 229 HB2 LEU 31 2HB LEU 31 -12.036 6.736 -5.731 230 HB3 LEU 31 1HB LEU 31 -12.243 7.892 -4.436 231 HG LEU 31 HG LEU 31 -12.593 9.600 -6.403 232 HD11 LEU 31 1HD1 LEU 31 -12.011 8.070 -8.207 233 HD12 LEU 31 2HD1 LEU 31 -13.694 8.584 -8.336 234 HD13 LEU 31 3HD1 LEU 31 -13.306 6.981 -7.714 235 HD21 LEU 31 3HD2 LEU 31 -14.257 9.025 -4.728 236 HD22 LEU 31 1HD2 LEU 31 -14.650 7.546 -5.607 237 HD23 LEU 31 2HD2 LEU 31 -14.992 9.119 -6.330 238 H ARG 32 HN ARG 32 -9.512 5.925 -6.298 239 HA ARG 32 HA ARG 32 -8.877 6.747 -9.032 240 HB2 ARG 32 2HB ARG 32 -6.998 7.022 -7.072 241 HB3 ARG 32 1HB ARG 32 -6.677 5.381 -7.613 242 HG2 ARG 32 2HG ARG 32 -5.258 6.881 -8.812 243 HG3 ARG 32 1HG ARG 32 -6.464 6.237 -9.926 244 HD2 ARG 32 2HD ARG 32 -7.746 8.263 -9.798 245 HD3 ARG 32 1HD ARG 32 -6.694 8.901 -8.536 246 HE ARG 32 HE ARG 32 -5.218 8.288 -10.888 247 HH11 ARG 32 1HH1 ARG 32 -7.380 10.668 -9.509 248 HH12 ARG 32 2HH1 ARG 32 -6.787 11.976 -10.486 249 HH21 ARG 32 1HH2 ARG 32 -4.424 9.991 -12.185 250 HH22 ARG 32 2HH2 ARG 32 -5.100 11.588 -12.022 251 H HIS 33 HN HIS 33 -10.822 4.945 -8.203 252 HA HIS 33 HA HIS 33 -11.663 2.888 -8.680 253 HB2 HIS 33 2HB HIS 33 -9.036 2.505 -10.127 254 HB3 HIS 33 1HB HIS 33 -10.340 1.329 -10.141 255 HD1 HIS 33 1HD HIS 33 -8.984 3.584 -12.335 256 HD2 HIS 33 2HD HIS 33 -12.878 3.039 -10.970 257 HE1 HIS 33 1HE HIS 33 -10.469 4.609 -14.086 258 HE2 HIS 33 2HE HIS 33 -12.814 4.106 -13.332 259 H LYS 34 HN LYS 34 -10.829 0.371 -8.576 260 HA LYS 34 HA LYS 34 -9.607 0.157 -5.911 261 HB2 LYS 34 2HB LYS 34 -10.667 -2.037 -5.763 262 HB3 LYS 34 1HB LYS 34 -11.867 -0.813 -6.151 263 HG2 LYS 34 2HG LYS 34 -11.823 -1.488 -8.488 264 HG3 LYS 34 1HG LYS 34 -10.584 -2.689 -8.127 265 HD2 LYS 34 2HD LYS 34 -12.654 -3.846 -8.245 266 HD3 LYS 34 1HD LYS 34 -12.222 -3.750 -6.539 267 HE2 LYS 34 2HE LYS 34 -13.971 -1.647 -7.731 268 HE3 LYS 34 1HE LYS 34 -14.660 -3.219 -7.342 269 HZ1 LYS 34 3HZ LYS 34 -13.261 -1.423 -5.430 270 HZ2 LYS 34 1HZ LYS 34 -13.929 -2.939 -5.059 271 HZ3 LYS 34 2HZ LYS 34 -14.934 -1.656 -5.530 272 H HIS 35 HN HIS 35 -8.667 -2.364 -5.853 273 HA HIS 35 HA HIS 35 -6.896 -2.735 -8.138 274 HB2 HIS 35 2HB HIS 35 -5.886 -2.296 -5.315 275 HB3 HIS 35 1HB HIS 35 -4.899 -2.902 -6.638 276 HD1 HIS 35 1HD HIS 35 -5.596 0.106 -4.921 277 HD2 HIS 35 2HD HIS 35 -4.990 -0.864 -8.914 278 HE1 HIS 35 1HE HIS 35 -4.993 2.267 -6.053 279 HE2 HIS 35 2HE HIS 35 -4.828 1.686 -8.499 280 H GLY 36 HN GLY 36 -5.238 -4.664 -7.185 281 HA2 GLY 36 2HA GLY 36 -6.998 -6.927 -6.948 282 HA3 GLY 36 1HA GLY 36 -5.244 -6.968 -7.020 283 H GLN 37 HN GLN 37 -5.452 -8.654 -5.384 284 HA GLN 37 HA GLN 37 -6.428 -7.922 -2.775 285 HB2 GLN 37 2HB GLN 37 -5.067 -10.356 -3.881 286 HB3 GLN 37 1HB GLN 37 -5.254 -10.146 -2.148 287 HG2 GLN 37 2HG GLN 37 -7.713 -9.905 -2.530 288 HG3 GLN 37 1HG GLN 37 -7.425 -10.358 -4.210 289 HE21 GLN 37 1HE2 GLN 37 -7.339 -11.440 -0.891 290 HE22 GLN 37 2HE2 GLN 37 -7.277 -13.137 -1.243 291 H PHE 38 HN PHE 38 -3.254 -9.262 -3.614 292 HA PHE 38 HA PHE 38 -2.103 -7.561 -1.514 293 HB2 PHE 38 2HB PHE 38 -0.921 -10.034 -2.795 294 HB3 PHE 38 1HB PHE 38 -0.295 -9.176 -1.392 295 HD1 PHE 38 1HD PHE 38 -1.678 -9.153 0.718 296 HD2 PHE 38 2HD PHE 38 -2.524 -11.720 -2.567 297 HE1 PHE 38 1HE PHE 38 -3.015 -10.595 2.194 298 HE2 PHE 38 2HE PHE 38 -3.863 -13.170 -1.095 299 HZ PHE 38 HZ PHE 38 -4.110 -12.606 1.288 300 H ILE 39 HN ILE 39 -1.559 -5.688 -2.517 301 HA ILE 39 HA ILE 39 0.106 -5.926 -4.946 302 HB ILE 39 HB ILE 39 -1.736 -3.637 -4.234 303 HG12 ILE 39 2HG1 ILE 39 -2.985 -5.651 -4.877 304 HG13 ILE 39 1HG1 ILE 39 -3.123 -4.396 -6.106 305 HG21 ILE 39 1HG2 ILE 39 0.186 -2.875 -5.485 306 HG22 ILE 39 2HG2 ILE 39 -1.242 -2.848 -6.520 307 HG23 ILE 39 3HG2 ILE 39 -0.058 -4.144 -6.687 308 HD11 ILE 39 3HD1 ILE 39 -2.834 -6.601 -7.094 309 HD12 ILE 39 1HD1 ILE 39 -1.310 -6.801 -6.229 310 HD13 ILE 39 2HD1 ILE 39 -1.465 -5.556 -7.469 311 H TYR 40 HN TYR 40 2.122 -5.304 -4.684 312 HA TYR 40 HA TYR 40 2.729 -3.231 -2.682 313 HB2 TYR 40 2HB TYR 40 3.863 -5.492 -2.456 314 HB3 TYR 40 1HB TYR 40 4.673 -5.158 -3.980 315 HD1 TYR 40 2HD TYR 40 6.271 -3.201 -4.102 316 HD2 TYR 40 1HD TYR 40 4.669 -4.614 -0.422 317 HE1 TYR 40 2HE TYR 40 8.065 -2.045 -2.882 318 HE2 TYR 40 1HE TYR 40 6.456 -3.457 0.806 319 HH TYR 40 HH TYR 40 8.378 -1.098 -0.539 320 H VAL 41 HN VAL 41 2.769 -1.302 -3.654 321 HA VAL 41 HA VAL 41 3.645 -1.097 -6.423 322 HB VAL 41 HB VAL 41 3.040 1.335 -6.177 323 HG11 VAL 41 1HG1 VAL 41 0.888 -0.706 -5.616 324 HG12 VAL 41 2HG1 VAL 41 1.515 -0.249 -7.202 325 HG13 VAL 41 3HG1 VAL 41 0.614 0.921 -6.239 326 HG21 VAL 41 3HG2 VAL 41 1.604 1.962 -4.283 327 HG22 VAL 41 1HG2 VAL 41 3.243 1.565 -3.769 328 HG23 VAL 41 2HG2 VAL 41 1.939 0.405 -3.526 329 H TRP 42 HN TRP 42 5.639 -0.557 -6.991 330 HA TRP 42 HA TRP 42 7.406 0.465 -4.867 331 HB2 TRP 42 2HB TRP 42 9.108 -1.006 -5.509 332 HB3 TRP 42 1HB TRP 42 7.654 -1.990 -5.572 333 HD1 TRP 42 1HD TRP 42 6.591 -2.242 -8.203 334 HE1 TRP 42 1HE TRP 42 7.915 -2.627 -10.379 335 HE3 TRP 42 3HE TRP 42 11.184 -0.621 -6.652 336 HZ2 TRP 42 2HZ TRP 42 10.564 -2.282 -11.308 337 HZ3 TRP 42 3HZ TRP 42 13.057 -0.682 -8.241 338 HH2 TRP 42 2HH TRP 42 12.755 -1.494 -10.520 339 H GLY 43 HN GLY 43 9.229 1.699 -5.537 340 HA2 GLY 43 2HA GLY 43 10.571 2.771 -7.166 341 HA3 GLY 43 1HA GLY 43 9.270 2.575 -8.328 342 H GLU 44 HN GLU 44 10.240 4.367 -5.431 343 HA GLU 44 HA GLU 44 8.274 6.343 -5.508 344 HB2 GLU 44 2HB GLU 44 9.743 6.221 -3.612 345 HB3 GLU 44 1HB GLU 44 11.157 6.490 -4.619 346 HG2 GLU 44 2HG GLU 44 10.622 8.479 -3.358 347 HG3 GLU 44 1HG GLU 44 10.407 8.766 -5.082 348 H GLU 45 HN GLU 45 8.013 8.184 -6.609 349 HA GLU 45 HA GLU 45 9.677 8.463 -9.017 350 HB2 GLU 45 2HB GLU 45 7.319 7.734 -9.348 351 HB3 GLU 45 1HB GLU 45 6.778 9.227 -8.603 352 HG2 GLU 45 2HG GLU 45 8.486 9.189 -11.069 353 HG3 GLU 45 1HG GLU 45 6.729 9.096 -11.132 354 H GLY 46 HN GLY 46 8.016 10.182 -6.410 355 HA2 GLY 46 2HA GLY 46 9.803 12.347 -6.411 356 HA3 GLY 46 1HA GLY 46 8.423 12.786 -7.403 357 H ALA 47 HN ALA 47 9.151 11.371 -4.234 358 HA ALA 47 HA ALA 47 8.508 11.913 -2.143 359 HB1 ALA 47 1HB ALA 47 9.136 14.190 -2.820 360 HB2 ALA 47 2HB ALA 47 7.834 14.165 -1.631 361 HB3 ALA 47 3HB ALA 47 7.471 14.477 -3.329 362 H GLY 48 HN GLY 48 6.979 10.147 -2.282 363 HA2 GLY 48 2HA GLY 48 5.047 9.503 -1.175 364 HA3 GLY 48 1HA GLY 48 4.531 11.179 -1.151 365 H LYS 49 HN LYS 49 3.814 8.198 -2.298 366 HA LYS 49 HA LYS 49 2.085 9.347 -4.392 367 HB2 LYS 49 2HB LYS 49 3.428 6.631 -4.455 368 HB3 LYS 49 1HB LYS 49 2.306 7.248 -5.658 369 HG2 LYS 49 2HG LYS 49 5.016 8.404 -5.028 370 HG3 LYS 49 1HG LYS 49 4.615 7.394 -6.419 371 HD2 LYS 49 2HD LYS 49 3.018 9.092 -7.181 372 HD3 LYS 49 1HD LYS 49 3.443 10.107 -5.801 373 HE2 LYS 49 2HE LYS 49 5.757 10.209 -6.605 374 HE3 LYS 49 1HE LYS 49 5.314 9.216 -7.993 375 HZ1 LYS 49 3HZ LYS 49 4.372 11.961 -7.364 376 HZ2 LYS 49 1HZ LYS 49 3.697 10.994 -8.589 377 HZ3 LYS 49 2HZ LYS 49 5.324 11.470 -8.685 378 H SER 50 HN SER 50 1.872 8.603 -1.476 379 HA SER 50 HA SER 50 0.447 6.183 -1.214 380 HB2 SER 50 2HB SER 50 0.497 8.502 0.718 381 HB3 SER 50 1HB SER 50 0.194 6.802 1.090 382 HG SER 50 HG SER 50 2.292 6.317 0.745 383 H HIS 51 HN HIS 51 -0.599 9.087 -2.490 384 HA HIS 51 HA HIS 51 -3.156 9.407 -1.434 385 HB2 HIS 51 2HB HIS 51 -3.740 10.621 -3.452 386 HB3 HIS 51 1HB HIS 51 -2.110 11.047 -2.958 387 HD1 HIS 51 1HD HIS 51 -0.237 10.622 -4.616 388 HD2 HIS 51 2HD HIS 51 -3.896 9.061 -5.841 389 HE1 HIS 51 1HE HIS 51 0.089 9.917 -7.009 390 HE2 HIS 51 2HE HIS 51 -2.120 8.927 -7.720 391 H LEU 52 HN LEU 52 -1.973 7.067 -3.760 392 HA LEU 52 HA LEU 52 -4.572 6.293 -4.661 393 HB2 LEU 52 2HB LEU 52 -3.454 4.448 -5.790 394 HB3 LEU 52 1HB LEU 52 -2.660 5.976 -6.102 395 HG LEU 52 HG LEU 52 -1.110 5.140 -4.094 396 HD11 LEU 52 1HD1 LEU 52 -0.718 2.729 -4.289 397 HD12 LEU 52 2HD1 LEU 52 -2.105 2.600 -5.373 398 HD13 LEU 52 3HD1 LEU 52 -2.340 3.087 -3.694 399 HD21 LEU 52 3HD2 LEU 52 -0.874 4.178 -6.941 400 HD22 LEU 52 1HD2 LEU 52 0.442 4.331 -5.778 401 HD23 LEU 52 2HD2 LEU 52 -0.397 5.772 -6.353 402 H LEU 53 HN LEU 53 -2.538 5.364 -1.991 403 HA LEU 53 HA LEU 53 -3.981 2.999 -1.309 404 HB2 LEU 53 2HB LEU 53 -2.218 4.825 0.321 405 HB3 LEU 53 1HB LEU 53 -3.017 3.431 1.014 406 HG LEU 53 HG LEU 53 -1.796 2.072 -0.807 407 HD11 LEU 53 1HD1 LEU 53 -0.075 4.541 -0.792 408 HD12 LEU 53 2HD1 LEU 53 -1.063 3.987 -2.143 409 HD13 LEU 53 3HD1 LEU 53 0.297 3.011 -1.586 410 HD21 LEU 53 3HD2 LEU 53 0.176 1.861 0.617 411 HD22 LEU 53 1HD2 LEU 53 -1.303 1.941 1.573 412 HD23 LEU 53 2HD2 LEU 53 -0.259 3.356 1.445 413 H GLN 54 HN GLN 54 -4.149 6.381 -0.334 414 HA GLN 54 HA GLN 54 -6.246 6.195 1.519 415 HB2 GLN 54 2HB GLN 54 -5.639 8.504 -0.342 416 HB3 GLN 54 1HB GLN 54 -6.506 8.591 1.186 417 HG2 GLN 54 2HG GLN 54 -4.526 8.109 2.419 418 HG3 GLN 54 1HG GLN 54 -3.636 7.722 0.948 419 HE21 GLN 54 1HE2 GLN 54 -3.022 9.678 3.020 420 HE22 GLN 54 2HE2 GLN 54 -2.952 11.220 2.227 421 H ALA 55 HN ALA 55 -6.239 6.827 -1.955 422 HA ALA 55 HA ALA 55 -8.997 7.154 -2.325 423 HB1 ALA 55 1HB ALA 55 -8.534 6.764 -4.684 424 HB2 ALA 55 2HB ALA 55 -6.942 6.125 -4.275 425 HB3 ALA 55 3HB ALA 55 -7.317 7.821 -3.969 426 H TRP 56 HN TRP 56 -6.948 4.282 -2.506 427 HA TRP 56 HA TRP 56 -8.859 2.485 -3.499 428 HB2 TRP 56 2HB TRP 56 -6.472 2.010 -3.497 429 HB3 TRP 56 1HB TRP 56 -6.443 2.029 -1.740 430 HD1 TRP 56 1HD TRP 56 -8.189 -0.056 -4.526 431 HE1 TRP 56 1HE TRP 56 -8.227 -2.511 -3.734 432 HE3 TRP 56 3HE TRP 56 -6.079 0.536 0.090 433 HZ2 TRP 56 2HZ TRP 56 -7.477 -3.989 -1.456 434 HZ3 TRP 56 3HZ TRP 56 -5.775 -1.447 1.515 435 HH2 TRP 56 2HH TRP 56 -6.462 -3.662 0.757 436 H VAL 57 HN VAL 57 -7.982 3.385 -0.196 437 HA VAL 57 HA VAL 57 -9.691 1.575 1.126 438 HB VAL 57 HB VAL 57 -8.606 4.245 2.028 439 HG11 VAL 57 1HG1 VAL 57 -9.173 3.529 4.308 440 HG12 VAL 57 2HG1 VAL 57 -9.992 2.114 3.653 441 HG13 VAL 57 3HG1 VAL 57 -10.613 3.728 3.310 442 HG21 VAL 57 3HG2 VAL 57 -7.764 1.410 2.612 443 HG22 VAL 57 1HG2 VAL 57 -7.063 2.857 3.337 444 HG23 VAL 57 2HG2 VAL 57 -6.899 2.572 1.604 445 H ALA 58 HN ALA 58 -10.165 4.978 0.197 446 HA ALA 58 HA ALA 58 -12.730 5.272 1.310 447 HB1 ALA 58 1HB ALA 58 -11.299 7.146 0.657 448 HB2 ALA 58 2HB ALA 58 -12.902 7.268 -0.071 449 HB3 ALA 58 3HB ALA 58 -11.529 6.728 -1.040 450 H GLN 59 HN GLN 59 -11.668 4.124 -1.849 451 HA GLN 59 HA GLN 59 -14.186 4.108 -3.105 452 HB2 GLN 59 2HB GLN 59 -11.828 3.808 -4.119 453 HB3 GLN 59 1HB GLN 59 -12.004 2.115 -3.689 454 HG2 GLN 59 2HG GLN 59 -14.015 3.556 -5.386 455 HG3 GLN 59 1HG GLN 59 -12.587 2.786 -6.066 456 HE21 GLN 59 1HE2 GLN 59 -15.459 2.246 -6.411 457 HE22 GLN 59 2HE2 GLN 59 -15.675 0.574 -5.988 458 H ALA 60 HN ALA 60 -12.454 1.670 -1.206 459 HA ALA 60 HA ALA 60 -14.423 -0.360 -1.484 460 HB1 ALA 60 1HB ALA 60 -13.206 -1.509 0.283 461 HB2 ALA 60 2HB ALA 60 -12.296 -0.039 0.626 462 HB3 ALA 60 3HB ALA 60 -12.097 -0.859 -0.923 463 H LEU 61 HN LEU 61 -13.932 2.277 0.762 464 HA LEU 61 HA LEU 61 -15.723 1.483 2.770 465 HB2 LEU 61 2HB LEU 61 -14.878 4.224 1.843 466 HB3 LEU 61 1HB LEU 61 -15.887 3.958 3.251 467 HG LEU 61 HG LEU 61 -13.061 2.952 2.892 468 HD11 LEU 61 1HD1 LEU 61 -14.174 5.124 4.661 469 HD12 LEU 61 2HD1 LEU 61 -13.189 5.366 3.217 470 HD13 LEU 61 3HD1 LEU 61 -12.503 4.563 4.629 471 HD21 LEU 61 3HD2 LEU 61 -14.899 2.780 5.279 472 HD22 LEU 61 1HD2 LEU 61 -13.217 2.250 5.219 473 HD23 LEU 61 2HD2 LEU 61 -14.437 1.434 4.240 474 H GLU 62 HN GLU 62 -16.251 3.476 -0.136 475 HA GLU 62 HA GLU 62 -19.005 3.921 0.369 476 HB2 GLU 62 2HB GLU 62 -17.483 4.042 -2.233 477 HB3 GLU 62 1HB GLU 62 -19.123 4.634 -1.995 478 HG2 GLU 62 2HG GLU 62 -18.246 6.187 -0.271 479 HG3 GLU 62 1HG GLU 62 -16.617 5.665 -0.696 480 H ALA 63 HN ALA 63 -17.275 1.264 -0.934 481 HA ALA 63 HA ALA 63 -19.447 0.090 -2.375 482 HB1 ALA 63 1HB ALA 63 -16.946 -1.210 -1.306 483 HB2 ALA 63 2HB ALA 63 -17.102 -0.429 -2.882 484 HB3 ALA 63 3HB ALA 63 -18.037 -1.881 -2.520 485 H GLY 64 HN GLY 64 -18.723 0.386 0.919 486 HA2 GLY 64 2HA GLY 64 -20.181 -0.264 2.646 487 HA3 GLY 64 1HA GLY 64 -20.887 -1.465 1.572 488 H LYS 65 HN LYS 65 -17.460 -1.296 1.724 489 HA LYS 65 HA LYS 65 -17.426 -3.829 3.200 490 HB2 LYS 65 2HB LYS 65 -15.268 -2.573 1.487 491 HB3 LYS 65 1HB LYS 65 -15.210 -4.172 2.214 492 HG2 LYS 65 2HG LYS 65 -17.139 -3.265 0.087 493 HG3 LYS 65 1HG LYS 65 -15.725 -4.292 -0.160 494 HD2 LYS 65 2HD LYS 65 -16.717 -5.976 1.342 495 HD3 LYS 65 1HD LYS 65 -18.144 -4.954 1.521 496 HE2 LYS 65 2HE LYS 65 -18.513 -5.100 -0.914 497 HE3 LYS 65 1HE LYS 65 -17.128 -6.184 -1.036 498 HZ1 LYS 65 3HZ LYS 65 -19.145 -7.455 -0.977 499 HZ2 LYS 65 1HZ LYS 65 -19.642 -6.693 0.460 500 HZ3 LYS 65 2HZ LYS 65 -18.289 -7.717 0.466 501 H ASN 66 HN ASN 66 -15.007 -3.965 4.254 502 HA ASN 66 HA ASN 66 -14.768 -1.545 5.916 503 HB2 ASN 66 2HB ASN 66 -15.226 -3.869 6.983 504 HB3 ASN 66 1HB ASN 66 -13.537 -4.193 6.632 505 HD21 ASN 66 1HD2 ASN 66 -13.172 -4.368 8.877 506 HD22 ASN 66 2HD2 ASN 66 -13.036 -2.949 9.868 507 H ALA 67 HN ALA 67 -12.904 -0.449 5.951 508 HA ALA 67 HA ALA 67 -10.502 -1.537 4.761 509 HB1 ALA 67 1HB ALA 67 -11.891 0.816 3.480 510 HB2 ALA 67 2HB ALA 67 -11.762 -0.800 2.789 511 HB3 ALA 67 3HB ALA 67 -10.312 0.172 3.031 512 H ALA 68 HN ALA 68 -8.679 -0.492 5.429 513 HA ALA 68 HA ALA 68 -8.939 2.072 6.801 514 HB1 ALA 68 1HB ALA 68 -7.807 1.300 8.799 515 HB2 ALA 68 2HB ALA 68 -7.722 -0.338 8.147 516 HB3 ALA 68 3HB ALA 68 -9.288 0.379 8.542 517 H TYR 69 HN TYR 69 -7.127 3.312 6.727 518 HA TYR 69 HA TYR 69 -4.780 2.149 5.407 519 HB2 TYR 69 2HB TYR 69 -4.234 4.564 4.807 520 HB3 TYR 69 1HB TYR 69 -5.614 3.855 3.978 521 HD1 TYR 69 1HD TYR 69 -4.601 6.248 6.613 522 HD2 TYR 69 2HD TYR 69 -7.811 4.748 4.258 523 HE1 TYR 69 1HE TYR 69 -6.013 8.119 7.353 524 HE2 TYR 69 2HE TYR 69 -9.224 6.623 4.984 525 HH TYR 69 HH TYR 69 -7.979 9.357 6.605 526 H ILE 70 HN ILE 70 -2.858 2.279 6.370 527 HA ILE 70 HA ILE 70 -2.617 3.835 8.854 528 HB ILE 70 HB ILE 70 -1.697 0.974 8.494 529 HG12 ILE 70 2HG1 ILE 70 -3.815 2.130 10.323 530 HG13 ILE 70 1HG1 ILE 70 -4.133 1.207 8.857 531 HG21 ILE 70 1HG2 ILE 70 -1.423 2.825 10.857 532 HG22 ILE 70 2HG2 ILE 70 -0.116 2.235 9.832 533 HG23 ILE 70 3HG2 ILE 70 -1.014 1.110 10.852 534 HD11 ILE 70 3HD1 ILE 70 -2.731 0.185 11.315 535 HD12 ILE 70 1HD1 ILE 70 -3.054 -0.738 9.848 536 HD13 ILE 70 2HD1 ILE 70 -4.393 -0.165 10.840 537 H ASP 71 HN ASP 71 -0.850 5.061 8.885 538 HA ASP 71 HA ASP 71 1.432 4.275 7.221 539 HB2 ASP 71 2HB ASP 71 1.901 6.547 6.692 540 HB3 ASP 71 1HB ASP 71 0.186 6.318 6.387 541 H ALA 72 HN ALA 72 3.264 4.014 8.261 542 HA ALA 72 HA ALA 72 3.234 4.057 11.116 543 HB1 ALA 72 1HB ALA 72 4.307 2.261 9.837 544 HB2 ALA 72 2HB ALA 72 5.420 3.023 10.974 545 HB3 ALA 72 3HB ALA 72 5.511 3.411 9.255 546 H ALA 73 HN ALA 73 3.451 6.661 9.349 547 HA ALA 73 HA ALA 73 5.665 7.794 10.918 548 HB1 ALA 73 1HB ALA 73 5.795 9.566 9.177 549 HB2 ALA 73 2HB ALA 73 4.604 8.670 8.235 550 HB3 ALA 73 3HB ALA 73 6.178 7.952 8.581 551 H SER 74 HN SER 74 2.768 7.391 11.497 552 HA SER 74 HA SER 74 2.265 9.868 12.799 553 HB2 SER 74 2HB SER 74 1.583 10.522 10.527 554 HB3 SER 74 1HB SER 74 0.499 9.139 10.444 555 HG SER 74 HG SER 74 -0.854 10.628 11.106 556 H MET 75 HN MET 75 1.186 6.724 11.704 557 HA MET 75 HA MET 75 -0.375 6.444 14.188 558 HB2 MET 75 2HB MET 75 -1.105 5.439 11.434 559 HB3 MET 75 1HB MET 75 -1.926 4.949 12.907 560 HG2 MET 75 2HG MET 75 -2.563 7.285 13.304 561 HG3 MET 75 1HG MET 75 -1.783 7.737 11.791 562 HE1 MET 75 3HE MET 75 -2.497 5.419 9.804 563 HE2 MET 75 1HE MET 75 -2.662 7.131 9.414 564 HE3 MET 75 2HE MET 75 -4.001 6.024 9.108 565 HA PRO 76 HA PRO 76 1.914 2.605 14.512 566 HB2 PRO 76 2HB PRO 76 0.305 1.784 16.716 567 HB3 PRO 76 1HB PRO 76 1.899 2.536 16.775 568 HG2 PRO 76 2HG PRO 76 -0.462 3.702 17.667 569 HG3 PRO 76 1HG PRO 76 1.032 4.573 17.288 570 HD2 PRO 76 2HD PRO 76 -1.439 4.230 15.647 571 HD3 PRO 76 1HD PRO 76 -0.354 5.631 15.784 572 H LEU 77 HN LEU 77 1.362 0.225 14.662 573 HA LEU 77 HA LEU 77 -0.917 -0.333 12.951 574 HB2 LEU 77 2HB LEU 77 1.312 -1.352 12.533 575 HB3 LEU 77 1HB LEU 77 1.175 -2.212 14.054 576 HG LEU 77 HG LEU 77 -0.777 -3.430 13.197 577 HD11 LEU 77 1HD1 LEU 77 -1.614 -1.729 11.658 578 HD12 LEU 77 2HD1 LEU 77 -1.384 -3.276 10.843 579 HD13 LEU 77 3HD1 LEU 77 -0.213 -1.978 10.617 580 HD21 LEU 77 3HD2 LEU 77 0.407 -4.800 11.555 581 HD22 LEU 77 1HD2 LEU 77 1.437 -4.394 12.927 582 HD23 LEU 77 2HD2 LEU 77 1.635 -3.544 11.395 583 H THR 78 HN THR 78 -2.626 -1.710 13.515 584 HA THR 78 HA THR 78 -2.966 -2.121 16.399 585 HB THR 78 HB THR 78 -5.406 -1.614 15.996 586 HG1 THR 78 1HG THR 78 -5.699 -0.258 14.027 587 HG21 THR 78 3HG2 THR 78 -5.128 0.816 16.001 588 HG22 THR 78 1HG2 THR 78 -3.473 0.638 15.417 589 HG23 THR 78 2HG2 THR 78 -3.912 0.047 17.019 590 H ASP 79 HN ASP 79 -4.600 -3.741 16.938 591 HA ASP 79 HA ASP 79 -4.457 -6.065 15.243 592 HB2 ASP 79 2HB ASP 79 -5.600 -7.225 17.027 593 HB3 ASP 79 1HB ASP 79 -4.347 -6.218 17.734 594 H ALA 80 HN ALA 80 -6.479 -3.394 15.606 595 HA ALA 80 HA ALA 80 -8.978 -4.355 14.793 596 HB1 ALA 80 1HB ALA 80 -7.703 -1.685 14.196 597 HB2 ALA 80 2HB ALA 80 -8.638 -2.088 15.636 598 HB3 ALA 80 3HB ALA 80 -9.422 -2.064 14.057 599 H ALA 81 HN ALA 81 -6.030 -3.906 13.065 600 HA ALA 81 HA ALA 81 -6.946 -3.617 10.447 601 HB1 ALA 81 1HB ALA 81 -4.450 -5.023 11.379 602 HB2 ALA 81 2HB ALA 81 -4.624 -3.282 11.153 603 HB3 ALA 81 3HB ALA 81 -4.747 -4.365 9.768 604 H PHE 82 HN PHE 82 -6.998 -6.401 12.501 605 HA PHE 82 HA PHE 82 -7.151 -8.348 10.407 606 HB2 PHE 82 2HB PHE 82 -7.817 -8.434 13.346 607 HB3 PHE 82 1HB PHE 82 -8.049 -9.816 12.283 608 HD1 PHE 82 2HD PHE 82 -6.017 -10.638 10.971 609 HD2 PHE 82 1HD PHE 82 -5.748 -8.058 14.347 610 HE1 PHE 82 2HE PHE 82 -3.664 -11.286 11.276 611 HE2 PHE 82 1HE PHE 82 -3.392 -8.700 14.654 612 HZ PHE 82 HZ PHE 82 -2.353 -10.318 13.115 613 H GLU 83 HN GLU 83 -9.337 -6.118 11.775 614 HA GLU 83 HA GLU 83 -11.709 -7.607 11.026 615 HB2 GLU 83 2HB GLU 83 -11.398 -4.819 12.129 616 HB3 GLU 83 1HB GLU 83 -12.906 -5.697 11.960 617 HG2 GLU 83 2HG GLU 83 -12.076 -7.384 13.535 618 HG3 GLU 83 1HG GLU 83 -10.597 -6.453 13.724 619 H ALA 84 HN ALA 84 -9.636 -5.175 9.788 620 HA ALA 84 HA ALA 84 -11.539 -4.217 7.822 621 HB1 ALA 84 1HB ALA 84 -9.958 -2.652 8.852 622 HB2 ALA 84 2HB ALA 84 -9.740 -2.738 7.103 623 HB3 ALA 84 3HB ALA 84 -8.613 -3.571 8.176 624 H GLU 85 HN GLU 85 -11.943 -5.397 6.103 625 HA GLU 85 HA GLU 85 -10.337 -7.525 5.191 626 HB2 GLU 85 2HB GLU 85 -12.765 -7.313 4.737 627 HB3 GLU 85 1HB GLU 85 -12.429 -5.976 3.651 628 HG2 GLU 85 2HG GLU 85 -12.759 -7.882 2.300 629 HG3 GLU 85 1HG GLU 85 -11.032 -7.543 2.289 630 H TYR 86 HN TYR 86 -10.696 -4.189 4.106 631 HA TYR 86 HA TYR 86 -8.466 -4.552 2.228 632 HB2 TYR 86 2HB TYR 86 -10.421 -2.255 2.507 633 HB3 TYR 86 1HB TYR 86 -9.145 -2.361 1.301 634 HD1 TYR 86 1HD TYR 86 -12.237 -4.078 2.470 635 HD2 TYR 86 2HD TYR 86 -9.551 -3.384 -0.756 636 HE1 TYR 86 1HE TYR 86 -13.774 -5.242 0.948 637 HE2 TYR 86 2HE TYR 86 -11.082 -4.550 -2.289 638 HH TYR 86 HH TYR 86 -12.880 -6.215 -2.186 639 H LEU 87 HN LEU 87 -6.558 -4.231 3.205 640 HA LEU 87 HA LEU 87 -6.362 -1.965 5.081 641 HB2 LEU 87 2HB LEU 87 -6.038 -4.220 6.086 642 HB3 LEU 87 1HB LEU 87 -4.665 -4.448 5.023 643 HG LEU 87 HG LEU 87 -3.550 -2.506 6.097 644 HD11 LEU 87 1HD1 LEU 87 -5.881 -2.651 8.001 645 HD12 LEU 87 2HD1 LEU 87 -5.531 -1.332 6.884 646 HD13 LEU 87 3HD1 LEU 87 -4.431 -1.671 8.220 647 HD21 LEU 87 3HD2 LEU 87 -4.384 -4.717 7.973 648 HD22 LEU 87 1HD2 LEU 87 -2.975 -3.672 8.159 649 HD23 LEU 87 2HD2 LEU 87 -3.064 -4.796 6.802 650 H ALA 88 HN ALA 88 -5.013 -0.403 4.624 651 HA ALA 88 HA ALA 88 -2.989 -0.851 2.529 652 HB1 ALA 88 1HB ALA 88 -4.773 0.650 1.773 653 HB2 ALA 88 2HB ALA 88 -3.230 1.494 1.899 654 HB3 ALA 88 3HB ALA 88 -4.460 1.713 3.142 655 H VAL 89 HN VAL 89 -0.978 -0.779 3.291 656 HA VAL 89 HA VAL 89 -0.476 0.847 5.698 657 HB VAL 89 HB VAL 89 0.864 -1.772 4.990 658 HG11 VAL 89 1HG1 VAL 89 1.910 -1.590 7.201 659 HG12 VAL 89 2HG1 VAL 89 1.155 -0.012 7.426 660 HG13 VAL 89 3HG1 VAL 89 2.361 -0.237 6.159 661 HG21 VAL 89 3HG2 VAL 89 -1.436 -2.120 5.731 662 HG22 VAL 89 1HG2 VAL 89 -1.133 -1.138 7.165 663 HG23 VAL 89 2HG2 VAL 89 -0.298 -2.675 6.957 664 H ASP 90 HN ASP 90 0.813 2.489 5.286 665 HA ASP 90 HA ASP 90 2.876 2.168 3.201 666 HB2 ASP 90 2HB ASP 90 0.963 3.980 3.004 667 HB3 ASP 90 1HB ASP 90 1.965 4.865 4.148 668 H GLN 91 HN GLN 91 4.696 3.934 3.712 669 HA GLN 91 HA GLN 91 6.544 4.308 4.941 670 HB2 GLN 91 2HB GLN 91 4.356 4.640 6.905 671 HB3 GLN 91 1HB GLN 91 5.971 4.428 7.568 672 HG2 GLN 91 2HG GLN 91 5.532 6.748 7.347 673 HG3 GLN 91 1HG GLN 91 6.754 6.303 6.169 674 HE21 GLN 91 1HE2 GLN 91 3.332 5.689 5.812 675 HE22 GLN 91 2HE2 GLN 91 3.078 6.786 4.507 676 H VAL 92 HN VAL 92 5.911 1.639 4.279 677 HA VAL 92 HA VAL 92 6.452 -0.170 6.367 678 HB VAL 92 HB VAL 92 7.232 -0.476 3.455 679 HG11 VAL 92 1HG1 VAL 92 6.961 -2.877 3.866 680 HG12 VAL 92 2HG1 VAL 92 6.597 -2.545 5.558 681 HG13 VAL 92 3HG1 VAL 92 8.197 -2.178 4.913 682 HG21 VAL 92 3HG2 VAL 92 5.044 -1.498 3.102 683 HG22 VAL 92 1HG2 VAL 92 4.881 0.174 3.637 684 HG23 VAL 92 2HG2 VAL 92 4.600 -1.147 4.772 685 H GLU 93 HN GLU 93 8.473 -1.334 6.713 686 HA GLU 93 HA GLU 93 10.688 -1.521 7.153 687 HB2 GLU 93 2HB GLU 93 11.033 -0.868 4.767 688 HB3 GLU 93 1HB GLU 93 11.127 0.809 5.280 689 HG2 GLU 93 2HG GLU 93 13.338 0.058 4.987 690 HG3 GLU 93 1HG GLU 93 13.065 0.164 6.724 691 H LYS 94 HN LYS 94 8.911 1.351 7.650 692 HA LYS 94 HA LYS 94 10.888 2.452 9.478 693 HB2 LYS 94 2HB LYS 94 8.357 3.451 8.300 694 HB3 LYS 94 1HB LYS 94 8.793 4.062 9.892 695 HG2 LYS 94 2HG LYS 94 9.660 5.574 8.287 696 HG3 LYS 94 1HG LYS 94 11.022 4.681 8.960 697 HD2 LYS 94 2HD LYS 94 11.441 4.715 6.669 698 HD3 LYS 94 1HD LYS 94 10.742 3.122 6.945 699 HE2 LYS 94 2HE LYS 94 8.596 3.864 6.171 700 HE3 LYS 94 1HE LYS 94 9.171 5.525 6.036 701 HZ1 LYS 94 3HZ LYS 94 10.089 3.206 4.413 702 HZ2 LYS 94 1HZ LYS 94 10.722 4.777 4.314 703 HZ3 LYS 94 2HZ LYS 94 9.108 4.490 3.887 704 H LEU 95 HN LEU 95 8.872 -0.030 9.698 705 HA LEU 95 HA LEU 95 7.566 0.465 12.199 706 HB2 LEU 95 2HB LEU 95 8.150 -2.123 10.754 707 HB3 LEU 95 1HB LEU 95 7.131 -1.975 12.171 708 HG LEU 95 HG LEU 95 6.579 -0.697 9.490 709 HD11 LEU 95 1HD1 LEU 95 6.366 -3.125 9.423 710 HD12 LEU 95 2HD1 LEU 95 4.790 -2.343 9.302 711 HD13 LEU 95 3HD1 LEU 95 5.296 -3.078 10.824 712 HD21 LEU 95 3HD2 LEU 95 4.375 -0.197 10.452 713 HD22 LEU 95 1HD2 LEU 95 5.676 0.610 11.330 714 HD23 LEU 95 2HD2 LEU 95 4.916 -0.831 12.007 715 H GLY 96 HN GLY 96 8.080 -0.473 14.232 716 HA2 GLY 96 2HA GLY 96 10.940 -0.521 14.703 717 HA3 GLY 96 1HA GLY 96 9.678 -0.506 15.922 718 H ASN 97 HN ASN 97 8.470 -2.566 16.232 719 HA ASN 97 HA ASN 97 9.999 -4.947 15.530 720 HB2 ASN 97 2HB ASN 97 11.118 -4.023 17.552 721 HB3 ASN 97 1HB ASN 97 9.595 -4.163 18.422 722 HD21 ASN 97 1HD2 ASN 97 10.938 -6.428 16.076 723 HD22 ASN 97 2HD2 ASN 97 11.111 -7.741 17.190 724 H GLU 98 HN GLU 98 7.613 -3.989 17.985 725 HA GLU 98 HA GLU 98 6.199 -6.401 17.956 726 HB2 GLU 98 2HB GLU 98 5.161 -3.658 18.692 727 HB3 GLU 98 1HB GLU 98 4.468 -5.194 19.182 728 HG2 GLU 98 2HG GLU 98 6.470 -5.713 20.461 729 HG3 GLU 98 1HG GLU 98 7.199 -4.194 19.944 730 H GLU 99 HN GLU 99 5.831 -3.464 16.090 731 HA GLU 99 HA GLU 99 3.304 -4.020 14.968 732 HB2 GLU 99 2HB GLU 99 5.443 -2.483 13.516 733 HB3 GLU 99 1HB GLU 99 3.704 -2.238 13.481 734 HG2 GLU 99 2HG GLU 99 4.261 -0.502 14.803 735 HG3 GLU 99 1HG GLU 99 4.114 -1.739 16.053 736 H GLN 100 HN GLN 100 6.543 -5.043 14.116 737 HA GLN 100 HA GLN 100 5.835 -5.971 11.507 738 HB2 GLN 100 2HB GLN 100 8.250 -6.621 13.202 739 HB3 GLN 100 1HB GLN 100 8.058 -7.041 11.505 740 HG2 GLN 100 2HG GLN 100 7.808 -4.582 11.039 741 HG3 GLN 100 1HG GLN 100 8.301 -4.300 12.707 742 HE21 GLN 100 1HE2 GLN 100 9.586 -3.523 10.224 743 HE22 GLN 100 2HE2 GLN 100 11.180 -4.198 10.259 744 H ALA 101 HN ALA 101 5.985 -7.375 14.710 745 HA ALA 101 HA ALA 101 5.576 -10.071 13.906 746 HB1 ALA 101 1HB ALA 101 4.917 -8.709 16.515 747 HB2 ALA 101 2HB ALA 101 6.429 -9.520 16.116 748 HB3 ALA 101 3HB ALA 101 4.938 -10.452 16.246 749 H LEU 102 HN LEU 102 3.435 -7.423 14.812 750 HA LEU 102 HA LEU 102 0.987 -8.828 14.592 751 HB2 LEU 102 2HB LEU 102 1.558 -6.485 15.607 752 HB3 LEU 102 1HB LEU 102 1.303 -5.902 13.977 753 HG LEU 102 HG LEU 102 -0.656 -5.605 15.440 754 HD11 LEU 102 1HD1 LEU 102 -2.340 -6.482 13.920 755 HD12 LEU 102 2HD1 LEU 102 -1.131 -7.530 13.179 756 HD13 LEU 102 3HD1 LEU 102 -0.985 -5.779 13.036 757 HD21 LEU 102 3HD2 LEU 102 -1.982 -7.547 16.103 758 HD22 LEU 102 1HD2 LEU 102 -0.383 -7.562 16.845 759 HD23 LEU 102 2HD2 LEU 102 -0.727 -8.612 15.471 760 H LEU 103 HN LEU 103 2.819 -6.793 12.360 761 HA LEU 103 HA LEU 103 1.219 -6.937 10.103 762 HB2 LEU 103 2HB LEU 103 3.238 -5.517 10.415 763 HB3 LEU 103 1HB LEU 103 4.240 -6.936 10.215 764 HG LEU 103 HG LEU 103 3.983 -5.327 8.239 765 HD11 LEU 103 1HD1 LEU 103 5.051 -7.490 8.042 766 HD12 LEU 103 2HD1 LEU 103 4.074 -7.148 6.614 767 HD13 LEU 103 3HD1 LEU 103 3.482 -8.268 7.843 768 HD21 LEU 103 3HD2 LEU 103 2.064 -5.756 6.775 769 HD22 LEU 103 1HD2 LEU 103 1.574 -5.062 8.321 770 HD23 LEU 103 2HD2 LEU 103 1.354 -6.785 8.020 771 H PHE 104 HN PHE 104 3.789 -9.166 11.127 772 HA PHE 104 HA PHE 104 3.595 -11.039 9.082 773 HB2 PHE 104 2HB PHE 104 5.363 -11.229 10.672 774 HB3 PHE 104 1HB PHE 104 4.234 -11.367 12.012 775 HD1 PHE 104 1HD PHE 104 5.068 -13.118 8.819 776 HD2 PHE 104 2HD PHE 104 3.844 -13.446 12.880 777 HE1 PHE 104 1HE PHE 104 5.115 -15.569 8.631 778 HE2 PHE 104 2HE PHE 104 3.891 -15.900 12.700 779 HZ PHE 104 HZ PHE 104 4.524 -16.963 10.573 780 H SER 105 HN SER 105 1.806 -10.856 12.113 781 HA SER 105 HA SER 105 0.230 -13.147 11.826 782 HB2 SER 105 2HB SER 105 0.531 -11.666 13.879 783 HB3 SER 105 1HB SER 105 -0.655 -10.584 13.155 784 HG SER 105 HG SER 105 -1.220 -12.527 14.695 785 H ILE 106 HN ILE 106 -0.219 -9.848 10.666 786 HA ILE 106 HA ILE 106 -2.791 -10.106 9.583 787 HB ILE 106 HB ILE 106 -0.481 -8.407 8.624 788 HG12 ILE 106 2HG1 ILE 106 -2.874 -7.733 10.349 789 HG13 ILE 106 1HG1 ILE 106 -1.230 -7.975 10.936 790 HG21 ILE 106 1HG2 ILE 106 -2.118 -8.707 6.833 791 HG22 ILE 106 2HG2 ILE 106 -2.141 -7.053 7.447 792 HG23 ILE 106 3HG2 ILE 106 -3.407 -8.188 7.920 793 HD11 ILE 106 3HD1 ILE 106 -2.128 -5.807 9.048 794 HD12 ILE 106 1HD1 ILE 106 -0.490 -6.037 9.661 795 HD13 ILE 106 2HD1 ILE 106 -1.797 -5.617 10.769 796 H PHE 107 HN PHE 107 0.392 -10.636 8.059 797 HA PHE 107 HA PHE 107 -0.572 -11.479 5.561 798 HB2 PHE 107 2HB PHE 107 1.993 -11.722 7.033 799 HB3 PHE 107 1HB PHE 107 1.740 -12.828 5.686 800 HD1 PHE 107 1HD PHE 107 1.528 -12.000 3.425 801 HD2 PHE 107 2HD PHE 107 2.285 -9.366 6.674 802 HE1 PHE 107 1HE PHE 107 2.199 -10.250 1.840 803 HE2 PHE 107 2HE PHE 107 2.959 -7.604 5.091 804 HZ PHE 107 HZ PHE 107 2.916 -8.047 2.671 805 H ASN 108 HN ASN 108 -0.098 -13.201 8.573 806 HA ASN 108 HA ASN 108 -0.512 -15.817 7.614 807 HB2 ASN 108 2HB ASN 108 0.289 -15.371 9.896 808 HB3 ASN 108 1HB ASN 108 -1.266 -14.650 10.306 809 HD21 ASN 108 1HD2 ASN 108 -1.809 -16.077 11.880 810 HD22 ASN 108 2HD2 ASN 108 -2.168 -17.746 11.570 811 H ARG 109 HN ARG 109 -2.840 -13.577 9.143 812 HA ARG 109 HA ARG 109 -5.117 -15.122 8.807 813 HB2 ARG 109 2HB ARG 109 -5.084 -13.129 10.210 814 HB3 ARG 109 1HB ARG 109 -4.860 -12.106 8.802 815 HG2 ARG 109 2HG ARG 109 -7.281 -13.835 8.919 816 HG3 ARG 109 1HG ARG 109 -7.215 -12.397 9.938 817 HD2 ARG 109 2HD ARG 109 -6.851 -10.996 7.999 818 HD3 ARG 109 1HD ARG 109 -6.771 -12.410 6.952 819 HE ARG 109 HE ARG 109 -9.239 -12.544 8.176 820 HH11 ARG 109 1HH1 ARG 109 -7.574 -10.213 6.148 821 HH12 ARG 109 2HH1 ARG 109 -9.030 -9.640 5.396 822 HH21 ARG 109 1HH2 ARG 109 -11.164 -11.760 7.160 823 HH22 ARG 109 2HH2 ARG 109 -11.043 -10.508 5.954 824 H PHE 110 HN PHE 110 -3.788 -12.686 6.591 825 HA PHE 110 HA PHE 110 -5.911 -12.808 4.746 826 HB2 PHE 110 2HB PHE 110 -3.066 -11.859 4.549 827 HB3 PHE 110 1HB PHE 110 -4.127 -11.850 3.144 828 HD1 PHE 110 2HD PHE 110 -4.800 -10.992 6.722 829 HD2 PHE 110 1HD PHE 110 -4.630 -9.645 2.687 830 HE1 PHE 110 2HE PHE 110 -5.710 -8.814 7.411 831 HE2 PHE 110 1HE PHE 110 -5.545 -7.469 3.375 832 HZ PHE 110 HZ PHE 110 -6.082 -7.049 5.737 833 H ARG 111 HN ARG 111 -2.685 -14.364 4.600 834 HA ARG 111 HA ARG 111 -3.416 -15.678 2.147 835 HB2 ARG 111 2HB ARG 111 -0.954 -15.309 3.686 836 HB3 ARG 111 1HB ARG 111 -1.074 -16.874 2.890 837 HG2 ARG 111 2HG ARG 111 -1.405 -14.211 1.514 838 HG3 ARG 111 1HG ARG 111 0.066 -15.192 1.502 839 HD2 ARG 111 2HD ARG 111 -0.986 -16.930 0.299 840 HD3 ARG 111 1HD ARG 111 -2.590 -16.260 0.586 841 HE ARG 111 HE ARG 111 -0.829 -14.555 -0.939 842 HH11 ARG 111 1HH1 ARG 111 -3.189 -17.147 -1.059 843 HH12 ARG 111 2HH1 ARG 111 -3.714 -16.764 -2.680 844 HH21 ARG 111 1HH2 ARG 111 -1.502 -14.066 -3.086 845 HH22 ARG 111 2HH2 ARG 111 -2.731 -15.039 -3.832 846 H ASN 112 HN ASN 112 -3.691 -16.469 5.470 847 HA ASN 112 HA ASN 112 -3.490 -19.280 5.330 848 HB2 ASN 112 2HB ASN 112 -3.764 -17.625 7.382 849 HB3 ASN 112 1HB ASN 112 -5.470 -17.998 7.166 850 HD21 ASN 112 1HD2 ASN 112 -2.393 -19.140 8.152 851 HD22 ASN 112 2HD2 ASN 112 -2.920 -20.652 8.812 852 H SER 113 HN SER 113 -6.275 -17.096 5.052 853 HA SER 113 HA SER 113 -7.948 -19.327 4.174 854 HB2 SER 113 2HB SER 113 -8.715 -16.453 4.761 855 HB3 SER 113 1HB SER 113 -9.819 -17.800 4.490 856 HG SER 113 HG SER 113 -7.940 -18.195 6.473 857 H GLY 114 HN GLY 114 -5.903 -17.136 2.788 858 HA2 GLY 114 2HA GLY 114 -5.605 -16.373 0.639 859 HA3 GLY 114 1HA GLY 114 -6.839 -17.527 0.147 860 H LYS 115 HN LYS 115 -7.124 -14.836 2.407 861 HA LYS 115 HA LYS 115 -9.143 -13.620 0.669 862 HB2 LYS 115 2HB LYS 115 -10.076 -15.186 2.449 863 HB3 LYS 115 1HB LYS 115 -9.481 -14.047 3.642 864 HG2 LYS 115 2HG LYS 115 -10.957 -12.365 2.873 865 HG3 LYS 115 1HG LYS 115 -11.406 -13.328 1.462 866 HD2 LYS 115 2HD LYS 115 -12.385 -15.022 2.951 867 HD3 LYS 115 1HD LYS 115 -11.964 -14.030 4.346 868 HE2 LYS 115 2HE LYS 115 -13.766 -13.125 2.110 869 HE3 LYS 115 1HE LYS 115 -14.343 -13.837 3.615 870 HZ1 LYS 115 3HZ LYS 115 -14.429 -11.448 3.723 871 HZ2 LYS 115 1HZ LYS 115 -12.776 -11.323 3.347 872 HZ3 LYS 115 2HZ LYS 115 -13.268 -12.017 4.819 873 H GLY 116 HN GLY 116 -9.805 -11.443 1.784 874 HA2 GLY 116 2HA GLY 116 -9.175 -9.451 2.810 875 HA3 GLY 116 1HA GLY 116 -7.642 -10.186 3.248 876 H PHE 117 HN PHE 117 -7.846 -7.602 2.287 877 HA PHE 117 HA PHE 117 -6.348 -7.837 -0.233 878 HB2 PHE 117 2HB PHE 117 -8.395 -5.713 0.456 879 HB3 PHE 117 1HB PHE 117 -7.340 -5.674 -0.949 880 HD1 PHE 117 2HD PHE 117 -10.131 -7.516 0.634 881 HD2 PHE 117 1HD PHE 117 -7.884 -6.841 -2.912 882 HE1 PHE 117 2HE PHE 117 -11.807 -8.769 -0.658 883 HE2 PHE 117 1HE PHE 117 -9.558 -8.089 -4.214 884 HZ PHE 117 HZ PHE 117 -11.525 -9.056 -3.084 885 H LEU 118 HN LEU 118 -4.464 -6.701 -0.244 886 HA LEU 118 HA LEU 118 -3.951 -4.862 1.988 887 HB2 LEU 118 2HB LEU 118 -3.126 -7.205 2.487 888 HB3 LEU 118 1HB LEU 118 -2.018 -6.996 1.147 889 HG LEU 118 HG LEU 118 -0.980 -5.086 2.309 890 HD11 LEU 118 1HD1 LEU 118 -1.471 -4.713 4.671 891 HD12 LEU 118 2HD1 LEU 118 -2.784 -5.885 4.586 892 HD13 LEU 118 3HD1 LEU 118 -2.877 -4.384 3.662 893 HD21 LEU 118 3HD2 LEU 118 -1.073 -7.642 3.900 894 HD22 LEU 118 1HD2 LEU 118 0.181 -6.406 4.001 895 HD23 LEU 118 2HD2 LEU 118 -0.037 -7.324 2.510 896 H LEU 119 HN LEU 119 -2.730 -3.181 1.491 897 HA LEU 119 HA LEU 119 -1.433 -3.098 -1.145 898 HB2 LEU 119 2HB LEU 119 -3.609 -1.906 -1.183 899 HB3 LEU 119 1HB LEU 119 -3.046 -0.874 0.115 900 HG LEU 119 HG LEU 119 -1.318 0.058 -1.351 901 HD11 LEU 119 1HD1 LEU 119 -0.910 -1.886 -2.751 902 HD12 LEU 119 2HD1 LEU 119 -1.308 -0.480 -3.740 903 HD13 LEU 119 3HD1 LEU 119 -2.519 -1.733 -3.458 904 HD21 LEU 119 3HD2 LEU 119 -4.078 0.093 -2.571 905 HD22 LEU 119 1HD2 LEU 119 -2.800 1.269 -2.877 906 HD23 LEU 119 2HD2 LEU 119 -3.503 1.132 -1.265 907 H LEU 120 HN LEU 120 0.651 -2.687 -0.945 908 HA LEU 120 HA LEU 120 1.572 -1.214 1.441 909 HB2 LEU 120 2HB LEU 120 2.961 -3.497 0.032 910 HB3 LEU 120 1HB LEU 120 3.586 -2.616 1.412 911 HG LEU 120 HG LEU 120 1.091 -4.319 1.441 912 HD11 LEU 120 1HD1 LEU 120 3.103 -5.665 1.147 913 HD12 LEU 120 2HD1 LEU 120 2.428 -5.881 2.762 914 HD13 LEU 120 3HD1 LEU 120 3.850 -4.865 2.528 915 HD21 LEU 120 3HD2 LEU 120 2.604 -2.977 3.678 916 HD22 LEU 120 1HD2 LEU 120 1.208 -4.039 3.860 917 HD23 LEU 120 2HD2 LEU 120 1.032 -2.481 3.051 918 H GLY 121 HN GLY 121 3.331 0.178 1.183 919 HA2 GLY 121 2HA GLY 121 4.395 0.508 -1.536 920 HA3 GLY 121 1HA GLY 121 3.709 1.902 -0.712 921 H SER 122 HN SER 122 5.768 2.909 -0.893 922 HA SER 122 HA SER 122 7.646 3.750 0.069 923 HB2 SER 122 2HB SER 122 7.242 1.639 2.197 924 HB3 SER 122 1HB SER 122 8.362 2.998 2.292 925 HG SER 122 HG SER 122 5.704 3.607 1.730 926 H GLU 123 HN GLU 123 9.880 3.409 0.064 927 HA GLU 123 HA GLU 123 11.858 2.458 -0.449 928 HB2 GLU 123 2HB GLU 123 10.384 0.335 0.956 929 HB3 GLU 123 1HB GLU 123 11.730 -0.227 -0.024 930 HG2 GLU 123 2HG GLU 123 12.292 0.228 2.353 931 HG3 GLU 123 1HG GLU 123 13.275 1.111 1.187 932 H TYR 124 HN TYR 124 12.522 -0.028 -1.522 933 HA TYR 124 HA TYR 124 11.500 0.370 -4.228 934 HB2 TYR 124 2HB TYR 124 13.965 -1.104 -3.286 935 HB3 TYR 124 1HB TYR 124 13.494 -0.873 -4.968 936 HD1 TYR 124 1HD TYR 124 13.353 1.500 -5.862 937 HD2 TYR 124 2HD TYR 124 15.193 0.550 -2.142 938 HE1 TYR 124 1HE TYR 124 14.513 3.669 -5.890 939 HE2 TYR 124 2HE TYR 124 16.364 2.713 -2.162 940 HH TYR 124 HH TYR 124 17.107 4.392 -3.893 941 H THR 125 HN THR 125 12.865 -2.618 -2.866 942 HA THR 125 HA THR 125 10.267 -3.896 -3.346 943 HB THR 125 HB THR 125 11.636 -5.896 -4.247 944 HG1 THR 125 1HG THR 125 13.457 -4.213 -5.386 945 HG21 THR 125 3HG2 THR 125 10.096 -4.615 -5.634 946 HG22 THR 125 1HG2 THR 125 11.551 -5.018 -6.543 947 HG23 THR 125 2HG2 THR 125 11.334 -3.389 -5.907 948 HA PRO 126 HA PRO 126 10.867 -6.012 0.513 949 HB2 PRO 126 2HB PRO 126 9.823 -8.430 -0.848 950 HB3 PRO 126 1HB PRO 126 9.215 -7.595 0.582 951 HG2 PRO 126 2HG PRO 126 7.933 -7.422 -1.744 952 HG3 PRO 126 1HG PRO 126 8.061 -6.014 -0.669 953 HD2 PRO 126 2HD PRO 126 9.606 -6.654 -3.156 954 HD3 PRO 126 1HD PRO 126 8.952 -5.097 -2.605 955 H GLN 127 HN GLN 127 12.175 -7.098 -2.420 956 HA GLN 127 HA GLN 127 13.628 -9.370 -1.574 957 HB2 GLN 127 2HB GLN 127 14.125 -7.478 -3.879 958 HB3 GLN 127 1HB GLN 127 14.889 -9.049 -3.677 959 HG2 GLN 127 2HG GLN 127 12.845 -10.189 -3.997 960 HG3 GLN 127 1HG GLN 127 11.912 -8.698 -3.866 961 HE21 GLN 127 1HE2 GLN 127 10.938 -9.010 -5.853 962 HE22 GLN 127 2HE2 GLN 127 11.797 -8.806 -7.347 963 H GLN 128 HN GLN 128 14.109 -6.010 -1.119 964 HA GLN 128 HA GLN 128 16.839 -6.543 -0.173 965 HB2 GLN 128 2HB GLN 128 17.499 -4.299 -0.967 966 HB3 GLN 128 1HB GLN 128 17.025 -5.371 -2.277 967 HG2 GLN 128 2HG GLN 128 14.768 -4.282 -2.212 968 HG3 GLN 128 1HG GLN 128 15.457 -3.100 -1.098 969 HE21 GLN 128 1HE2 GLN 128 15.455 -4.310 -4.351 970 HE22 GLN 128 2HE2 GLN 128 16.319 -2.986 -5.063 971 H LEU 129 HN LEU 129 13.941 -6.035 0.938 972 HA LEU 129 HA LEU 129 14.356 -3.803 2.697 973 HB2 LEU 129 2HB LEU 129 12.302 -6.011 2.680 974 HB3 LEU 129 1HB LEU 129 12.313 -4.707 3.846 975 HG LEU 129 HG LEU 129 11.915 -4.438 0.870 976 HD11 LEU 129 1HD1 LEU 129 10.057 -3.990 3.203 977 HD12 LEU 129 2HD1 LEU 129 9.975 -5.319 2.045 978 HD13 LEU 129 3HD1 LEU 129 9.681 -3.664 1.511 979 HD21 LEU 129 3HD2 LEU 129 12.000 -2.320 3.015 980 HD22 LEU 129 1HD2 LEU 129 11.528 -2.060 1.335 981 HD23 LEU 129 2HD2 LEU 129 13.178 -2.545 1.724 982 H VAL 130 HN VAL 130 14.400 -4.009 5.067 983 HA VAL 130 HA VAL 130 16.284 -6.098 5.820 984 HB VAL 130 HB VAL 130 15.237 -3.869 7.578 985 HG11 VAL 130 1HG1 VAL 130 17.332 -4.232 8.816 986 HG12 VAL 130 2HG1 VAL 130 17.725 -5.568 7.732 987 HG13 VAL 130 3HG1 VAL 130 16.316 -5.674 8.787 988 HG21 VAL 130 3HG2 VAL 130 16.200 -2.846 5.628 989 HG22 VAL 130 1HG2 VAL 130 17.623 -3.883 5.736 990 HG23 VAL 130 2HG2 VAL 130 17.321 -2.668 6.978 991 H ILE 131 HN ILE 131 14.460 -7.657 5.424 992 HA ILE 131 HA ILE 131 12.892 -7.997 7.890 993 HB ILE 131 HB ILE 131 11.212 -9.206 6.468 994 HG12 ILE 131 2HG1 ILE 131 12.748 -7.871 4.231 995 HG13 ILE 131 1HG1 ILE 131 12.602 -9.603 4.503 996 HG21 ILE 131 1HG2 ILE 131 10.121 -7.147 5.701 997 HG22 ILE 131 2HG2 ILE 131 11.630 -6.266 5.945 998 HG23 ILE 131 3HG2 ILE 131 10.793 -6.980 7.322 999 HD11 ILE 131 3HD1 ILE 131 10.212 -9.477 4.051 1000 HD12 ILE 131 1HD1 ILE 131 11.159 -8.853 2.701 1001 HD13 ILE 131 2HD1 ILE 131 10.346 -7.737 3.800 1002 H ARG 132 HN ARG 132 12.327 -10.258 8.360 1003 HA ARG 132 HA ARG 132 14.656 -11.941 7.900 1004 HB2 ARG 132 2HB ARG 132 12.297 -12.460 9.720 1005 HB3 ARG 132 1HB ARG 132 13.863 -13.262 9.755 1006 HG2 ARG 132 2HG ARG 132 14.901 -11.069 10.315 1007 HG3 ARG 132 1HG ARG 132 13.278 -10.394 10.450 1008 HD2 ARG 132 2HD ARG 132 13.931 -10.947 12.644 1009 HD3 ARG 132 1HD ARG 132 12.807 -12.210 12.143 1010 HE ARG 132 HE ARG 132 15.698 -12.664 11.881 1011 HH11 ARG 132 1HH1 ARG 132 12.600 -13.491 13.280 1012 HH12 ARG 132 2HH1 ARG 132 13.193 -14.912 14.087 1013 HH21 ARG 132 1HH2 ARG 132 16.502 -14.506 12.944 1014 HH22 ARG 132 2HH2 ARG 132 15.432 -15.487 13.904 1015 H GLU 133 HN GLU 133 14.167 -14.373 7.675 1016 HA GLU 133 HA GLU 133 13.308 -14.604 5.032 1017 HB2 GLU 133 2HB GLU 133 13.692 -16.796 7.067 1018 HB3 GLU 133 1HB GLU 133 13.591 -17.023 5.325 1019 HG2 GLU 133 2HG GLU 133 15.607 -15.659 5.045 1020 HG3 GLU 133 1HG GLU 133 15.722 -15.492 6.798 1021 H ASP 134 HN ASP 134 11.609 -15.605 7.997 1022 HA ASP 134 HA ASP 134 9.562 -17.000 6.619 1023 HB2 ASP 134 2HB ASP 134 10.229 -17.291 9.050 1024 HB3 ASP 134 1HB ASP 134 9.326 -15.817 9.385 1025 H LEU 135 HN LEU 135 9.923 -13.675 7.634 1026 HA LEU 135 HA LEU 135 7.227 -12.947 6.886 1027 HB2 LEU 135 2HB LEU 135 8.712 -11.845 8.683 1028 HB3 LEU 135 1HB LEU 135 9.528 -11.058 7.350 1029 HG LEU 135 HG LEU 135 6.557 -10.782 7.759 1030 HD11 LEU 135 1HD1 LEU 135 8.735 -9.038 8.903 1031 HD12 LEU 135 2HD1 LEU 135 7.662 -10.091 9.823 1032 HD13 LEU 135 3HD1 LEU 135 7.003 -8.703 8.955 1033 HD21 LEU 135 3HD2 LEU 135 7.432 -10.106 5.582 1034 HD22 LEU 135 1HD2 LEU 135 8.610 -9.055 6.373 1035 HD23 LEU 135 2HD2 LEU 135 6.887 -8.706 6.506 1036 H ARG 136 HN ARG 136 10.449 -12.836 5.548 1037 HA ARG 136 HA ARG 136 10.054 -11.179 3.330 1038 HB2 ARG 136 2HB ARG 136 12.204 -12.177 4.364 1039 HB3 ARG 136 1HB ARG 136 11.881 -13.571 3.347 1040 HG2 ARG 136 2HG ARG 136 12.073 -12.207 1.359 1041 HG3 ARG 136 1HG ARG 136 12.291 -10.759 2.350 1042 HD2 ARG 136 2HD ARG 136 14.278 -11.962 3.390 1043 HD3 ARG 136 1HD ARG 136 14.132 -13.121 2.071 1044 HE ARG 136 HE ARG 136 14.410 -11.066 0.590 1045 HH11 ARG 136 1HH1 ARG 136 15.837 -11.393 3.769 1046 HH12 ARG 136 2HH1 ARG 136 17.184 -10.353 3.416 1047 HH21 ARG 136 1HH2 ARG 136 16.200 -9.681 0.127 1048 HH22 ARG 136 2HH2 ARG 136 17.390 -9.396 1.363 1049 H THR 137 HN THR 137 9.568 -14.644 3.759 1050 HA THR 137 HA THR 137 8.969 -15.235 1.059 1051 HB THR 137 HB THR 137 7.749 -17.249 2.217 1052 HG1 THR 137 1HG THR 137 9.454 -16.639 4.361 1053 HG21 THR 137 3HG2 THR 137 9.918 -18.369 2.520 1054 HG22 THR 137 1HG2 THR 137 10.730 -16.804 2.460 1055 HG23 THR 137 2HG2 THR 137 9.885 -17.414 1.038 1056 H ARG 138 HN ARG 138 6.957 -14.264 3.811 1057 HA ARG 138 HA ARG 138 4.443 -14.580 2.611 1058 HB2 ARG 138 2HB ARG 138 5.388 -12.547 4.638 1059 HB3 ARG 138 1HB ARG 138 3.702 -12.842 4.234 1060 HG2 ARG 138 2HG ARG 138 5.503 -15.014 5.243 1061 HG3 ARG 138 1HG ARG 138 4.613 -13.947 6.326 1062 HD2 ARG 138 2HD ARG 138 2.511 -14.653 5.318 1063 HD3 ARG 138 1HD ARG 138 3.386 -15.677 4.181 1064 HE ARG 138 HE ARG 138 4.219 -16.561 6.610 1065 HH11 ARG 138 1HH1 ARG 138 1.046 -16.111 5.185 1066 HH12 ARG 138 2HH1 ARG 138 0.337 -17.448 6.039 1067 HH21 ARG 138 1HH2 ARG 138 3.295 -18.267 7.747 1068 HH22 ARG 138 2HH2 ARG 138 1.615 -18.661 7.533 1069 H MET 139 HN MET 139 6.816 -12.003 2.439 1070 HA MET 139 HA MET 139 5.232 -10.089 1.098 1071 HB2 MET 139 2HB MET 139 8.202 -10.513 1.333 1072 HB3 MET 139 1HB MET 139 7.532 -9.194 0.387 1073 HG2 MET 139 2HG MET 139 7.016 -9.661 3.315 1074 HG3 MET 139 1HG MET 139 8.194 -8.529 2.652 1075 HE1 MET 139 3HE MET 139 5.912 -7.696 4.724 1076 HE2 MET 139 1HE MET 139 5.374 -6.167 4.029 1077 HE3 MET 139 2HE MET 139 7.094 -6.560 4.071 1078 H ALA 140 HN ALA 140 6.899 -12.926 0.022 1079 HA ALA 140 HA ALA 140 7.088 -12.188 -2.731 1080 HB1 ALA 140 1HB ALA 140 7.201 -14.921 -1.461 1081 HB2 ALA 140 2HB ALA 140 8.577 -13.853 -1.737 1082 HB3 ALA 140 3HB ALA 140 7.689 -14.518 -3.109 1083 H TYR 141 HN TYR 141 4.511 -13.151 -0.759 1084 HA TYR 141 HA TYR 141 2.964 -14.325 -2.919 1085 HB2 TYR 141 2HB TYR 141 2.400 -13.816 -0.002 1086 HB3 TYR 141 1HB TYR 141 1.150 -14.358 -1.114 1087 HD1 TYR 141 1HD TYR 141 1.370 -16.573 -2.220 1088 HD2 TYR 141 2HD TYR 141 4.031 -15.333 0.857 1089 HE1 TYR 141 1HE TYR 141 2.080 -18.902 -1.907 1090 HE2 TYR 141 2HE TYR 141 4.747 -17.665 1.183 1091 HH TYR 141 HH TYR 141 3.783 -19.962 0.774 1092 H CYS 142 HN CYS 142 3.838 -11.308 -2.284 1093 HA CYS 142 HA CYS 142 1.255 -10.135 -2.999 1094 HB2 CYS 142 2HB CYS 142 3.761 -8.812 -1.930 1095 HB3 CYS 142 1HB CYS 142 2.267 -7.979 -2.338 1096 HG CYS 142 HG CYS 142 3.121 -9.200 0.515 1097 H LEU 143 HN LEU 143 1.070 -8.934 -4.821 1098 HA LEU 143 HA LEU 143 2.891 -9.556 -6.951 1099 HB2 LEU 143 2HB LEU 143 0.406 -7.859 -6.841 1100 HB3 LEU 143 1HB LEU 143 1.340 -8.076 -8.298 1101 HG LEU 143 HG LEU 143 0.903 -10.561 -8.024 1102 HD11 LEU 143 1HD1 LEU 143 -1.048 -11.207 -6.730 1103 HD12 LEU 143 2HD1 LEU 143 -1.207 -9.559 -6.127 1104 HD13 LEU 143 3HD1 LEU 143 0.200 -10.529 -5.682 1105 HD21 LEU 143 3HD2 LEU 143 -1.314 -10.395 -9.035 1106 HD22 LEU 143 1HD2 LEU 143 -0.203 -9.197 -9.699 1107 HD23 LEU 143 2HD2 LEU 143 -1.417 -8.713 -8.514 1108 H VAL 144 HN VAL 144 3.929 -7.964 -8.300 1109 HA VAL 144 HA VAL 144 4.795 -5.616 -6.759 1110 HB VAL 144 HB VAL 144 6.393 -7.142 -8.831 1111 HG11 VAL 144 1HG1 VAL 144 6.998 -4.794 -8.713 1112 HG12 VAL 144 2HG1 VAL 144 8.273 -5.801 -8.028 1113 HG13 VAL 144 3HG1 VAL 144 7.184 -4.915 -6.962 1114 HG21 VAL 144 3HG2 VAL 144 6.077 -8.482 -6.823 1115 HG22 VAL 144 1HG2 VAL 144 6.664 -7.147 -5.830 1116 HG23 VAL 144 2HG2 VAL 144 7.748 -7.940 -6.973 1117 H TYR 145 HN TYR 145 4.070 -3.792 -7.593 1118 HA TYR 145 HA TYR 145 3.893 -3.556 -10.511 1119 HB2 TYR 145 2HB TYR 145 1.750 -2.946 -8.501 1120 HB3 TYR 145 1HB TYR 145 1.787 -2.120 -10.057 1121 HD1 TYR 145 2HD TYR 145 2.081 -3.751 -12.128 1122 HD2 TYR 145 1HD TYR 145 0.517 -4.917 -8.350 1123 HE1 TYR 145 2HE TYR 145 0.983 -5.679 -13.182 1124 HE2 TYR 145 1HE TYR 145 -0.577 -6.856 -9.399 1125 HH TYR 145 HH TYR 145 -1.365 -7.567 -11.589 1126 H GLU 146 HN GLU 146 4.281 -1.590 -11.379 1127 HA GLU 146 HA GLU 146 6.007 0.130 -9.886 1128 HB2 GLU 146 2HB GLU 146 5.999 1.426 -12.078 1129 HB3 GLU 146 1HB GLU 146 6.575 -0.235 -12.155 1130 HG2 GLU 146 2HG GLU 146 4.570 -0.993 -13.142 1131 HG3 GLU 146 1HG GLU 146 3.736 0.514 -12.781 1132 H VAL 147 HN VAL 147 5.486 1.954 -8.810 1133 HA VAL 147 HA VAL 147 2.820 3.074 -9.261 1134 HB VAL 147 HB VAL 147 3.264 2.625 -6.942 1135 HG11 VAL 147 1HG1 VAL 147 5.678 2.676 -6.922 1136 HG12 VAL 147 2HG1 VAL 147 5.032 3.760 -5.690 1137 HG13 VAL 147 3HG1 VAL 147 5.666 4.419 -7.198 1138 HG21 VAL 147 3HG2 VAL 147 2.890 4.847 -5.974 1139 HG22 VAL 147 1HG2 VAL 147 1.914 4.571 -7.418 1140 HG23 VAL 147 2HG2 VAL 147 3.358 5.580 -7.509 1141 H LYS 148 HN LYS 148 3.174 4.091 -11.194 1142 HA LYS 148 HA LYS 148 4.922 6.451 -11.095 1143 HB2 LYS 148 2HB LYS 148 4.536 4.511 -13.382 1144 HB3 LYS 148 1HB LYS 148 5.279 6.091 -13.571 1145 HG2 LYS 148 2HG LYS 148 7.077 5.478 -12.099 1146 HG3 LYS 148 1HG LYS 148 6.301 3.932 -11.742 1147 HD2 LYS 148 2HD LYS 148 6.592 3.203 -14.011 1148 HD3 LYS 148 1HD LYS 148 7.176 4.797 -14.495 1149 HE2 LYS 148 2HE LYS 148 8.543 2.962 -12.526 1150 HE3 LYS 148 1HE LYS 148 8.998 3.158 -14.220 1151 HZ1 LYS 148 3HZ LYS 148 9.168 5.172 -12.046 1152 HZ2 LYS 148 1HZ LYS 148 9.309 5.584 -13.690 1153 HZ3 LYS 148 2HZ LYS 148 10.430 4.532 -12.980 1154 HA PRO 149 HA PRO 149 1.304 8.657 -12.443 1155 HB2 PRO 149 2HB PRO 149 2.491 10.832 -13.554 1156 HB3 PRO 149 1HB PRO 149 2.382 10.584 -11.808 1157 HG2 PRO 149 2HG PRO 149 4.683 10.119 -13.650 1158 HG3 PRO 149 1HG PRO 149 4.677 10.786 -12.008 1159 HD2 PRO 149 2HD PRO 149 5.365 8.209 -12.591 1160 HD3 PRO 149 1HD PRO 149 4.679 8.712 -11.035
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