NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
640584 | 6o1q | 30575 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 -28.428 18.987 7.961 2 H2 GLY 1 HT2 GLY 1 -29.984 19.560 8.288 3 H3 GLY 1 HT3 GLY 1 -28.942 19.169 9.561 4 HA2 GLY 1 HA1 GLY 1 -29.073 21.559 9.294 5 HA3 GLY 1 HA2 GLY 1 -27.454 20.963 8.950 6 HA PRO 2 HA PRO 2 -28.775 23.416 5.283 7 HB2 PRO 2 HB2 PRO 2 -26.828 25.239 5.265 8 HB3 PRO 2 HB1 PRO 2 -28.174 25.359 6.406 9 HG2 PRO 2 HG2 PRO 2 -25.379 24.408 6.861 10 HG3 PRO 2 HG1 PRO 2 -26.416 25.386 7.913 11 HD2 PRO 2 HD2 PRO 2 -26.009 22.641 8.147 12 HD3 PRO 2 HD1 PRO 2 -27.355 23.545 8.864 13 H MET 3 HN MET 3 -26.957 20.968 5.572 14 HA MET 3 HA MET 3 -25.470 21.419 3.070 15 HB2 MET 3 HB2 MET 3 -24.568 19.801 5.463 16 HB3 MET 3 HB1 MET 3 -23.774 19.775 3.896 17 HG2 MET 3 HG2 MET 3 -23.251 22.138 4.103 18 HG3 MET 3 HG1 MET 3 -24.092 22.199 5.650 19 HE1 MET 3 HE1 MET 3 -20.213 19.800 4.919 20 HE2 MET 3 HE2 MET 3 -21.068 20.706 3.671 21 HE3 MET 3 HE3 MET 3 -21.789 19.250 4.352 22 H ALA 4 HN ALA 4 -28.137 20.423 3.488 23 HA ALA 4 HA ALA 4 -28.039 17.547 3.246 24 HB1 ALA 4 HB1 ALA 4 -29.872 18.637 4.449 25 HB2 ALA 4 HB2 ALA 4 -30.465 17.680 3.092 26 HB3 ALA 4 HB3 ALA 4 -30.372 19.435 2.958 27 H MET 5 HN MET 5 -26.498 18.385 1.283 28 HA MET 5 HA MET 5 -27.919 17.506 -1.072 29 HB2 MET 5 HB2 MET 5 -27.218 19.424 -2.471 30 HB3 MET 5 HB1 MET 5 -28.368 19.884 -1.226 31 HG2 MET 5 HG2 MET 5 -26.545 20.783 0.128 32 HG3 MET 5 HG1 MET 5 -25.390 20.318 -1.120 33 HE1 MET 5 HE1 MET 5 -25.591 23.272 0.059 34 HE2 MET 5 HE2 MET 5 -25.460 24.225 -1.418 35 HE3 MET 5 HE3 MET 5 -24.446 22.799 -1.197 36 H LEU 6 HN LEU 6 -26.023 16.221 0.349 37 HA LEU 6 HA LEU 6 -23.376 16.714 -0.647 38 HB2 LEU 6 HB2 LEU 6 -24.459 14.274 0.774 39 HB3 LEU 6 HB1 LEU 6 -22.766 14.670 0.547 40 HG LEU 6 HG LEU 6 -24.734 16.227 2.228 41 HD11 LEU 6 HD11 LEU 6 -22.406 14.478 3.009 42 HD12 LEU 6 HD12 LEU 6 -24.113 14.092 3.222 43 HD13 LEU 6 HD13 LEU 6 -23.395 15.435 4.111 44 HD21 LEU 6 HD21 LEU 6 -23.058 17.684 1.208 45 HD22 LEU 6 HD22 LEU 6 -21.775 16.642 1.821 46 HD23 LEU 6 HD23 LEU 6 -22.803 17.530 2.946 47 H ALA 7 HN ALA 7 -22.812 16.273 -2.665 48 HA ALA 7 HA ALA 7 -24.254 14.333 -4.241 49 HB1 ALA 7 HB1 ALA 7 -23.550 16.455 -5.225 50 HB2 ALA 7 HB2 ALA 7 -22.846 15.083 -6.079 51 HB3 ALA 7 HB3 ALA 7 -21.863 16.021 -4.956 52 H ARG 8 HN ARG 8 -21.508 14.343 -2.256 53 HA ARG 8 HA ARG 8 -19.894 12.417 -3.537 54 HB2 ARG 8 HB2 ARG 8 -19.029 13.867 -1.787 55 HB3 ARG 8 HB1 ARG 8 -20.137 13.167 -0.619 56 HG2 ARG 8 HG2 ARG 8 -17.940 12.278 -0.264 57 HG3 ARG 8 HG1 ARG 8 -18.984 10.999 -0.878 58 HD2 ARG 8 HD2 ARG 8 -18.045 11.239 -3.086 59 HD3 ARG 8 HD1 ARG 8 -17.080 12.619 -2.562 60 HE ARG 8 HE ARG 8 -16.257 10.685 -0.889 61 HH11 ARG 8 HH11 ARG 8 -16.621 10.770 -4.368 62 HH12 ARG 8 HH12 ARG 8 -15.342 9.635 -4.656 63 HH21 ARG 8 HH21 ARG 8 -14.573 9.192 -1.259 64 HH22 ARG 8 HH22 ARG 8 -14.174 8.738 -2.892 65 H ARG 9 HN ARG 9 -21.832 11.950 -0.577 66 HA ARG 9 HA ARG 9 -22.904 10.152 0.287 67 HB2 ARG 9 HB2 ARG 9 -23.372 9.635 -2.649 68 HB3 ARG 9 HB1 ARG 9 -24.130 8.701 -1.368 69 HG2 ARG 9 HG2 ARG 9 -25.206 10.709 -0.517 70 HG3 ARG 9 HG1 ARG 9 -24.423 11.668 -1.774 71 HD2 ARG 9 HD2 ARG 9 -26.707 11.170 -2.403 72 HD3 ARG 9 HD1 ARG 9 -25.584 10.348 -3.484 73 HE ARG 9 HE ARG 9 -26.149 8.506 -1.540 74 HH11 ARG 9 HH11 ARG 9 -28.041 10.399 -3.789 75 HH12 ARG 9 HH12 ARG 9 -29.307 9.221 -3.924 76 HH21 ARG 9 HH21 ARG 9 -27.798 6.929 -1.731 77 HH22 ARG 9 HH22 ARG 9 -29.156 7.234 -2.768 78 H GLN 10 HN GLN 10 -20.426 9.751 0.637 79 HA GLN 10 HA GLN 10 -19.424 7.364 -0.654 80 HB2 GLN 10 HB2 GLN 10 -17.911 9.218 -0.084 81 HB3 GLN 10 HB1 GLN 10 -18.303 9.022 1.616 82 HG2 GLN 10 HG2 GLN 10 -17.304 6.776 1.567 83 HG3 GLN 10 HG1 GLN 10 -16.868 7.026 -0.125 84 HE21 GLN 10 HE21 GLN 10 -16.265 7.978 3.164 85 HE22 GLN 10 HE22 GLN 10 -14.752 8.757 2.869 86 H ARG 11 HN ARG 11 -21.168 5.983 0.017 87 HA ARG 11 HA ARG 11 -21.539 5.387 2.807 88 HB2 ARG 11 HB2 ARG 11 -23.449 5.192 1.360 89 HB3 ARG 11 HB1 ARG 11 -22.585 4.111 0.277 90 HG2 ARG 11 HG2 ARG 11 -22.420 2.558 2.333 91 HG3 ARG 11 HG1 ARG 11 -23.724 3.556 2.982 92 HD2 ARG 11 HD2 ARG 11 -24.596 1.581 1.831 93 HD3 ARG 11 HD1 ARG 11 -25.086 3.070 1.024 94 HE ARG 11 HE ARG 11 -22.739 1.597 0.040 95 HH11 ARG 11 HH11 ARG 11 -26.032 2.690 -0.425 96 HH12 ARG 11 HH12 ARG 11 -26.029 2.380 -2.133 97 HH21 ARG 11 HH21 ARG 11 -22.705 1.242 -2.207 98 HH22 ARG 11 HH22 ARG 11 -24.136 1.557 -3.147 99 H ASP 12 HN ASP 12 -20.389 3.543 0.006 100 HA ASP 12 HA ASP 12 -19.777 1.226 1.485 101 HB2 ASP 12 HB2 ASP 12 -18.799 2.081 -1.248 102 HB3 ASP 12 HB1 ASP 12 -18.613 0.467 -0.570 103 HA PRO 13 HA PRO 13 -15.947 2.353 3.444 104 HB2 PRO 13 HB2 PRO 13 -15.559 -0.593 3.386 105 HB3 PRO 13 HB1 PRO 13 -15.502 0.520 4.757 106 HG2 PRO 13 HG2 PRO 13 -17.579 -1.121 4.392 107 HG3 PRO 13 HG1 PRO 13 -17.800 0.521 5.021 108 HD2 PRO 13 HD2 PRO 13 -18.346 -0.556 2.293 109 HD3 PRO 13 HD1 PRO 13 -19.233 0.666 3.228 110 H LEU 14 HN LEU 14 -16.242 0.151 0.734 111 HA LEU 14 HA LEU 14 -13.552 -0.115 0.019 112 HB2 LEU 14 HB2 LEU 14 -15.904 0.084 -1.874 113 HB3 LEU 14 HB1 LEU 14 -14.328 -0.605 -2.241 114 HG LEU 14 HG LEU 14 -16.356 -1.727 -0.296 115 HD11 LEU 14 HD11 LEU 14 -16.969 -2.022 -2.635 116 HD12 LEU 14 HD12 LEU 14 -16.515 -3.558 -1.896 117 HD13 LEU 14 HD13 LEU 14 -15.387 -2.729 -2.967 118 HD21 LEU 14 HD21 LEU 14 -14.812 -3.666 -0.187 119 HD22 LEU 14 HD22 LEU 14 -14.148 -2.200 0.531 120 HD23 LEU 14 HD23 LEU 14 -13.614 -2.717 -1.068 121 H GLN 15 HN GLN 15 -15.871 2.456 -0.768 122 HA GLN 15 HA GLN 15 -14.137 3.815 -2.555 123 HB2 GLN 15 HB2 GLN 15 -16.548 4.159 -2.644 124 HB3 GLN 15 HB1 GLN 15 -16.542 4.811 -1.013 125 HG2 GLN 15 HG2 GLN 15 -16.719 6.553 -2.727 126 HG3 GLN 15 HG1 GLN 15 -15.274 6.728 -1.733 127 HE21 GLN 15 HE21 GLN 15 -15.605 4.372 -4.301 128 HE22 GLN 15 HE22 GLN 15 -14.448 5.088 -5.366 129 H ALA 16 HN ALA 16 -14.905 4.281 0.884 130 HA ALA 16 HA ALA 16 -13.247 6.509 1.318 131 HB1 ALA 16 HB1 ALA 16 -13.386 5.931 3.682 132 HB2 ALA 16 HB2 ALA 16 -14.014 4.336 3.267 133 HB3 ALA 16 HB3 ALA 16 -14.963 5.779 2.909 134 H LEU 17 HN LEU 17 -12.652 3.045 1.650 135 HA LEU 17 HA LEU 17 -9.993 3.273 2.555 136 HB2 LEU 17 HB2 LEU 17 -11.387 1.238 2.778 137 HB3 LEU 17 HB1 LEU 17 -11.250 0.984 1.047 138 HG LEU 17 HG LEU 17 -8.793 0.761 1.305 139 HD11 LEU 17 HD11 LEU 17 -8.456 2.055 3.314 140 HD12 LEU 17 HD12 LEU 17 -7.895 0.404 3.580 141 HD13 LEU 17 HD13 LEU 17 -9.441 0.926 4.245 142 HD21 LEU 17 HD21 LEU 17 -10.205 -1.210 1.241 143 HD22 LEU 17 HD22 LEU 17 -10.455 -1.108 2.983 144 HD23 LEU 17 HD23 LEU 17 -8.849 -1.452 2.341 145 H ARG 18 HN ARG 18 -11.361 2.876 -0.706 146 HA ARG 18 HA ARG 18 -8.937 2.591 -2.079 147 HB2 ARG 18 HB2 ARG 18 -11.665 3.500 -2.883 148 HB3 ARG 18 HB1 ARG 18 -10.330 3.775 -3.993 149 HG2 ARG 18 HG2 ARG 18 -9.798 1.339 -3.825 150 HG3 ARG 18 HG1 ARG 18 -11.293 1.141 -2.912 151 HD2 ARG 18 HD2 ARG 18 -12.624 1.723 -4.759 152 HD3 ARG 18 HD1 ARG 18 -11.256 2.416 -5.633 153 HE ARG 18 HE ARG 18 -10.668 -0.267 -5.189 154 HH11 ARG 18 HH11 ARG 18 -13.080 1.585 -6.948 155 HH12 ARG 18 HH12 ARG 18 -13.241 0.403 -8.206 156 HH21 ARG 18 HH21 ARG 18 -10.901 -1.813 -6.823 157 HH22 ARG 18 HH22 ARG 18 -11.999 -1.534 -8.137 158 H ARG 19 HN ARG 19 -10.660 5.491 -1.062 159 HA ARG 19 HA ARG 19 -9.050 7.397 -2.326 160 HB2 ARG 19 HB2 ARG 19 -11.189 7.848 -1.104 161 HB3 ARG 19 HB1 ARG 19 -10.325 7.615 0.409 162 HG2 ARG 19 HG2 ARG 19 -8.817 9.491 -0.258 163 HG3 ARG 19 HG1 ARG 19 -9.892 9.779 -1.629 164 HD2 ARG 19 HD2 ARG 19 -10.472 11.261 0.192 165 HD3 ARG 19 HD1 ARG 19 -11.766 10.091 -0.070 166 HE ARG 19 HE ARG 19 -9.852 9.323 1.951 167 HH11 ARG 19 HH11 ARG 19 -12.828 11.036 1.293 168 HH12 ARG 19 HH12 ARG 19 -13.410 10.916 2.920 169 HH21 ARG 19 HH21 ARG 19 -10.616 9.148 4.102 170 HH22 ARG 19 HH22 ARG 19 -12.151 9.837 4.523 171 H ARG 20 HN ARG 20 -8.749 5.863 0.851 172 HA ARG 20 HA ARG 20 -6.297 7.095 1.536 173 HB2 ARG 20 HB2 ARG 20 -7.797 6.109 3.208 174 HB3 ARG 20 HB1 ARG 20 -7.484 4.510 2.551 175 HG2 ARG 20 HG2 ARG 20 -5.154 4.668 3.200 176 HG3 ARG 20 HG1 ARG 20 -5.409 6.315 3.775 177 HD2 ARG 20 HD2 ARG 20 -6.963 5.491 5.469 178 HD3 ARG 20 HD1 ARG 20 -6.739 3.842 4.885 179 HE ARG 20 HE ARG 20 -4.300 5.181 5.683 180 HH11 ARG 20 HH11 ARG 20 -6.999 3.227 6.768 181 HH12 ARG 20 HH12 ARG 20 -6.115 2.501 8.069 182 HH21 ARG 20 HH21 ARG 20 -3.137 4.241 7.401 183 HH22 ARG 20 HH22 ARG 20 -3.908 3.076 8.441 184 H ASN 21 HN ASN 21 -7.069 4.021 -0.060 185 HA ASN 21 HA ASN 21 -4.448 2.998 -0.126 186 HB2 ASN 21 HB2 ASN 21 -6.733 2.516 -2.051 187 HB3 ASN 21 HB1 ASN 21 -5.224 1.612 -2.057 188 HD21 ASN 21 HD21 ASN 21 -7.794 0.508 -1.722 189 HD22 ASN 21 HD22 ASN 21 -7.861 -0.186 -0.135 190 H GLN 22 HN GLN 22 -6.168 5.136 -2.354 191 HA GLN 22 HA GLN 22 -4.169 5.243 -4.335 192 HB2 GLN 22 HB2 GLN 22 -6.577 6.089 -4.474 193 HB3 GLN 22 HB1 GLN 22 -6.021 7.514 -3.609 194 HG2 GLN 22 HG2 GLN 22 -6.056 8.045 -5.921 195 HG3 GLN 22 HG1 GLN 22 -4.367 7.892 -5.437 196 HE21 GLN 22 HE21 GLN 22 -3.701 7.478 -7.571 197 HE22 GLN 22 HE22 GLN 22 -4.015 5.965 -8.345 198 H GLU 23 HN GLU 23 -4.584 6.846 -1.280 199 HA GLU 23 HA GLU 23 -2.603 8.867 -1.695 200 HB2 GLU 23 HB2 GLU 23 -4.502 9.037 -0.056 201 HB3 GLU 23 HB1 GLU 23 -3.690 7.825 0.925 202 HG2 GLU 23 HG2 GLU 23 -1.788 9.303 1.210 203 HG3 GLU 23 HG1 GLU 23 -2.559 10.512 0.187 204 H LEU 24 HN LEU 24 -2.713 5.662 -0.209 205 HA LEU 24 HA LEU 24 -0.073 5.596 0.762 206 HB2 LEU 24 HB2 LEU 24 -1.806 3.336 -0.245 207 HB3 LEU 24 HB1 LEU 24 -0.271 3.111 0.565 208 HG LEU 24 HG LEU 24 -2.753 4.324 1.795 209 HD11 LEU 24 HD11 LEU 24 -2.839 1.880 1.398 210 HD12 LEU 24 HD12 LEU 24 -2.842 2.305 3.107 211 HD13 LEU 24 HD13 LEU 24 -1.369 1.705 2.354 212 HD21 LEU 24 HD21 LEU 24 -0.749 5.329 2.729 213 HD22 LEU 24 HD22 LEU 24 -0.044 3.735 2.988 214 HD23 LEU 24 HD23 LEU 24 -1.476 4.226 3.894 215 H LYS 25 HN LYS 25 -1.460 4.700 -2.377 216 HA LYS 25 HA LYS 25 0.868 3.684 -3.532 217 HB2 LYS 25 HB2 LYS 25 -1.330 3.411 -4.572 218 HB3 LYS 25 HB1 LYS 25 -1.401 5.139 -4.898 219 HG2 LYS 25 HG2 LYS 25 0.609 4.915 -6.316 220 HG3 LYS 25 HG1 LYS 25 0.564 3.173 -6.050 221 HD2 LYS 25 HD2 LYS 25 -1.571 3.010 -7.137 222 HD3 LYS 25 HD1 LYS 25 -1.681 4.767 -7.273 223 HE2 LYS 25 HE2 LYS 25 0.390 3.015 -8.592 224 HE3 LYS 25 HE1 LYS 25 -1.003 3.740 -9.390 225 HZ1 LYS 25 HZ1 LYS 25 -0.107 5.933 -8.859 226 HZ2 LYS 25 HZ2 LYS 25 0.987 5.035 -9.783 227 HZ3 LYS 25 HZ3 LYS 25 1.247 5.227 -8.120 228 H GLN 26 HN GLN 26 -0.357 7.011 -3.403 229 HA GLN 26 HA GLN 26 1.612 8.170 -5.029 230 HB2 GLN 26 HB2 GLN 26 0.053 9.369 -2.736 231 HB3 GLN 26 HB1 GLN 26 1.023 10.296 -3.875 232 HG2 GLN 26 HG2 GLN 26 -0.397 9.537 -5.707 233 HG3 GLN 26 HG1 GLN 26 -1.368 8.605 -4.568 234 HE21 GLN 26 HE21 GLN 26 -3.228 9.727 -5.067 235 HE22 GLN 26 HE22 GLN 26 -3.497 11.357 -4.557 236 H GLN 27 HN GLN 27 1.584 7.333 -1.629 237 HA GLN 27 HA GLN 27 4.033 8.663 -0.999 238 HB2 GLN 27 HB2 GLN 27 2.408 6.562 0.425 239 HB3 GLN 27 HB1 GLN 27 3.925 7.176 1.068 240 HG2 GLN 27 HG2 GLN 27 3.023 9.405 1.196 241 HG3 GLN 27 HG1 GLN 27 1.533 8.884 0.415 242 HE21 GLN 27 HE21 GLN 27 0.024 7.717 1.606 243 HE22 GLN 27 HE22 GLN 27 0.102 7.583 3.325 244 H VAL 28 HN VAL 28 3.126 5.456 -2.111 245 HA VAL 28 HA VAL 28 5.654 4.223 -1.700 246 HB VAL 28 HB VAL 28 3.407 3.523 -3.602 247 HG11 VAL 28 HG11 VAL 28 5.491 2.628 -4.455 248 HG12 VAL 28 HG12 VAL 28 4.494 1.327 -3.803 249 HG13 VAL 28 HG13 VAL 28 5.863 1.937 -2.876 250 HG21 VAL 28 HG21 VAL 28 2.806 3.336 -1.238 251 HG22 VAL 28 HG22 VAL 28 4.219 2.319 -0.956 252 HG23 VAL 28 HG23 VAL 28 2.912 1.744 -1.994 253 H ASP 29 HN ASP 29 4.082 5.721 -4.516 254 HA ASP 29 HA ASP 29 6.178 5.468 -6.346 255 HB2 ASP 29 HB2 ASP 29 4.033 7.582 -6.086 256 HB3 ASP 29 HB1 ASP 29 5.185 7.556 -7.416 257 H SER 30 HN SER 30 5.590 7.815 -3.816 258 HA SER 30 HA SER 30 7.685 9.597 -4.515 259 HB2 SER 30 HB2 SER 30 5.713 10.159 -3.047 260 HB3 SER 30 HB1 SER 30 6.461 9.197 -1.775 261 HG SER 30 HG SER 30 7.016 11.349 -1.500 262 H LEU 31 HN LEU 31 7.467 6.776 -2.406 263 HA LEU 31 HA LEU 31 10.041 7.012 -1.260 264 HB2 LEU 31 HB2 LEU 31 8.299 5.563 -0.321 265 HB3 LEU 31 HB1 LEU 31 8.366 4.547 -1.748 266 HG LEU 31 HG LEU 31 10.714 3.966 -1.190 267 HD11 LEU 31 HD11 LEU 31 11.376 5.886 0.076 268 HD12 LEU 31 HD12 LEU 31 11.488 4.466 1.117 269 HD13 LEU 31 HD13 LEU 31 10.131 5.579 1.284 270 HD21 LEU 31 HD21 LEU 31 8.832 2.541 -0.513 271 HD22 LEU 31 HD22 LEU 31 8.743 3.412 1.019 272 HD23 LEU 31 HD23 LEU 31 10.176 2.463 0.624 273 H LEU 32 HN LEU 32 8.813 5.201 -4.047 274 HA LEU 32 HA LEU 32 11.224 4.128 -4.921 275 HB2 LEU 32 HB2 LEU 32 8.819 5.005 -6.517 276 HB3 LEU 32 HB1 LEU 32 10.114 3.995 -7.135 277 HG LEU 32 HG LEU 32 8.286 3.253 -4.848 278 HD11 LEU 32 HD11 LEU 32 7.080 3.337 -6.959 279 HD12 LEU 32 HD12 LEU 32 7.289 1.672 -6.418 280 HD13 LEU 32 HD13 LEU 32 8.304 2.314 -7.710 281 HD21 LEU 32 HD21 LEU 32 9.255 1.011 -5.143 282 HD22 LEU 32 HD22 LEU 32 10.451 2.204 -4.641 283 HD23 LEU 32 HD23 LEU 32 10.388 1.674 -6.322 284 H SER 33 HN SER 33 9.828 7.312 -5.355 285 HA SER 33 HA SER 33 11.601 8.270 -7.305 286 HB2 SER 33 HB2 SER 33 9.532 9.462 -6.645 287 HB3 SER 33 HB1 SER 33 10.264 9.842 -5.087 288 HG SER 33 HG SER 33 11.780 10.540 -7.286 289 H GLU 34 HN GLU 34 11.947 7.869 -3.822 290 HA GLU 34 HA GLU 34 14.385 9.374 -3.643 291 HB2 GLU 34 HB2 GLU 34 12.957 7.461 -1.816 292 HB3 GLU 34 HB1 GLU 34 14.593 7.987 -1.454 293 HG2 GLU 34 HG2 GLU 34 12.377 9.939 -1.950 294 HG3 GLU 34 HG1 GLU 34 12.673 9.239 -0.360 295 H SER 35 HN SER 35 13.526 5.939 -3.828 296 HA SER 35 HA SER 35 16.166 4.951 -3.782 297 HB2 SER 35 HB2 SER 35 15.103 2.862 -4.733 298 HB3 SER 35 HB1 SER 35 14.385 3.456 -3.239 299 HG SER 35 HG SER 35 13.301 4.390 -5.628 300 H GLN 36 HN GLN 36 14.741 6.820 -6.104 301 HA GLN 36 HA GLN 36 16.010 5.442 -8.366 302 HB2 GLN 36 HB2 GLN 36 13.545 6.086 -8.449 303 HB3 GLN 36 HB1 GLN 36 14.077 7.760 -8.484 304 HG2 GLN 36 HG2 GLN 36 13.599 7.041 -10.709 305 HG3 GLN 36 HG1 GLN 36 15.339 7.279 -10.547 306 HE21 GLN 36 HE21 GLN 36 16.705 5.496 -10.602 307 HE22 GLN 36 HE22 GLN 36 16.170 3.944 -11.142 308 H LEU 37 HN LEU 37 16.502 7.851 -6.140 309 HA LEU 37 HA LEU 37 17.764 9.791 -7.870 310 HB2 LEU 37 HB2 LEU 37 17.674 9.595 -4.856 311 HB3 LEU 37 HB1 LEU 37 18.271 10.967 -5.767 312 HG LEU 37 HG LEU 37 15.422 9.982 -5.818 313 HD11 LEU 37 HD11 LEU 37 14.906 11.951 -4.491 314 HD12 LEU 37 HD12 LEU 37 16.617 12.364 -4.415 315 HD13 LEU 37 HD13 LEU 37 16.029 10.896 -3.636 316 HD21 LEU 37 HD21 LEU 37 14.996 12.165 -6.900 317 HD22 LEU 37 HD22 LEU 37 15.986 11.080 -7.873 318 HD23 LEU 37 HD23 LEU 37 16.739 12.417 -7.002 319 H LYS 38 HN LYS 38 19.926 10.153 -8.074 320 HA LYS 38 HA LYS 38 21.724 8.012 -7.525 321 HB2 LYS 38 HB2 LYS 38 22.181 10.820 -8.534 322 HB3 LYS 38 HB1 LYS 38 23.467 9.635 -8.364 323 HG2 LYS 38 HG2 LYS 38 22.296 8.156 -9.934 324 HG3 LYS 38 HG1 LYS 38 21.042 9.380 -10.131 325 HD2 LYS 38 HD2 LYS 38 23.964 9.818 -10.731 326 HD3 LYS 38 HD1 LYS 38 22.755 9.377 -11.936 327 HE2 LYS 38 HE2 LYS 38 22.712 11.860 -10.224 328 HE3 LYS 38 HE1 LYS 38 23.196 11.787 -11.916 329 HZ1 LYS 38 HZ1 LYS 38 20.498 11.178 -10.839 330 HZ2 LYS 38 HZ2 LYS 38 20.952 11.012 -12.456 331 HZ3 LYS 38 HZ3 LYS 38 20.936 12.543 -11.739 332 H GLU 39 HN GLU 39 20.891 10.993 -5.928 333 HA GLU 39 HA GLU 39 23.080 11.063 -4.123 334 HB2 GLU 39 HB2 GLU 39 21.593 12.999 -4.566 335 HB3 GLU 39 HB1 GLU 39 20.284 12.160 -3.747 336 HG2 GLU 39 HG2 GLU 39 21.555 12.186 -1.671 337 HG3 GLU 39 HG1 GLU 39 22.884 13.002 -2.491 338 H ALA 40 HN ALA 40 20.323 9.069 -4.370 339 HA ALA 40 HA ALA 40 20.138 8.373 -1.601 340 HB1 ALA 40 HB1 ALA 40 19.008 6.951 -3.997 341 HB2 ALA 40 HB2 ALA 40 18.201 8.229 -3.088 342 HB3 ALA 40 HB3 ALA 40 18.555 6.685 -2.312 343 H LEU 41 HN LEU 41 22.425 7.761 -3.847 344 HA LEU 41 HA LEU 41 23.085 5.055 -3.254 345 HB2 LEU 41 HB2 LEU 41 23.872 6.264 -5.268 346 HB3 LEU 41 HB1 LEU 41 24.854 7.294 -4.248 347 HG LEU 41 HG LEU 41 26.123 5.267 -3.528 348 HD11 LEU 41 HD11 LEU 41 25.927 3.248 -4.903 349 HD12 LEU 41 HD12 LEU 41 24.527 3.950 -5.713 350 HD13 LEU 41 HD13 LEU 41 24.457 3.580 -3.991 351 HD21 LEU 41 HD21 LEU 41 27.412 5.083 -5.589 352 HD22 LEU 41 HD22 LEU 41 26.966 6.760 -5.268 353 HD23 LEU 41 HD23 LEU 41 26.093 5.832 -6.489 354 H GLU 42 HN GLU 42 23.332 7.958 -1.534 355 HA GLU 42 HA GLU 42 25.557 7.596 0.096 356 HB2 GLU 42 HB2 GLU 42 24.272 9.665 0.125 357 HB3 GLU 42 HB1 GLU 42 22.860 8.815 0.740 358 HG2 GLU 42 HG2 GLU 42 24.075 8.319 2.810 359 HG3 GLU 42 HG1 GLU 42 25.468 9.206 2.190 360 HA PRO 43 HA PRO 43 24.698 3.734 2.128 361 HB2 PRO 43 HB2 PRO 43 26.354 4.967 4.272 362 HB3 PRO 43 HB1 PRO 43 26.527 3.399 3.477 363 HG2 PRO 43 HG2 PRO 43 28.144 5.449 2.895 364 HG3 PRO 43 HG1 PRO 43 27.625 4.291 1.658 365 HD2 PRO 43 HD2 PRO 43 26.755 7.099 2.118 366 HD3 PRO 43 HD1 PRO 43 26.866 6.180 0.604 367 H ASN 44 HN ASN 44 24.508 6.777 3.965 368 HA ASN 44 HA ASN 44 22.980 5.678 6.093 369 HB2 ASN 44 HB2 ASN 44 23.468 8.508 5.171 370 HB3 ASN 44 HB1 ASN 44 22.390 8.144 6.514 371 HD21 ASN 44 HD21 ASN 44 23.706 9.279 7.949 372 HD22 ASN 44 HD22 ASN 44 25.216 8.645 8.503 373 H LYS 45 HN LYS 45 22.103 7.292 3.069 374 HA LYS 45 HA LYS 45 19.402 7.707 3.654 375 HB2 LYS 45 HB2 LYS 45 20.468 8.834 1.791 376 HB3 LYS 45 HB1 LYS 45 20.786 7.299 0.996 377 HG2 LYS 45 HG2 LYS 45 18.925 8.392 -0.077 378 HG3 LYS 45 HG1 LYS 45 18.353 6.949 0.757 379 HD2 LYS 45 HD2 LYS 45 16.758 8.582 1.263 380 HD3 LYS 45 HD1 LYS 45 17.783 8.522 2.697 381 HE2 LYS 45 HE2 LYS 45 17.401 10.816 2.202 382 HE3 LYS 45 HE1 LYS 45 19.063 10.458 1.738 383 HZ1 LYS 45 HZ1 LYS 45 17.912 11.787 0.068 384 HZ2 LYS 45 HZ2 LYS 45 16.746 10.573 -0.126 385 HZ3 LYS 45 HZ3 LYS 45 18.357 10.283 -0.557 386 H ARG 46 HN ARG 46 21.116 4.869 2.561 387 HA ARG 46 HA ARG 46 18.983 3.387 1.527 388 HB2 ARG 46 HB2 ARG 46 21.273 2.199 3.096 389 HB3 ARG 46 HB1 ARG 46 20.338 1.438 1.817 390 HG2 ARG 46 HG2 ARG 46 22.318 3.685 1.532 391 HG3 ARG 46 HG1 ARG 46 22.490 2.025 0.962 392 HD2 ARG 46 HD2 ARG 46 20.401 3.976 0.002 393 HD3 ARG 46 HD1 ARG 46 21.913 3.630 -0.831 394 HE ARG 46 HE ARG 46 20.569 1.208 -0.420 395 HH11 ARG 46 HH11 ARG 46 20.232 4.171 -2.259 396 HH12 ARG 46 HH12 ARG 46 19.363 3.415 -3.559 397 HH21 ARG 46 HH21 ARG 46 19.435 0.211 -2.090 398 HH22 ARG 46 HH22 ARG 46 18.887 1.147 -3.456 399 H GLN 47 HN GLN 47 20.152 3.699 4.862 400 HA GLN 47 HA GLN 47 18.295 1.847 5.964 401 HB2 GLN 47 HB2 GLN 47 19.953 4.039 7.207 402 HB3 GLN 47 HB1 GLN 47 18.866 3.032 8.151 403 HG2 GLN 47 HG2 GLN 47 21.080 2.175 8.359 404 HG3 GLN 47 HG1 GLN 47 20.137 1.042 7.395 405 HE21 GLN 47 HE21 GLN 47 22.659 3.424 7.363 406 HE22 GLN 47 HE22 GLN 47 23.318 3.001 5.819 407 H HIS 48 HN HIS 48 18.266 5.270 5.311 408 HA HIS 48 HA HIS 48 15.951 5.886 6.844 409 HB2 HIS 48 HB2 HIS 48 17.711 7.532 6.002 410 HB3 HIS 48 HB1 HIS 48 16.942 7.409 4.423 411 HD1 HIS 48 HD1 HIS 48 16.175 8.519 7.955 412 HD2 HIS 48 HD2 HIS 48 14.745 9.016 4.083 413 HE1 HIS 48 HE1 HIS 48 14.419 10.315 8.104 414 HE2 HIS 48 HE2 HIS 48 13.701 10.718 5.729 415 H ILE 49 HN ILE 49 16.495 4.996 3.462 416 HA ILE 49 HA ILE 49 13.781 5.225 2.650 417 HB ILE 49 HB ILE 49 16.010 3.508 1.525 418 HG12 ILE 49 HG12 ILE 49 14.913 6.180 0.612 419 HG13 ILE 49 HG11 ILE 49 16.436 5.945 1.461 420 HG21 ILE 49 HG21 ILE 49 13.800 2.647 0.909 421 HG22 ILE 49 HG22 ILE 49 14.656 3.307 -0.484 422 HG23 ILE 49 HG23 ILE 49 13.362 4.233 0.275 423 HD11 ILE 49 HD11 ILE 49 15.744 4.902 -1.277 424 HD12 ILE 49 HD12 ILE 49 17.259 4.608 -0.426 425 HD13 ILE 49 HD13 ILE 49 16.821 6.248 -0.904 426 H TYR 50 HN TYR 50 15.768 2.536 3.814 427 HA TYR 50 HA TYR 50 13.959 0.470 3.784 428 HB2 TYR 50 HB2 TYR 50 16.369 0.329 4.396 429 HB3 TYR 50 HB1 TYR 50 15.996 1.066 5.945 430 HD1 TYR 50 HD1 TYR 50 16.011 -0.393 7.711 431 HD2 TYR 50 HD2 TYR 50 14.670 -1.814 3.928 432 HE1 TYR 50 HE1 TYR 50 15.668 -2.621 8.678 433 HE2 TYR 50 HE2 TYR 50 14.319 -4.050 4.892 434 HH TYR 50 HH TYR 50 15.135 -5.389 6.772 435 H GLN 51 HN GLN 51 14.312 3.013 6.236 436 HA GLN 51 HA GLN 51 12.413 1.937 8.053 437 HB2 GLN 51 HB2 GLN 51 14.129 3.645 8.670 438 HB3 GLN 51 HB1 GLN 51 13.259 4.830 7.704 439 HG2 GLN 51 HG2 GLN 51 11.303 4.558 9.173 440 HG3 GLN 51 HG1 GLN 51 12.228 3.433 10.167 441 HE21 GLN 51 HE21 GLN 51 11.034 5.942 10.948 442 HE22 GLN 51 HE22 GLN 51 12.323 6.944 11.518 443 H ARG 52 HN ARG 52 12.168 4.422 5.523 444 HA ARG 52 HA ARG 52 9.455 5.050 5.886 445 HB2 ARG 52 HB2 ARG 52 11.268 5.205 3.489 446 HB3 ARG 52 HB1 ARG 52 9.583 5.691 3.403 447 HG2 ARG 52 HG2 ARG 52 9.982 7.374 5.129 448 HG3 ARG 52 HG1 ARG 52 11.678 6.886 5.204 449 HD2 ARG 52 HD2 ARG 52 12.030 7.551 2.923 450 HD3 ARG 52 HD1 ARG 52 10.311 7.861 2.699 451 HE ARG 52 HE ARG 52 11.377 9.460 4.794 452 HH11 ARG 52 HH11 ARG 52 11.239 9.186 1.311 453 HH12 ARG 52 HH12 ARG 52 11.462 10.882 1.035 454 HH21 ARG 52 HH21 ARG 52 11.666 11.703 4.436 455 HH22 ARG 52 HH22 ARG 52 11.698 12.315 2.811 456 H CYS 53 HN CYS 53 11.045 2.469 4.200 457 HA CYS 53 HA CYS 53 8.813 1.646 2.630 458 HB2 CYS 53 HB2 CYS 53 11.166 1.051 2.069 459 HB3 CYS 53 HB1 CYS 53 11.211 0.001 3.490 460 HG CYS 53 HG CYS 53 10.794 -1.190 0.766 461 H ILE 54 HN ILE 54 10.192 0.542 5.700 462 HA ILE 54 HA ILE 54 8.353 -1.503 6.209 463 HB ILE 54 HB ILE 54 9.920 0.215 8.128 464 HG12 ILE 54 HG12 ILE 54 10.367 -2.593 7.081 465 HG13 ILE 54 HG11 ILE 54 11.283 -1.161 6.613 466 HG21 ILE 54 HG21 ILE 54 8.003 -0.699 9.289 467 HG22 ILE 54 HG22 ILE 54 9.473 -1.523 9.809 468 HG23 ILE 54 HG23 ILE 54 8.372 -2.311 8.680 469 HD11 ILE 54 HD11 ILE 54 12.132 -0.956 8.885 470 HD12 ILE 54 HD12 ILE 54 12.507 -2.538 8.201 471 HD13 ILE 54 HD13 ILE 54 11.196 -2.370 9.368 472 H GLN 55 HN GLN 55 8.245 1.946 6.982 473 HA GLN 55 HA GLN 55 5.927 1.899 8.565 474 HB2 GLN 55 HB2 GLN 55 7.350 3.841 8.543 475 HB3 GLN 55 HB1 GLN 55 7.090 4.074 6.821 476 HG2 GLN 55 HG2 GLN 55 4.763 4.623 7.221 477 HG3 GLN 55 HG1 GLN 55 4.972 4.321 8.945 478 HE21 GLN 55 HE21 GLN 55 6.073 5.801 10.196 479 HE22 GLN 55 HE22 GLN 55 6.435 7.399 9.645 480 H LEU 56 HN LEU 56 6.238 2.691 5.084 481 HA LEU 56 HA LEU 56 3.523 2.816 4.543 482 HB2 LEU 56 HB2 LEU 56 5.696 1.894 2.658 483 HB3 LEU 56 HB1 LEU 56 4.117 2.489 2.193 484 HG LEU 56 HG LEU 56 6.302 4.090 3.530 485 HD11 LEU 56 HD11 LEU 56 6.406 5.285 1.417 486 HD12 LEU 56 HD12 LEU 56 5.164 4.229 0.743 487 HD13 LEU 56 HD13 LEU 56 6.739 3.569 1.187 488 HD21 LEU 56 HD21 LEU 56 3.547 4.929 2.627 489 HD22 LEU 56 HD22 LEU 56 4.827 6.025 3.143 490 HD23 LEU 56 HD23 LEU 56 4.141 4.874 4.288 491 H LYS 57 HN LYS 57 5.670 0.004 4.507 492 HA LYS 57 HA LYS 57 3.827 -1.815 3.410 493 HB2 LYS 57 HB2 LYS 57 6.217 -2.310 3.574 494 HB3 LYS 57 HB1 LYS 57 6.114 -2.311 5.328 495 HG2 LYS 57 HG2 LYS 57 4.695 -4.275 5.278 496 HG3 LYS 57 HG1 LYS 57 4.691 -4.251 3.514 497 HD2 LYS 57 HD2 LYS 57 7.053 -4.711 3.445 498 HD3 LYS 57 HD1 LYS 57 7.175 -4.552 5.197 499 HE2 LYS 57 HE2 LYS 57 7.169 -6.893 4.530 500 HE3 LYS 57 HE1 LYS 57 5.740 -6.505 5.483 501 HZ1 LYS 57 HZ1 LYS 57 5.807 -6.687 2.520 502 HZ2 LYS 57 HZ2 LYS 57 4.442 -6.411 3.476 503 HZ3 LYS 57 HZ3 LYS 57 5.238 -7.898 3.553 504 H GLN 58 HN GLN 58 4.494 -0.842 6.731 505 HA GLN 58 HA GLN 58 2.659 -2.545 8.008 506 HB2 GLN 58 HB2 GLN 58 4.393 -1.356 9.237 507 HB3 GLN 58 HB1 GLN 58 3.677 0.190 8.806 508 HG2 GLN 58 HG2 GLN 58 3.177 -0.410 11.099 509 HG3 GLN 58 HG1 GLN 58 1.708 -0.339 10.127 510 HE21 GLN 58 HE21 GLN 58 0.572 -1.638 11.516 511 HE22 GLN 58 HE22 GLN 58 0.863 -3.337 11.659 512 H ALA 59 HN ALA 59 2.298 0.612 6.496 513 HA ALA 59 HA ALA 59 -0.341 1.116 7.410 514 HB1 ALA 59 HB1 ALA 59 1.134 2.900 6.630 515 HB2 ALA 59 HB2 ALA 59 -0.380 2.879 5.726 516 HB3 ALA 59 HB3 ALA 59 1.091 2.230 5.001 517 H ILE 60 HN ILE 60 0.971 -0.291 4.421 518 HA ILE 60 HA ILE 60 -1.518 -0.577 3.117 519 HB ILE 60 HB ILE 60 0.990 -2.224 2.733 520 HG12 ILE 60 HG12 ILE 60 0.004 0.213 1.231 521 HG13 ILE 60 HG11 ILE 60 1.316 0.216 2.405 522 HG21 ILE 60 HG21 ILE 60 -1.408 -1.847 0.940 523 HG22 ILE 60 HG22 ILE 60 -0.987 -3.317 1.817 524 HG23 ILE 60 HG23 ILE 60 0.057 -2.735 0.522 525 HD11 ILE 60 HD11 ILE 60 2.188 0.209 0.152 526 HD12 ILE 60 HD12 ILE 60 1.274 -1.254 -0.219 527 HD13 ILE 60 HD13 ILE 60 2.582 -1.310 0.961 528 H ASP 61 HN ASP 61 0.351 -2.744 5.206 529 HA ASP 61 HA ASP 61 -1.357 -4.988 4.981 530 HB2 ASP 61 HB2 ASP 61 0.964 -5.054 5.944 531 HB3 ASP 61 HB1 ASP 61 0.347 -4.231 7.375 532 H GLU 62 HN GLU 62 -1.333 -2.194 7.089 533 HA GLU 62 HA GLU 62 -3.403 -2.937 8.826 534 HB2 GLU 62 HB2 GLU 62 -1.917 -1.050 9.262 535 HB3 GLU 62 HB1 GLU 62 -2.569 -0.191 7.874 536 HG2 GLU 62 HG2 GLU 62 -4.713 0.007 8.947 537 HG3 GLU 62 HG1 GLU 62 -4.159 -0.975 10.302 538 H ASN 63 HN ASN 63 -3.478 -1.140 5.761 539 HA ASN 63 HA ASN 63 -6.278 -0.817 5.650 540 HB2 ASN 63 HB2 ASN 63 -4.159 -0.846 3.502 541 HB3 ASN 63 HB1 ASN 63 -5.862 -0.593 3.137 542 HD21 ASN 63 HD21 ASN 63 -5.528 1.491 2.384 543 HD22 ASN 63 HD22 ASN 63 -5.126 2.797 3.444 544 H LYS 64 HN LYS 64 -4.126 -3.357 4.506 545 HA LYS 64 HA LYS 64 -6.032 -4.912 3.152 546 HB2 LYS 64 HB2 LYS 64 -3.572 -5.222 3.008 547 HB3 LYS 64 HB1 LYS 64 -3.575 -5.849 4.649 548 HG2 LYS 64 HG2 LYS 64 -4.943 -7.733 3.947 549 HG3 LYS 64 HG1 LYS 64 -4.997 -7.089 2.303 550 HD2 LYS 64 HD2 LYS 64 -2.588 -7.332 2.098 551 HD3 LYS 64 HD1 LYS 64 -2.480 -7.894 3.766 552 HE2 LYS 64 HE2 LYS 64 -3.855 -9.836 3.197 553 HE3 LYS 64 HE1 LYS 64 -3.962 -9.277 1.531 554 HZ1 LYS 64 HZ1 LYS 64 -2.284 -10.968 1.743 555 HZ2 LYS 64 HZ2 LYS 64 -1.487 -10.096 2.950 556 HZ3 LYS 64 HZ3 LYS 64 -1.546 -9.494 1.371 557 H ASN 65 HN ASN 65 -5.058 -4.810 6.549 558 HA ASN 65 HA ASN 65 -6.705 -6.948 7.427 559 HB2 ASN 65 HB2 ASN 65 -5.499 -4.591 8.875 560 HB3 ASN 65 HB1 ASN 65 -6.478 -5.796 9.695 561 HD21 ASN 65 HD21 ASN 65 -5.482 -8.011 8.098 562 HD22 ASN 65 HD22 ASN 65 -3.861 -8.299 8.622 563 H ALA 66 HN ALA 66 -7.183 -3.451 7.237 564 HA ALA 66 HA ALA 66 -9.745 -3.365 8.380 565 HB1 ALA 66 HB1 ALA 66 -8.378 -1.368 8.026 566 HB2 ALA 66 HB2 ALA 66 -9.968 -1.192 7.283 567 HB3 ALA 66 HB3 ALA 66 -8.560 -1.548 6.281 568 H LEU 67 HN LEU 67 -8.694 -3.692 5.017 569 HA LEU 67 HA LEU 67 -11.222 -3.736 3.827 570 HB2 LEU 67 HB2 LEU 67 -9.132 -3.436 2.590 571 HB3 LEU 67 HB1 LEU 67 -8.667 -5.085 2.952 572 HG LEU 67 HG LEU 67 -10.510 -5.926 1.588 573 HD11 LEU 67 HD11 LEU 67 -11.104 -3.014 1.110 574 HD12 LEU 67 HD12 LEU 67 -12.154 -4.205 1.878 575 HD13 LEU 67 HD13 LEU 67 -11.776 -4.338 0.162 576 HD21 LEU 67 HD21 LEU 67 -8.358 -5.546 0.530 577 HD22 LEU 67 HD22 LEU 67 -8.806 -3.876 0.183 578 HD23 LEU 67 HD23 LEU 67 -9.671 -5.199 -0.597 579 H GLN 68 HN GLN 68 -9.241 -6.370 5.132 580 HA GLN 68 HA GLN 68 -11.003 -8.450 4.399 581 HB2 GLN 68 HB2 GLN 68 -8.614 -8.744 5.065 582 HB3 GLN 68 HB1 GLN 68 -9.079 -8.416 6.729 583 HG2 GLN 68 HG2 GLN 68 -10.592 -10.365 6.650 584 HG3 GLN 68 HG1 GLN 68 -10.010 -10.713 5.024 585 HE21 GLN 68 HE21 GLN 68 -7.915 -11.476 4.742 586 HE22 GLN 68 HE22 GLN 68 -7.006 -12.146 6.051 587 H LYS 69 HN LYS 69 -10.893 -6.300 7.176 588 HA LYS 69 HA LYS 69 -12.834 -7.799 8.680 589 HB2 LYS 69 HB2 LYS 69 -11.138 -6.362 9.786 590 HB3 LYS 69 HB1 LYS 69 -11.886 -4.947 9.060 591 HG2 LYS 69 HG2 LYS 69 -12.545 -5.204 11.385 592 HG3 LYS 69 HG1 LYS 69 -13.932 -5.368 10.309 593 HD2 LYS 69 HD2 LYS 69 -13.759 -7.816 10.488 594 HD3 LYS 69 HD1 LYS 69 -12.393 -7.630 11.589 595 HE2 LYS 69 HE2 LYS 69 -13.823 -6.467 13.185 596 HE3 LYS 69 HE1 LYS 69 -15.190 -6.602 12.077 597 HZ1 LYS 69 HZ1 LYS 69 -15.054 -9.008 12.262 598 HZ2 LYS 69 HZ2 LYS 69 -15.274 -8.299 13.782 599 HZ3 LYS 69 HZ3 LYS 69 -13.749 -8.874 13.332 600 H LEU 70 HN LEU 70 -12.881 -5.170 6.385 601 HA LEU 70 HA LEU 70 -15.710 -4.692 6.818 602 HB2 LEU 70 HB2 LEU 70 -13.597 -3.412 5.151 603 HB3 LEU 70 HB1 LEU 70 -15.263 -3.236 4.644 604 HG LEU 70 HG LEU 70 -14.610 -1.304 5.928 605 HD11 LEU 70 HD11 LEU 70 -16.338 -1.279 7.603 606 HD12 LEU 70 HD12 LEU 70 -16.404 -3.040 7.612 607 HD13 LEU 70 HD13 LEU 70 -16.911 -2.147 6.178 608 HD21 LEU 70 HD21 LEU 70 -13.944 -3.216 8.161 609 HD22 LEU 70 HD22 LEU 70 -13.949 -1.457 8.276 610 HD23 LEU 70 HD23 LEU 70 -12.791 -2.267 7.222 611 H SER 71 HN SER 71 -15.480 -7.233 6.262 612 HA SER 71 HA SER 71 -16.553 -7.442 3.528 613 HB2 SER 71 HB2 SER 71 -15.072 -9.573 5.103 614 HB3 SER 71 HB1 SER 71 -15.777 -9.794 3.504 615 HG SER 71 HG SER 71 -13.408 -9.212 3.778 616 H LYS 72 HN LYS 72 -18.434 -6.684 4.896 617 HA LYS 72 HA LYS 72 -19.549 -8.497 6.801 618 HB2 LYS 72 HB2 LYS 72 -21.532 -6.881 6.655 619 HB3 LYS 72 HB1 LYS 72 -20.003 -6.227 7.230 620 HG2 LYS 72 HG2 LYS 72 -19.569 -5.245 5.035 621 HG3 LYS 72 HG1 LYS 72 -21.067 -5.944 4.409 622 HD2 LYS 72 HD2 LYS 72 -22.351 -4.629 6.044 623 HD3 LYS 72 HD1 LYS 72 -20.851 -3.919 6.644 624 HE2 LYS 72 HE2 LYS 72 -20.437 -2.907 4.477 625 HE3 LYS 72 HE1 LYS 72 -21.880 -3.677 3.820 626 HZ1 LYS 72 HZ1 LYS 72 -23.222 -2.414 5.388 627 HZ2 LYS 72 HZ2 LYS 72 -22.312 -1.382 4.399 628 HZ3 LYS 72 HZ3 LYS 72 -21.829 -1.657 5.995 629 H ALA 73 HN ALA 73 -19.608 -10.389 5.398 630 HA ALA 73 HA ALA 73 -21.425 -10.515 3.198 631 HB1 ALA 73 HB1 ALA 73 -20.169 -12.741 4.792 632 HB2 ALA 73 HB2 ALA 73 -19.484 -11.987 3.354 633 HB3 ALA 73 HB3 ALA 73 -20.982 -12.911 3.236 634 H ASP 74 HN ASP 74 -21.719 -10.832 6.612 635 HA ASP 74 HA ASP 74 -24.125 -12.360 6.653 636 HB2 ASP 74 HB2 ASP 74 -22.954 -10.473 8.713 637 HB3 ASP 74 HB1 ASP 74 -24.361 -11.486 8.991 638 H GLU 75 HN GLU 75 -23.357 -9.078 6.039 639 HA GLU 75 HA GLU 75 -26.154 -8.247 6.257 640 HB2 GLU 75 HB2 GLU 75 -24.375 -6.779 7.198 641 HB3 GLU 75 HB1 GLU 75 -23.692 -6.613 5.589 642 HG2 GLU 75 HG2 GLU 75 -25.674 -5.487 4.814 643 HG3 GLU 75 HG1 GLU 75 -26.469 -5.755 6.364 644 H SER 76 HN SER 76 -27.276 -7.430 4.450 645 HA SER 76 HA SER 76 -26.541 -8.654 1.954 646 HB2 SER 76 HB2 SER 76 -28.706 -7.394 1.233 647 HB3 SER 76 HB1 SER 76 -28.835 -8.750 2.354 648 HG SER 76 HG SER 76 -28.943 -5.977 2.910 649 H ALA 77 HN ALA 77 -24.488 -7.278 2.020 650 HA ALA 77 HA ALA 77 -24.990 -4.735 0.642 651 HB1 ALA 77 HB1 ALA 77 -22.971 -3.823 1.588 652 HB2 ALA 77 HB2 ALA 77 -22.623 -5.349 2.396 653 HB3 ALA 77 HB3 ALA 77 -24.030 -4.402 2.874 654 HA PRO 78 HA PRO 78 -21.078 -6.776 -1.490 655 HB2 PRO 78 HB2 PRO 78 -21.551 -9.630 -0.838 656 HB3 PRO 78 HB1 PRO 78 -20.032 -8.729 -0.898 657 HG2 PRO 78 HG2 PRO 78 -21.081 -9.454 1.432 658 HG3 PRO 78 HG1 PRO 78 -20.308 -7.867 1.240 659 HD2 PRO 78 HD2 PRO 78 -23.229 -8.563 1.257 660 HD3 PRO 78 HD1 PRO 78 -22.390 -7.213 2.049 661 H VAL 79 HN VAL 79 -22.428 -6.188 -3.220 662 HA VAL 79 HA VAL 79 -23.947 -8.402 -4.419 663 HB VAL 79 HB VAL 79 -24.347 -5.447 -4.892 664 HG11 VAL 79 HG11 VAL 79 -26.362 -6.125 -6.089 665 HG12 VAL 79 HG12 VAL 79 -25.969 -7.820 -5.804 666 HG13 VAL 79 HG13 VAL 79 -24.922 -6.832 -6.822 667 HG21 VAL 79 HG21 VAL 79 -25.029 -6.094 -2.643 668 HG22 VAL 79 HG22 VAL 79 -26.032 -7.381 -3.314 669 HG23 VAL 79 HG23 VAL 79 -26.423 -5.694 -3.644 670 H ALA 80 HN ALA 80 -22.547 -9.342 -5.756 671 HA ALA 80 HA ALA 80 -21.235 -9.725 -7.551 672 HB1 ALA 80 HB1 ALA 80 -23.309 -9.259 -8.647 673 HB2 ALA 80 HB2 ALA 80 -21.981 -8.635 -9.625 674 HB3 ALA 80 HB3 ALA 80 -22.964 -7.533 -8.662 675 H ASN 81 HN ASN 81 -21.441 -6.339 -8.490 676 HA ASN 81 HA ASN 81 -18.694 -6.183 -9.061 677 HB2 ASN 81 HB2 ASN 81 -20.705 -3.955 -8.649 678 HB3 ASN 81 HB1 ASN 81 -19.084 -3.721 -9.294 679 HD21 ASN 81 HD21 ASN 81 -21.621 -3.160 -10.549 680 HD22 ASN 81 HD22 ASN 81 -21.668 -4.102 -11.999 681 H TYR 82 HN TYR 82 -20.470 -5.601 -6.156 682 HA TYR 82 HA TYR 82 -18.606 -4.014 -4.766 683 HB2 TYR 82 HB2 TYR 82 -20.991 -4.574 -4.064 684 HB3 TYR 82 HB1 TYR 82 -20.391 -6.142 -3.541 685 HD1 TYR 82 HD1 TYR 82 -18.744 -6.238 -1.608 686 HD2 TYR 82 HD2 TYR 82 -20.745 -2.644 -2.725 687 HE1 TYR 82 HE1 TYR 82 -18.234 -5.271 0.592 688 HE2 TYR 82 HE2 TYR 82 -20.228 -1.672 -0.530 689 HH TYR 82 HH TYR 82 -19.687 -2.362 1.699 690 H ASN 83 HN ASN 83 -18.967 -7.546 -5.000 691 HA ASN 83 HA ASN 83 -16.702 -8.093 -3.347 692 HB2 ASN 83 HB2 ASN 83 -18.378 -9.810 -5.170 693 HB3 ASN 83 HB1 ASN 83 -16.969 -10.443 -4.324 694 HD21 ASN 83 HD21 ASN 83 -19.807 -11.144 -4.052 695 HD22 ASN 83 HD22 ASN 83 -20.184 -10.898 -2.383 696 H GLN 84 HN GLN 84 -17.242 -7.622 -6.747 697 HA GLN 84 HA GLN 84 -14.796 -8.649 -7.704 698 HB2 GLN 84 HB2 GLN 84 -16.695 -8.182 -9.183 699 HB3 GLN 84 HB1 GLN 84 -16.558 -6.464 -8.835 700 HG2 GLN 84 HG2 GLN 84 -15.600 -7.000 -10.997 701 HG3 GLN 84 HG1 GLN 84 -14.369 -6.408 -9.884 702 HE21 GLN 84 HE21 GLN 84 -12.680 -7.360 -10.935 703 HE22 GLN 84 HE22 GLN 84 -12.422 -9.076 -10.948 704 H ARG 85 HN ARG 85 -15.790 -5.330 -6.868 705 HA ARG 85 HA ARG 85 -13.278 -4.143 -7.359 706 HB2 ARG 85 HB2 ARG 85 -15.532 -3.267 -5.542 707 HB3 ARG 85 HB1 ARG 85 -14.121 -2.283 -5.905 708 HG2 ARG 85 HG2 ARG 85 -14.725 -2.313 -8.279 709 HG3 ARG 85 HG1 ARG 85 -16.159 -3.265 -7.891 710 HD2 ARG 85 HD2 ARG 85 -17.010 -1.454 -6.512 711 HD3 ARG 85 HD1 ARG 85 -15.552 -0.509 -6.821 712 HE ARG 85 HE ARG 85 -16.653 -1.133 -9.292 713 HH11 ARG 85 HH11 ARG 85 -17.593 0.662 -6.436 714 HH12 ARG 85 HH12 ARG 85 -18.545 1.812 -7.319 715 HH21 ARG 85 HH21 ARG 85 -17.910 0.363 -10.450 716 HH22 ARG 85 HH22 ARG 85 -18.737 1.634 -9.605 717 H LYS 86 HN LYS 86 -14.684 -5.643 -4.523 718 HA LYS 86 HA LYS 86 -12.731 -4.928 -2.651 719 HB2 LYS 86 HB2 LYS 86 -14.760 -5.822 -1.829 720 HB3 LYS 86 HB1 LYS 86 -14.645 -7.249 -2.852 721 HG2 LYS 86 HG2 LYS 86 -12.726 -8.032 -1.504 722 HG3 LYS 86 HG1 LYS 86 -12.918 -6.624 -0.450 723 HD2 LYS 86 HD2 LYS 86 -15.160 -8.573 -0.949 724 HD3 LYS 86 HD1 LYS 86 -13.966 -8.823 0.324 725 HE2 LYS 86 HE2 LYS 86 -15.680 -6.349 0.066 726 HE3 LYS 86 HE1 LYS 86 -16.071 -7.727 1.091 727 HZ1 LYS 86 HZ1 LYS 86 -14.093 -7.366 2.363 728 HZ2 LYS 86 HZ2 LYS 86 -14.957 -5.911 2.295 729 HZ3 LYS 86 HZ3 LYS 86 -13.583 -6.127 1.328 730 H GLU 87 HN GLU 87 -12.909 -7.662 -4.904 731 HA GLU 87 HA GLU 87 -10.539 -8.917 -3.925 732 HB2 GLU 87 HB2 GLU 87 -12.323 -10.158 -5.108 733 HB3 GLU 87 HB1 GLU 87 -11.921 -9.292 -6.585 734 HG2 GLU 87 HG2 GLU 87 -10.950 -11.504 -6.599 735 HG3 GLU 87 HG1 GLU 87 -9.686 -10.278 -6.556 736 H GLU 88 HN GLU 88 -11.256 -6.775 -6.654 737 HA GLU 88 HA GLU 88 -8.678 -6.831 -7.788 738 HB2 GLU 88 HB2 GLU 88 -10.875 -4.774 -7.915 739 HB3 GLU 88 HB1 GLU 88 -9.364 -4.596 -8.792 740 HG2 GLU 88 HG2 GLU 88 -9.827 -6.748 -9.926 741 HG3 GLU 88 HG1 GLU 88 -11.394 -6.793 -9.120 742 H GLU 89 HN GLU 89 -10.041 -4.997 -5.146 743 HA GLU 89 HA GLU 89 -7.955 -3.092 -4.926 744 HB2 GLU 89 HB2 GLU 89 -10.303 -3.139 -3.791 745 HB3 GLU 89 HB1 GLU 89 -9.497 -4.085 -2.546 746 HG2 GLU 89 HG2 GLU 89 -9.566 -1.753 -1.924 747 HG3 GLU 89 HG1 GLU 89 -7.899 -2.255 -2.214 748 H HIS 90 HN HIS 90 -8.448 -6.326 -3.623 749 HA HIS 90 HA HIS 90 -6.186 -6.506 -1.978 750 HB2 HIS 90 HB2 HIS 90 -7.825 -8.508 -3.474 751 HB3 HIS 90 HB1 HIS 90 -6.262 -9.022 -2.860 752 HD1 HIS 90 HD1 HIS 90 -6.056 -9.457 -0.383 753 HD2 HIS 90 HD2 HIS 90 -9.737 -7.864 -1.449 754 HE1 HIS 90 HE1 HIS 90 -7.528 -9.758 1.632 755 HE2 HIS 90 HE2 HIS 90 -9.793 -8.955 0.893 756 H THR 91 HN THR 91 -6.573 -6.940 -5.453 757 HA THR 91 HA THR 91 -4.042 -8.016 -6.006 758 HB THR 91 HB THR 91 -5.705 -6.307 -7.864 759 HG1 THR 91 HG1 THR 91 -6.188 -8.787 -6.769 760 HG21 THR 91 HG21 THR 91 -3.461 -6.819 -8.690 761 HG22 THR 91 HG22 THR 91 -4.685 -7.687 -9.617 762 HG23 THR 91 HG23 THR 91 -3.736 -8.536 -8.396 763 H LEU 92 HN LEU 92 -5.187 -4.654 -5.905 764 HA LEU 92 HA LEU 92 -2.773 -3.556 -6.955 765 HB2 LEU 92 HB2 LEU 92 -4.879 -2.348 -7.140 766 HB3 LEU 92 HB1 LEU 92 -5.006 -2.252 -5.395 767 HG LEU 92 HG LEU 92 -2.908 -0.884 -5.382 768 HD11 LEU 92 HD11 LEU 92 -2.186 0.141 -7.478 769 HD12 LEU 92 HD12 LEU 92 -3.333 -0.863 -8.365 770 HD13 LEU 92 HD13 LEU 92 -1.985 -1.611 -7.509 771 HD21 LEU 92 HD21 LEU 92 -3.992 1.164 -6.166 772 HD22 LEU 92 HD22 LEU 92 -5.090 0.162 -5.216 773 HD23 LEU 92 HD23 LEU 92 -5.225 0.196 -6.975 774 H LEU 93 HN LEU 93 -4.153 -3.739 -3.684 775 HA LEU 93 HA LEU 93 -2.017 -2.429 -2.401 776 HB2 LEU 93 HB2 LEU 93 -3.987 -4.430 -1.284 777 HB3 LEU 93 HB1 LEU 93 -2.915 -3.436 -0.320 778 HG LEU 93 HG LEU 93 -5.119 -2.407 -2.106 779 HD11 LEU 93 HD11 LEU 93 -5.985 -3.532 -0.133 780 HD12 LEU 93 HD12 LEU 93 -6.208 -1.788 0.001 781 HD13 LEU 93 HD13 LEU 93 -4.913 -2.583 0.898 782 HD21 LEU 93 HD21 LEU 93 -4.630 -0.245 -1.017 783 HD22 LEU 93 HD22 LEU 93 -3.292 -0.831 -2.004 784 HD23 LEU 93 HD23 LEU 93 -3.222 -0.977 -0.249 785 H ASP 94 HN ASP 94 -2.528 -5.769 -3.312 786 HA ASP 94 HA ASP 94 -0.513 -6.857 -1.630 787 HB2 ASP 94 HB2 ASP 94 -2.340 -8.220 -2.656 788 HB3 ASP 94 HB1 ASP 94 -1.555 -8.023 -4.223 789 H LYS 95 HN LYS 95 -0.499 -5.892 -5.094 790 HA LYS 95 HA LYS 95 2.151 -6.568 -5.587 791 HB2 LYS 95 HB2 LYS 95 0.506 -5.931 -7.334 792 HB3 LYS 95 HB1 LYS 95 0.587 -4.266 -6.774 793 HG2 LYS 95 HG2 LYS 95 2.946 -4.157 -7.387 794 HG3 LYS 95 HG1 LYS 95 2.897 -5.841 -7.908 795 HD2 LYS 95 HD2 LYS 95 2.736 -4.400 -9.834 796 HD3 LYS 95 HD1 LYS 95 1.207 -5.243 -9.599 797 HE2 LYS 95 HE2 LYS 95 0.231 -3.265 -8.599 798 HE3 LYS 95 HE1 LYS 95 1.774 -2.419 -8.696 799 HZ1 LYS 95 HZ1 LYS 95 1.664 -2.559 -11.098 800 HZ2 LYS 95 HZ2 LYS 95 0.291 -1.782 -10.490 801 HZ3 LYS 95 HZ3 LYS 95 0.191 -3.387 -11.013 802 H LEU 96 HN LEU 96 0.759 -3.506 -4.456 803 HA LEU 96 HA LEU 96 3.143 -2.093 -4.194 804 HB2 LEU 96 HB2 LEU 96 0.695 -1.908 -2.433 805 HB3 LEU 96 HB1 LEU 96 1.980 -0.720 -2.514 806 HG LEU 96 HG LEU 96 0.126 -1.441 -4.786 807 HD11 LEU 96 HD11 LEU 96 -1.023 -0.220 -3.030 808 HD12 LEU 96 HD12 LEU 96 -0.784 0.806 -4.444 809 HD13 LEU 96 HD13 LEU 96 0.248 1.003 -3.028 810 HD21 LEU 96 HD21 LEU 96 2.277 0.663 -4.576 811 HD22 LEU 96 HD22 LEU 96 1.130 0.498 -5.906 812 HD23 LEU 96 HD23 LEU 96 2.313 -0.773 -5.601 813 H THR 97 HN THR 97 1.556 -4.263 -1.862 814 HA THR 97 HA THR 97 3.392 -4.077 0.212 815 HB THR 97 HB THR 97 2.024 -6.631 -0.670 816 HG1 THR 97 HG1 THR 97 0.606 -4.722 -0.325 817 HG21 THR 97 HG21 THR 97 2.907 -5.716 2.065 818 HG22 THR 97 HG22 THR 97 3.791 -6.856 1.051 819 HG23 THR 97 HG23 THR 97 2.186 -7.272 1.654 820 H GLN 98 HN GLN 98 3.442 -6.253 -2.610 821 HA GLN 98 HA GLN 98 5.854 -7.552 -1.884 822 HB2 GLN 98 HB2 GLN 98 4.558 -7.308 -4.601 823 HB3 GLN 98 HB1 GLN 98 5.830 -8.442 -4.175 824 HG2 GLN 98 HG2 GLN 98 3.081 -8.385 -2.950 825 HG3 GLN 98 HG1 GLN 98 3.597 -9.466 -4.241 826 HE21 GLN 98 HE21 GLN 98 3.201 -11.299 -3.044 827 HE22 GLN 98 HE22 GLN 98 4.195 -11.777 -1.714 828 H GLN 99 HN GLN 99 5.113 -4.755 -3.870 829 HA GLN 99 HA GLN 99 7.607 -4.345 -5.059 830 HB2 GLN 99 HB2 GLN 99 5.556 -3.120 -5.682 831 HB3 GLN 99 HB1 GLN 99 5.597 -2.275 -4.143 832 HG2 GLN 99 HG2 GLN 99 6.436 -0.859 -5.908 833 HG3 GLN 99 HG1 GLN 99 7.725 -1.245 -4.769 834 HE21 GLN 99 HE21 GLN 99 6.480 -1.754 -7.973 835 HE22 GLN 99 HE22 GLN 99 7.925 -2.432 -8.640 836 H LEU 100 HN LEU 100 6.308 -3.156 -1.990 837 HA LEU 100 HA LEU 100 8.684 -1.793 -1.231 838 HB2 LEU 100 HB2 LEU 100 6.351 -2.761 0.422 839 HB3 LEU 100 HB1 LEU 100 7.617 -1.701 1.011 840 HG LEU 100 HG LEU 100 5.628 -1.051 -1.164 841 HD11 LEU 100 HD11 LEU 100 4.779 0.575 0.442 842 HD12 LEU 100 HD12 LEU 100 5.941 0.002 1.639 843 HD13 LEU 100 HD13 LEU 100 4.664 -1.070 1.068 844 HD21 LEU 100 HD21 LEU 100 7.859 0.597 0.018 845 HD22 LEU 100 HD22 LEU 100 6.599 1.213 -1.050 846 HD23 LEU 100 HD23 LEU 100 7.745 0.012 -1.643 847 H GLN 101 HN GLN 101 7.304 -4.945 -0.431 848 HA GLN 101 HA GLN 101 9.160 -5.669 1.541 849 HB2 GLN 101 HB2 GLN 101 7.004 -6.785 1.237 850 HB3 GLN 101 HB1 GLN 101 7.525 -7.413 -0.315 851 HG2 GLN 101 HG2 GLN 101 9.076 -8.090 2.142 852 HG3 GLN 101 HG1 GLN 101 7.558 -8.918 1.813 853 HE21 GLN 101 HE21 GLN 101 10.247 -10.009 1.910 854 HE22 GLN 101 HE22 GLN 101 10.547 -10.710 0.355 855 H GLY 102 HN GLY 102 9.138 -6.280 -1.963 856 HA2 GLY 102 HA2 GLY 102 11.522 -7.795 -2.024 857 HA3 GLY 102 HA1 GLY 102 10.819 -6.931 -3.384 858 H LEU 103 HN LEU 103 10.903 -4.334 -2.438 859 HA LEU 103 HA LEU 103 13.571 -3.616 -3.010 860 HB2 LEU 103 HB2 LEU 103 11.624 -2.183 -3.503 861 HB3 LEU 103 HB1 LEU 103 11.355 -1.963 -1.784 862 HG LEU 103 HG LEU 103 13.552 -0.815 -1.617 863 HD11 LEU 103 HD11 LEU 103 14.663 -0.090 -3.678 864 HD12 LEU 103 HD12 LEU 103 13.544 -1.073 -4.621 865 HD13 LEU 103 HD13 LEU 103 14.675 -1.845 -3.507 866 HD21 LEU 103 HD21 LEU 103 11.502 0.471 -1.880 867 HD22 LEU 103 HD22 LEU 103 11.633 0.343 -3.634 868 HD23 LEU 103 HD23 LEU 103 12.843 1.247 -2.724 869 H ALA 104 HN ALA 104 11.717 -3.733 0.003 870 HA ALA 104 HA ALA 104 13.573 -2.521 1.692 871 HB1 ALA 104 HB1 ALA 104 11.543 -4.658 2.319 872 HB2 ALA 104 HB2 ALA 104 11.302 -2.911 2.400 873 HB3 ALA 104 HB3 ALA 104 12.409 -3.702 3.521 874 H VAL 105 HN VAL 105 13.146 -5.971 0.913 875 HA VAL 105 HA VAL 105 15.251 -6.881 2.558 876 HB VAL 105 HB VAL 105 14.012 -8.143 0.114 877 HG11 VAL 105 HG11 VAL 105 16.249 -9.042 0.439 878 HG12 VAL 105 HG12 VAL 105 15.029 -10.242 0.871 879 HG13 VAL 105 HG13 VAL 105 15.885 -9.361 2.135 880 HG21 VAL 105 HG21 VAL 105 12.891 -9.569 1.782 881 HG22 VAL 105 HG22 VAL 105 12.461 -7.866 1.945 882 HG23 VAL 105 HG23 VAL 105 13.611 -8.597 3.064 883 H THR 106 HN THR 106 15.116 -5.893 -0.819 884 HA THR 106 HA THR 106 17.724 -6.595 -1.545 885 HB THR 106 HB THR 106 16.027 -4.324 -2.600 886 HG1 THR 106 HG1 THR 106 14.891 -6.135 -3.030 887 HG21 THR 106 HG21 THR 106 18.363 -4.080 -3.262 888 HG22 THR 106 HG22 THR 106 17.371 -4.552 -4.642 889 HG23 THR 106 HG23 THR 106 18.386 -5.747 -3.835 890 H ILE 107 HN ILE 107 16.433 -3.612 -0.115 891 HA ILE 107 HA ILE 107 18.943 -2.249 -0.107 892 HB ILE 107 HB ILE 107 16.482 -1.690 1.554 893 HG12 ILE 107 HG12 ILE 107 17.353 -0.417 -1.052 894 HG13 ILE 107 HG11 ILE 107 16.095 -1.643 -0.918 895 HG21 ILE 107 HG21 ILE 107 17.408 0.573 1.758 896 HG22 ILE 107 HG22 ILE 107 18.854 0.048 0.896 897 HG23 ILE 107 HG23 ILE 107 18.468 -0.645 2.470 898 HD11 ILE 107 HD11 ILE 107 15.150 0.587 -1.081 899 HD12 ILE 107 HD12 ILE 107 16.042 1.081 0.359 900 HD13 ILE 107 HD13 ILE 107 14.779 -0.145 0.481 901 H SER 108 HN SER 108 17.163 -4.227 2.190 902 HA SER 108 HA SER 108 18.743 -3.634 4.455 903 HB2 SER 108 HB2 SER 108 16.465 -4.664 4.530 904 HB3 SER 108 HB1 SER 108 17.163 -6.164 3.924 905 HG SER 108 HG SER 108 18.659 -5.565 5.937 906 H ARG 109 HN ARG 109 19.238 -5.714 1.732 907 HA ARG 109 HA ARG 109 21.424 -7.085 3.083 908 HB2 ARG 109 HB2 ARG 109 19.799 -8.365 1.653 909 HB3 ARG 109 HB1 ARG 109 20.436 -7.509 0.256 910 HG2 ARG 109 HG2 ARG 109 21.400 -9.745 0.483 911 HG3 ARG 109 HG1 ARG 109 22.626 -8.484 0.621 912 HD2 ARG 109 HD2 ARG 109 22.429 -8.681 3.106 913 HD3 ARG 109 HD1 ARG 109 21.370 -10.067 2.862 914 HE ARG 109 HE ARG 109 23.566 -10.744 1.456 915 HH11 ARG 109 HH11 ARG 109 23.098 -9.616 4.737 916 HH12 ARG 109 HH12 ARG 109 24.508 -10.421 5.350 917 HH21 ARG 109 HH21 ARG 109 25.437 -11.797 2.260 918 HH22 ARG 109 HH22 ARG 109 25.831 -11.665 3.945 919 H GLU 110 HN GLU 110 21.230 -4.163 2.002 920 HA GLU 110 HA GLU 110 23.725 -4.160 0.485 921 HB2 GLU 110 HB2 GLU 110 21.920 -1.884 1.338 922 HB3 GLU 110 HB1 GLU 110 23.380 -1.698 0.377 923 HG2 GLU 110 HG2 GLU 110 22.369 -3.132 -1.360 924 HG3 GLU 110 HG1 GLU 110 20.886 -3.183 -0.407 925 H ASN 111 HN ASN 111 22.801 -4.408 3.580 926 HA ASN 111 HA ASN 111 25.013 -2.815 4.660 927 HB2 ASN 111 HB2 ASN 111 22.599 -4.051 6.009 928 HB3 ASN 111 HB1 ASN 111 23.890 -3.222 6.869 929 HD21 ASN 111 HD21 ASN 111 24.019 -1.004 6.782 930 HD22 ASN 111 HD22 ASN 111 22.759 -0.017 6.124 931 H ILE 112 HN ILE 112 26.029 -4.874 3.398 932 HA ILE 112 HA ILE 112 26.126 -7.229 5.081 933 HB ILE 112 HB ILE 112 27.811 -6.706 2.633 934 HG12 ILE 112 HG12 ILE 112 25.130 -8.099 2.760 935 HG13 ILE 112 HG11 ILE 112 25.362 -6.467 2.157 936 HG21 ILE 112 HG21 ILE 112 26.932 -9.245 4.000 937 HG22 ILE 112 HG22 ILE 112 28.551 -8.545 4.046 938 HG23 ILE 112 HG23 ILE 112 27.896 -9.155 2.525 939 HD11 ILE 112 HD11 ILE 112 25.193 -8.053 0.336 940 HD12 ILE 112 HD12 ILE 112 26.548 -8.972 0.991 941 HD13 ILE 112 HD13 ILE 112 26.804 -7.337 0.382 942 H THR 113 HN THR 113 26.906 -5.502 6.741 943 HA THR 113 HA THR 113 29.809 -5.190 6.671 944 HB THR 113 HB THR 113 29.362 -3.953 8.868 945 HG1 THR 113 HG1 THR 113 27.089 -3.217 8.959 946 HG21 THR 113 HG21 THR 113 28.542 -1.931 7.721 947 HG22 THR 113 HG22 THR 113 28.109 -2.913 6.323 948 HG23 THR 113 HG23 THR 113 29.799 -2.751 6.799 949 H GLU 114 HN GLU 114 27.374 -6.235 9.029 950 HA GLU 114 HA GLU 114 29.232 -7.781 10.543 951 HB2 GLU 114 HB2 GLU 114 27.054 -6.667 11.337 952 HB3 GLU 114 HB1 GLU 114 26.234 -8.046 10.630 953 HG2 GLU 114 HG2 GLU 114 26.511 -8.447 12.959 954 HG3 GLU 114 HG1 GLU 114 27.597 -9.524 12.082 955 H VAL 115 HN VAL 115 30.037 -9.666 9.853 956 HA VAL 115 HA VAL 115 28.353 -11.358 8.141 957 HB VAL 115 HB VAL 115 30.486 -12.551 7.556 958 HG11 VAL 115 HG11 VAL 115 31.248 -10.831 5.994 959 HG12 VAL 115 HG12 VAL 115 30.359 -9.610 6.904 960 HG13 VAL 115 HG13 VAL 115 29.488 -10.896 6.071 961 HG21 VAL 115 HG21 VAL 115 31.766 -10.197 8.945 962 HG22 VAL 115 HG22 VAL 115 32.607 -11.402 7.973 963 HG23 VAL 115 HG23 VAL 115 31.829 -11.876 9.482 964 H GLY 116 HN GLY 116 28.175 -11.137 11.026 965 HA2 GLY 116 HA2 GLY 116 28.257 -13.973 11.625 966 HA3 GLY 116 HA1 GLY 116 29.257 -12.953 12.653 967 H ALA 117 HN ALA 117 27.720 -13.955 14.273 968 HA ALA 117 HA ALA 117 25.316 -12.265 14.501 969 HB1 ALA 117 HB1 ALA 117 24.685 -14.568 13.984 970 HB2 ALA 117 HB2 ALA 117 24.178 -14.121 15.612 971 HB3 ALA 117 HB3 ALA 117 25.600 -15.138 15.380 972 HA PRO 118 HA PRO 118 27.873 -11.612 18.266 973 HB2 PRO 118 HB2 PRO 118 27.796 -8.933 18.301 974 HB3 PRO 118 HB1 PRO 118 28.910 -9.805 17.243 975 HG2 PRO 118 HG2 PRO 118 26.301 -8.503 16.587 976 HG3 PRO 118 HG1 PRO 118 27.809 -8.520 15.655 977 HD2 PRO 118 HD2 PRO 118 25.649 -10.167 15.167 978 HD3 PRO 118 HD1 PRO 118 27.316 -10.527 14.684 979 H THR 119 HN THR 119 27.200 -10.957 20.347 980 HA THR 119 HA THR 119 24.362 -10.973 20.756 981 HB THR 119 HB THR 119 25.087 -10.668 23.199 982 HG1 THR 119 HG1 THR 119 27.187 -9.815 22.629 983 HG21 THR 119 HG21 THR 119 24.478 -12.842 22.246 984 HG22 THR 119 HG22 THR 119 25.816 -13.001 23.385 985 HG23 THR 119 HG23 THR 119 26.125 -13.046 21.649 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 -31.998 8.880 -0.021 2 H2 GLY 1 HT2 GLY 1 -31.457 8.278 -1.507 3 H3 GLY 1 HT3 GLY 1 -31.302 7.340 -0.109 4 HA2 GLY 1 HA1 GLY 1 -33.135 6.553 -1.469 5 HA3 GLY 1 HA2 GLY 1 -33.690 7.154 0.088 6 HA PRO 2 HA PRO 2 -35.483 9.284 -3.946 7 HB2 PRO 2 HB2 PRO 2 -38.018 8.151 -3.634 8 HB3 PRO 2 HB1 PRO 2 -36.809 7.661 -4.822 9 HG2 PRO 2 HG2 PRO 2 -37.463 6.463 -2.172 10 HG3 PRO 2 HG1 PRO 2 -37.004 5.663 -3.686 11 HD2 PRO 2 HD2 PRO 2 -35.260 5.933 -1.680 12 HD3 PRO 2 HD1 PRO 2 -34.742 6.099 -3.370 13 H MET 3 HN MET 3 -36.761 8.536 -0.750 14 HA MET 3 HA MET 3 -37.670 11.325 -0.552 15 HB2 MET 3 HB2 MET 3 -39.582 10.557 0.839 16 HB3 MET 3 HB1 MET 3 -39.673 10.003 -0.825 17 HG2 MET 3 HG2 MET 3 -38.832 7.810 -0.130 18 HG3 MET 3 HG1 MET 3 -38.777 8.372 1.539 19 HE1 MET 3 HE1 MET 3 -41.788 5.862 1.532 20 HE2 MET 3 HE2 MET 3 -40.241 6.278 2.268 21 HE3 MET 3 HE3 MET 3 -40.302 5.730 0.593 22 H ALA 4 HN ALA 4 -35.205 10.001 0.253 23 HA ALA 4 HA ALA 4 -35.205 10.756 3.053 24 HB1 ALA 4 HB1 ALA 4 -35.839 8.392 3.124 25 HB2 ALA 4 HB2 ALA 4 -34.251 8.665 3.839 26 HB3 ALA 4 HB3 ALA 4 -34.382 7.979 2.220 27 H MET 5 HN MET 5 -33.707 12.309 2.753 28 HA MET 5 HA MET 5 -31.237 11.784 1.348 29 HB2 MET 5 HB2 MET 5 -32.108 14.017 1.204 30 HB3 MET 5 HB1 MET 5 -32.233 14.143 2.952 31 HG2 MET 5 HG2 MET 5 -30.358 15.429 2.068 32 HG3 MET 5 HG1 MET 5 -29.827 14.156 3.163 33 HE1 MET 5 HE1 MET 5 -27.838 15.691 1.267 34 HE2 MET 5 HE2 MET 5 -26.869 14.363 0.632 35 HE3 MET 5 HE3 MET 5 -27.339 14.377 2.331 36 H LEU 6 HN LEU 6 -30.294 10.080 2.478 37 HA LEU 6 HA LEU 6 -29.119 10.873 5.048 38 HB2 LEU 6 HB2 LEU 6 -31.020 9.307 5.436 39 HB3 LEU 6 HB1 LEU 6 -30.205 8.118 4.439 40 HG LEU 6 HG LEU 6 -28.326 8.095 6.064 41 HD11 LEU 6 HD11 LEU 6 -28.685 9.092 8.282 42 HD12 LEU 6 HD12 LEU 6 -30.147 9.871 7.679 43 HD13 LEU 6 HD13 LEU 6 -28.575 10.307 7.008 44 HD21 LEU 6 HD21 LEU 6 -30.096 6.426 6.186 45 HD22 LEU 6 HD22 LEU 6 -31.039 7.491 7.228 46 HD23 LEU 6 HD23 LEU 6 -29.502 6.839 7.793 47 H ALA 7 HN ALA 7 -27.290 11.414 3.758 48 HA ALA 7 HA ALA 7 -25.981 9.340 2.241 49 HB1 ALA 7 HB1 ALA 7 -24.316 11.034 1.729 50 HB2 ALA 7 HB2 ALA 7 -25.051 12.126 2.901 51 HB3 ALA 7 HB3 ALA 7 -25.944 11.654 1.457 52 H ARG 8 HN ARG 8 -25.137 7.760 3.451 53 HA ARG 8 HA ARG 8 -23.420 8.517 5.723 54 HB2 ARG 8 HB2 ARG 8 -24.792 5.871 5.189 55 HB3 ARG 8 HB1 ARG 8 -23.796 6.248 6.588 56 HG2 ARG 8 HG2 ARG 8 -26.418 7.549 5.882 57 HG3 ARG 8 HG1 ARG 8 -26.163 6.335 7.137 58 HD2 ARG 8 HD2 ARG 8 -24.908 9.079 7.058 59 HD3 ARG 8 HD1 ARG 8 -26.277 8.605 8.062 60 HE ARG 8 HE ARG 8 -24.382 6.824 8.771 61 HH11 ARG 8 HH11 ARG 8 -24.354 10.314 8.506 62 HH12 ARG 8 HH12 ARG 8 -23.204 10.531 9.783 63 HH21 ARG 8 HH21 ARG 8 -22.862 7.103 10.451 64 HH22 ARG 8 HH22 ARG 8 -22.350 8.700 10.890 65 H ARG 9 HN ARG 9 -21.421 7.362 5.957 66 HA ARG 9 HA ARG 9 -20.195 6.832 3.398 67 HB2 ARG 9 HB2 ARG 9 -19.120 8.202 5.236 68 HB3 ARG 9 HB1 ARG 9 -18.909 6.702 6.129 69 HG2 ARG 9 HG2 ARG 9 -17.544 5.819 4.292 70 HG3 ARG 9 HG1 ARG 9 -17.723 7.353 3.439 71 HD2 ARG 9 HD2 ARG 9 -15.602 7.334 4.573 72 HD3 ARG 9 HD1 ARG 9 -16.667 8.494 5.367 73 HE ARG 9 HE ARG 9 -17.010 6.179 6.781 74 HH11 ARG 9 HH11 ARG 9 -14.248 8.156 5.917 75 HH12 ARG 9 HH12 ARG 9 -13.344 7.742 7.337 76 HH21 ARG 9 HH21 ARG 9 -15.812 5.626 8.658 77 HH22 ARG 9 HH22 ARG 9 -14.231 6.307 8.896 78 H GLN 10 HN GLN 10 -21.961 4.944 3.609 79 HA GLN 10 HA GLN 10 -20.378 2.545 3.859 80 HB2 GLN 10 HB2 GLN 10 -21.380 2.874 6.128 81 HB3 GLN 10 HB1 GLN 10 -22.972 2.791 5.392 82 HG2 GLN 10 HG2 GLN 10 -22.298 0.680 6.448 83 HG3 GLN 10 HG1 GLN 10 -22.596 0.509 4.719 84 HE21 GLN 10 HE21 GLN 10 -20.178 0.546 7.221 85 HE22 GLN 10 HE22 GLN 10 -18.904 -0.134 6.275 86 H ARG 11 HN ARG 11 -20.851 3.271 1.592 87 HA ARG 11 HA ARG 11 -23.136 1.763 0.580 88 HB2 ARG 11 HB2 ARG 11 -23.440 3.615 -1.151 89 HB3 ARG 11 HB1 ARG 11 -24.015 3.955 0.474 90 HG2 ARG 11 HG2 ARG 11 -22.155 5.347 0.940 91 HG3 ARG 11 HG1 ARG 11 -21.319 4.826 -0.525 92 HD2 ARG 11 HD2 ARG 11 -23.956 6.263 -0.550 93 HD3 ARG 11 HD1 ARG 11 -22.404 7.096 -0.627 94 HE ARG 11 HE ARG 11 -22.305 5.213 -2.626 95 HH11 ARG 11 HH11 ARG 11 -24.403 7.888 -1.799 96 HH12 ARG 11 HH12 ARG 11 -24.820 8.239 -3.445 97 HH21 ARG 11 HH21 ARG 11 -22.854 5.659 -4.793 98 HH22 ARG 11 HH22 ARG 11 -23.939 6.962 -5.156 99 H ASP 12 HN ASP 12 -20.084 3.386 0.000 100 HA ASP 12 HA ASP 12 -19.404 1.304 -1.947 101 HB2 ASP 12 HB2 ASP 12 -18.726 4.248 -2.226 102 HB3 ASP 12 HB1 ASP 12 -18.183 2.965 -3.301 103 HA PRO 13 HA PRO 13 -16.449 1.693 1.689 104 HB2 PRO 13 HB2 PRO 13 -16.324 -1.229 1.181 105 HB3 PRO 13 HB1 PRO 13 -16.504 -0.360 2.708 106 HG2 PRO 13 HG2 PRO 13 -18.568 -1.644 1.611 107 HG3 PRO 13 HG1 PRO 13 -18.790 -0.091 2.439 108 HD2 PRO 13 HD2 PRO 13 -18.697 -0.685 -0.489 109 HD3 PRO 13 HD1 PRO 13 -19.730 0.454 0.399 110 H LEU 14 HN LEU 14 -16.220 -0.242 -1.275 111 HA LEU 14 HA LEU 14 -13.378 -0.443 -1.242 112 HB2 LEU 14 HB2 LEU 14 -15.192 -0.572 -3.662 113 HB3 LEU 14 HB1 LEU 14 -13.552 -1.195 -3.542 114 HG LEU 14 HG LEU 14 -15.940 -2.259 -2.020 115 HD11 LEU 14 HD11 LEU 14 -15.680 -4.226 -3.462 116 HD12 LEU 14 HD12 LEU 14 -14.435 -3.375 -4.377 117 HD13 LEU 14 HD13 LEU 14 -16.093 -2.776 -4.377 118 HD21 LEU 14 HD21 LEU 14 -13.080 -3.197 -2.148 119 HD22 LEU 14 HD22 LEU 14 -14.411 -4.119 -1.449 120 HD23 LEU 14 HD23 LEU 14 -13.934 -2.578 -0.734 121 H GLN 15 HN GLN 15 -15.638 1.916 -2.493 122 HA GLN 15 HA GLN 15 -13.689 3.396 -3.971 123 HB2 GLN 15 HB2 GLN 15 -16.471 4.076 -3.023 124 HB3 GLN 15 HB1 GLN 15 -15.486 5.176 -3.977 125 HG2 GLN 15 HG2 GLN 15 -16.316 2.414 -4.836 126 HG3 GLN 15 HG1 GLN 15 -17.102 3.915 -5.329 127 HE21 GLN 15 HE21 GLN 15 -16.052 5.295 -6.741 128 HE22 GLN 15 HE22 GLN 15 -14.697 4.790 -7.690 129 H ALA 16 HN ALA 16 -15.164 3.737 -0.762 130 HA ALA 16 HA ALA 16 -13.839 6.118 -0.040 131 HB1 ALA 16 HB1 ALA 16 -15.749 5.240 1.206 132 HB2 ALA 16 HB2 ALA 16 -14.363 5.502 2.265 133 HB3 ALA 16 HB3 ALA 16 -14.777 3.869 1.740 134 H LEU 17 HN LEU 17 -13.001 2.708 0.471 135 HA LEU 17 HA LEU 17 -10.545 3.195 1.764 136 HB2 LEU 17 HB2 LEU 17 -11.733 1.036 1.833 137 HB3 LEU 17 HB1 LEU 17 -11.381 0.800 0.132 138 HG LEU 17 HG LEU 17 -8.959 0.790 0.660 139 HD11 LEU 17 HD11 LEU 17 -9.918 0.871 3.517 140 HD12 LEU 17 HD12 LEU 17 -8.983 2.115 2.687 141 HD13 LEU 17 HD13 LEU 17 -8.264 0.537 3.002 142 HD21 LEU 17 HD21 LEU 17 -10.165 -1.301 0.462 143 HD22 LEU 17 HD22 LEU 17 -10.632 -1.214 2.160 144 HD23 LEU 17 HD23 LEU 17 -8.937 -1.418 1.721 145 H ARG 18 HN ARG 18 -11.450 2.923 -1.615 146 HA ARG 18 HA ARG 18 -8.949 2.577 -2.785 147 HB2 ARG 18 HB2 ARG 18 -11.204 2.494 -3.923 148 HB3 ARG 18 HB1 ARG 18 -11.195 4.251 -3.926 149 HG2 ARG 18 HG2 ARG 18 -9.214 4.259 -5.329 150 HG3 ARG 18 HG1 ARG 18 -9.166 2.496 -5.288 151 HD2 ARG 18 HD2 ARG 18 -11.485 2.523 -6.274 152 HD3 ARG 18 HD1 ARG 18 -11.272 4.254 -6.525 153 HE ARG 18 HE ARG 18 -9.087 3.136 -7.704 154 HH11 ARG 18 HH11 ARG 18 -12.547 2.731 -8.041 155 HH12 ARG 18 HH12 ARG 18 -12.458 2.232 -9.698 156 HH21 ARG 18 HH21 ARG 18 -8.963 2.475 -9.891 157 HH22 ARG 18 HH22 ARG 18 -10.418 2.094 -10.754 158 H ARG 19 HN ARG 19 -10.546 5.515 -1.673 159 HA ARG 19 HA ARG 19 -8.663 7.366 -2.659 160 HB2 ARG 19 HB2 ARG 19 -10.874 8.037 -1.843 161 HB3 ARG 19 HB1 ARG 19 -10.452 7.516 -0.220 162 HG2 ARG 19 HG2 ARG 19 -8.802 9.253 -0.038 163 HG3 ARG 19 HG1 ARG 19 -9.057 9.721 -1.720 164 HD2 ARG 19 HD2 ARG 19 -10.213 11.215 -0.139 165 HD3 ARG 19 HD1 ARG 19 -11.321 10.392 -1.231 166 HE ARG 19 HE ARG 19 -10.863 9.348 1.480 167 HH11 ARG 19 HH11 ARG 19 -13.022 10.647 -0.961 168 HH12 ARG 19 HH12 ARG 19 -14.458 10.315 -0.046 169 HH21 ARG 19 HH21 ARG 19 -12.747 8.904 2.677 170 HH22 ARG 19 HH22 ARG 19 -14.303 9.320 2.027 171 H ARG 20 HN ARG 20 -8.911 5.634 0.411 172 HA ARG 20 HA ARG 20 -6.577 6.778 1.558 173 HB2 ARG 20 HB2 ARG 20 -8.445 5.742 2.852 174 HB3 ARG 20 HB1 ARG 20 -7.923 4.167 2.278 175 HG2 ARG 20 HG2 ARG 20 -5.772 4.468 3.403 176 HG3 ARG 20 HG1 ARG 20 -6.293 6.055 3.969 177 HD2 ARG 20 HD2 ARG 20 -8.189 4.936 5.146 178 HD3 ARG 20 HD1 ARG 20 -7.492 3.379 4.692 179 HE ARG 20 HE ARG 20 -5.577 5.009 6.028 180 HH11 ARG 20 HH11 ARG 20 -8.373 2.984 6.608 181 HH12 ARG 20 HH12 ARG 20 -7.920 2.602 8.238 182 HH21 ARG 20 HH21 ARG 20 -4.968 4.493 8.176 183 HH22 ARG 20 HH22 ARG 20 -5.986 3.461 9.128 184 H ASN 21 HN ASN 21 -7.204 3.855 -0.332 185 HA ASN 21 HA ASN 21 -4.630 2.716 -0.131 186 HB2 ASN 21 HB2 ASN 21 -6.652 2.533 -2.383 187 HB3 ASN 21 HB1 ASN 21 -5.180 1.575 -2.298 188 HD21 ASN 21 HD21 ASN 21 -7.880 0.627 -2.388 189 HD22 ASN 21 HD22 ASN 21 -8.142 -0.272 -0.936 190 H GLN 22 HN GLN 22 -6.000 5.072 -2.386 191 HA GLN 22 HA GLN 22 -3.739 5.315 -4.043 192 HB2 GLN 22 HB2 GLN 22 -5.944 6.120 -4.711 193 HB3 GLN 22 HB1 GLN 22 -5.920 7.313 -3.423 194 HG2 GLN 22 HG2 GLN 22 -4.136 8.509 -4.476 195 HG3 GLN 22 HG1 GLN 22 -3.948 7.247 -5.691 196 HE21 GLN 22 HE21 GLN 22 -4.548 10.123 -5.972 197 HE22 GLN 22 HE22 GLN 22 -6.011 10.199 -6.886 198 H GLU 23 HN GLU 23 -4.617 6.785 -0.998 199 HA GLU 23 HA GLU 23 -2.652 8.791 -0.884 200 HB2 GLU 23 HB2 GLU 23 -4.611 8.562 0.657 201 HB3 GLU 23 HB1 GLU 23 -3.805 7.196 1.414 202 HG2 GLU 23 HG2 GLU 23 -3.509 9.170 2.750 203 HG3 GLU 23 HG1 GLU 23 -1.959 8.674 2.069 204 H LEU 24 HN LEU 24 -2.651 5.416 0.209 205 HA LEU 24 HA LEU 24 0.017 5.415 1.177 206 HB2 LEU 24 HB2 LEU 24 -1.631 3.097 0.159 207 HB3 LEU 24 HB1 LEU 24 -0.156 2.967 1.093 208 HG LEU 24 HG LEU 24 -2.773 4.113 2.080 209 HD11 LEU 24 HD11 LEU 24 -1.319 1.581 2.819 210 HD12 LEU 24 HD12 LEU 24 -2.751 1.670 1.795 211 HD13 LEU 24 HD13 LEU 24 -2.847 2.149 3.489 212 HD21 LEU 24 HD21 LEU 24 -0.142 3.706 3.499 213 HD22 LEU 24 HD22 LEU 24 -1.659 4.168 4.268 214 HD23 LEU 24 HD23 LEU 24 -0.895 5.253 3.112 215 H LYS 25 HN LYS 25 -1.447 4.586 -1.919 216 HA LYS 25 HA LYS 25 0.797 3.467 -3.154 217 HB2 LYS 25 HB2 LYS 25 -1.563 3.341 -3.964 218 HB3 LYS 25 HB1 LYS 25 -1.426 5.012 -4.487 219 HG2 LYS 25 HG2 LYS 25 0.300 4.418 -6.067 220 HG3 LYS 25 HG1 LYS 25 0.287 2.750 -5.491 221 HD2 LYS 25 HD2 LYS 25 -0.990 2.862 -7.523 222 HD3 LYS 25 HD1 LYS 25 -2.098 2.594 -6.178 223 HE2 LYS 25 HE2 LYS 25 -3.033 4.237 -7.675 224 HE3 LYS 25 HE1 LYS 25 -2.602 5.010 -6.152 225 HZ1 LYS 25 HZ1 LYS 25 -1.027 5.098 -8.666 226 HZ2 LYS 25 HZ2 LYS 25 -0.555 5.799 -7.204 227 HZ3 LYS 25 HZ3 LYS 25 -1.926 6.369 -8.007 228 H GLN 26 HN GLN 26 -0.286 6.816 -2.938 229 HA GLN 26 HA GLN 26 1.564 7.973 -4.701 230 HB2 GLN 26 HB2 GLN 26 -0.418 9.130 -3.774 231 HB3 GLN 26 HB1 GLN 26 0.348 9.150 -2.194 232 HG2 GLN 26 HG2 GLN 26 2.188 10.506 -3.186 233 HG3 GLN 26 HG1 GLN 26 1.242 10.596 -4.671 234 HE21 GLN 26 HE21 GLN 26 0.955 12.790 -4.586 235 HE22 GLN 26 HE22 GLN 26 -0.043 13.570 -3.408 236 H GLN 27 HN GLN 27 1.688 7.376 -1.242 237 HA GLN 27 HA GLN 27 4.226 8.473 -0.744 238 HB2 GLN 27 HB2 GLN 27 2.673 6.312 0.678 239 HB3 GLN 27 HB1 GLN 27 4.180 6.981 1.291 240 HG2 GLN 27 HG2 GLN 27 3.215 9.136 1.538 241 HG3 GLN 27 HG1 GLN 27 1.760 8.652 0.673 242 HE21 GLN 27 HE21 GLN 27 0.196 7.464 1.746 243 HE22 GLN 27 HE22 GLN 27 0.211 7.245 3.459 244 H VAL 28 HN VAL 28 3.244 5.163 -1.545 245 HA VAL 28 HA VAL 28 5.724 3.927 -1.522 246 HB VAL 28 HB VAL 28 3.370 3.402 -3.345 247 HG11 VAL 28 HG11 VAL 28 5.398 2.458 -4.308 248 HG12 VAL 28 HG12 VAL 28 4.333 1.186 -3.710 249 HG13 VAL 28 HG13 VAL 28 5.758 1.651 -2.783 250 HG21 VAL 28 HG21 VAL 28 2.831 3.136 -0.992 251 HG22 VAL 28 HG22 VAL 28 4.240 2.097 -0.768 252 HG23 VAL 28 HG23 VAL 28 2.899 1.561 -1.783 253 H ASP 29 HN ASP 29 4.129 5.581 -4.257 254 HA ASP 29 HA ASP 29 6.198 5.113 -6.113 255 HB2 ASP 29 HB2 ASP 29 3.998 7.166 -6.019 256 HB3 ASP 29 HB1 ASP 29 5.192 7.154 -7.312 257 H SER 30 HN SER 30 5.633 7.768 -3.857 258 HA SER 30 HA SER 30 7.710 9.439 -4.765 259 HB2 SER 30 HB2 SER 30 5.898 10.180 -3.229 260 HB3 SER 30 HB1 SER 30 6.609 9.198 -1.948 261 HG SER 30 HG SER 30 8.180 10.611 -1.703 262 H LEU 31 HN LEU 31 7.649 6.719 -2.558 263 HA LEU 31 HA LEU 31 10.287 7.064 -1.539 264 HB2 LEU 31 HB2 LEU 31 8.478 5.751 -0.431 265 HB3 LEU 31 HB1 LEU 31 8.627 4.547 -1.693 266 HG LEU 31 HG LEU 31 10.956 4.112 -0.979 267 HD11 LEU 31 HD11 LEU 31 10.279 6.116 1.160 268 HD12 LEU 31 HD12 LEU 31 11.580 6.205 -0.029 269 HD13 LEU 31 HD13 LEU 31 11.635 4.995 1.253 270 HD21 LEU 31 HD21 LEU 31 8.876 3.879 1.191 271 HD22 LEU 31 HD22 LEU 31 10.387 2.974 1.118 272 HD23 LEU 31 HD23 LEU 31 9.153 2.732 -0.119 273 H LEU 32 HN LEU 32 8.871 5.019 -4.037 274 HA LEU 32 HA LEU 32 11.188 3.718 -4.885 275 HB2 LEU 32 HB2 LEU 32 8.734 4.493 -6.466 276 HB3 LEU 32 HB1 LEU 32 9.950 3.352 -7.011 277 HG LEU 32 HG LEU 32 8.246 2.989 -4.547 278 HD11 LEU 32 HD11 LEU 32 7.997 1.766 -7.288 279 HD12 LEU 32 HD12 LEU 32 6.872 2.897 -6.537 280 HD13 LEU 32 HD13 LEU 32 7.077 1.279 -5.866 281 HD21 LEU 32 HD21 LEU 32 9.079 0.681 -4.629 282 HD22 LEU 32 HD22 LEU 32 10.376 1.847 -4.382 283 HD23 LEU 32 HD23 LEU 32 10.137 1.122 -5.970 284 H SER 33 HN SER 33 9.893 6.872 -5.727 285 HA SER 33 HA SER 33 11.629 7.381 -7.907 286 HB2 SER 33 HB2 SER 33 9.530 8.637 -7.508 287 HB3 SER 33 HB1 SER 33 10.255 9.365 -6.075 288 HG SER 33 HG SER 33 10.853 9.782 -8.792 289 H GLU 34 HN GLU 34 11.777 8.263 -4.468 290 HA GLU 34 HA GLU 34 14.268 9.595 -4.649 291 HB2 GLU 34 HB2 GLU 34 12.827 8.379 -2.304 292 HB3 GLU 34 HB1 GLU 34 14.378 9.190 -2.140 293 HG2 GLU 34 HG2 GLU 34 13.289 11.205 -3.208 294 HG3 GLU 34 HG1 GLU 34 11.752 10.371 -2.991 295 H SER 35 HN SER 35 13.393 6.276 -4.329 296 HA SER 35 HA SER 35 15.801 5.209 -3.379 297 HB2 SER 35 HB2 SER 35 13.787 3.881 -3.415 298 HB3 SER 35 HB1 SER 35 13.676 4.012 -5.169 299 HG SER 35 HG SER 35 16.074 3.007 -4.343 300 H GLN 36 HN GLN 36 14.996 6.483 -6.494 301 HA GLN 36 HA GLN 36 17.143 5.043 -7.828 302 HB2 GLN 36 HB2 GLN 36 14.995 5.380 -8.986 303 HB3 GLN 36 HB1 GLN 36 15.219 7.120 -8.884 304 HG2 GLN 36 HG2 GLN 36 15.773 6.318 -11.091 305 HG3 GLN 36 HG1 GLN 36 17.209 6.947 -10.288 306 HE21 GLN 36 HE21 GLN 36 18.613 5.781 -11.559 307 HE22 GLN 36 HE22 GLN 36 18.794 4.066 -11.420 308 H LEU 37 HN LEU 37 16.681 7.929 -6.138 309 HA LEU 37 HA LEU 37 18.365 9.677 -7.588 310 HB2 LEU 37 HB2 LEU 37 17.586 9.706 -4.672 311 HB3 LEU 37 HB1 LEU 37 18.347 11.034 -5.526 312 HG LEU 37 HG LEU 37 15.610 9.921 -6.127 313 HD11 LEU 37 HD11 LEU 37 16.440 12.483 -4.780 314 HD12 LEU 37 HD12 LEU 37 15.673 11.098 -4.001 315 HD13 LEU 37 HD13 LEU 37 14.791 12.030 -5.211 316 HD21 LEU 37 HD21 LEU 37 17.127 12.246 -7.281 317 HD22 LEU 37 HD22 LEU 37 15.406 11.958 -7.523 318 HD23 LEU 37 HD23 LEU 37 16.585 10.798 -8.128 319 H LYS 38 HN LYS 38 20.496 9.869 -7.627 320 HA LYS 38 HA LYS 38 22.152 7.927 -6.399 321 HB2 LYS 38 HB2 LYS 38 24.035 9.173 -7.365 322 HB3 LYS 38 HB1 LYS 38 22.761 8.906 -8.545 323 HG2 LYS 38 HG2 LYS 38 21.984 11.211 -8.197 324 HG3 LYS 38 HG1 LYS 38 23.318 11.472 -7.070 325 HD2 LYS 38 HD2 LYS 38 24.901 10.899 -8.898 326 HD3 LYS 38 HD1 LYS 38 23.530 10.794 -10.005 327 HE2 LYS 38 HE2 LYS 38 24.584 12.953 -10.229 328 HE3 LYS 38 HE1 LYS 38 22.991 13.150 -9.504 329 HZ1 LYS 38 HZ1 LYS 38 24.656 14.500 -8.391 330 HZ2 LYS 38 HZ2 LYS 38 25.561 13.121 -8.020 331 HZ3 LYS 38 HZ3 LYS 38 24.031 13.334 -7.341 332 H GLU 39 HN GLU 39 21.166 11.141 -5.524 333 HA GLU 39 HA GLU 39 23.053 11.590 -3.454 334 HB2 GLU 39 HB2 GLU 39 21.353 13.226 -2.608 335 HB3 GLU 39 HB1 GLU 39 21.789 13.448 -4.296 336 HG2 GLU 39 HG2 GLU 39 19.758 12.351 -4.999 337 HG3 GLU 39 HG1 GLU 39 19.328 12.025 -3.324 338 H ALA 40 HN ALA 40 20.342 9.523 -3.709 339 HA ALA 40 HA ALA 40 19.841 9.389 -0.866 340 HB1 ALA 40 HB1 ALA 40 17.960 9.261 -2.389 341 HB2 ALA 40 HB2 ALA 40 18.107 7.768 -1.461 342 HB3 ALA 40 HB3 ALA 40 18.648 7.823 -3.140 343 H LEU 41 HN LEU 41 22.179 8.185 -2.773 344 HA LEU 41 HA LEU 41 22.330 5.475 -1.947 345 HB2 LEU 41 HB2 LEU 41 23.511 6.326 -3.918 346 HB3 LEU 41 HB1 LEU 41 24.514 7.333 -2.895 347 HG LEU 41 HG LEU 41 25.463 5.291 -1.857 348 HD11 LEU 41 HD11 LEU 41 23.865 3.858 -3.968 349 HD12 LEU 41 HD12 LEU 41 23.595 3.780 -2.227 350 HD13 LEU 41 HD13 LEU 41 25.079 3.128 -2.921 351 HD21 LEU 41 HD21 LEU 41 26.841 4.650 -3.759 352 HD22 LEU 41 HD22 LEU 41 26.589 6.396 -3.728 353 HD23 LEU 41 HD23 LEU 41 25.684 5.394 -4.862 354 H GLU 42 HN GLU 42 22.958 8.410 -0.370 355 HA GLU 42 HA GLU 42 24.860 7.866 1.545 356 HB2 GLU 42 HB2 GLU 42 23.736 10.030 1.338 357 HB3 GLU 42 HB1 GLU 42 22.219 9.315 1.857 358 HG2 GLU 42 HG2 GLU 42 23.167 10.557 3.666 359 HG3 GLU 42 HG1 GLU 42 23.238 8.839 4.056 360 HA PRO 43 HA PRO 43 23.295 4.122 3.453 361 HB2 PRO 43 HB2 PRO 43 25.027 5.123 5.669 362 HB3 PRO 43 HB1 PRO 43 24.956 3.519 4.931 363 HG2 PRO 43 HG2 PRO 43 26.937 5.191 4.343 364 HG3 PRO 43 HG1 PRO 43 26.218 4.159 3.094 365 HD2 PRO 43 HD2 PRO 43 25.878 7.083 3.576 366 HD3 PRO 43 HD1 PRO 43 25.898 6.183 2.045 367 H ASN 44 HN ASN 44 23.347 7.232 5.150 368 HA ASN 44 HA ASN 44 21.530 6.395 7.195 369 HB2 ASN 44 HB2 ASN 44 22.315 9.175 6.281 370 HB3 ASN 44 HB1 ASN 44 21.308 8.836 7.685 371 HD21 ASN 44 HD21 ASN 44 23.802 10.227 7.680 372 HD22 ASN 44 HD22 ASN 44 24.903 9.309 8.648 373 H LYS 45 HN LYS 45 21.236 7.862 4.050 374 HA LYS 45 HA LYS 45 18.420 8.359 4.279 375 HB2 LYS 45 HB2 LYS 45 19.817 9.682 2.736 376 HB3 LYS 45 HB1 LYS 45 20.158 8.230 1.803 377 HG2 LYS 45 HG2 LYS 45 18.447 9.620 0.737 378 HG3 LYS 45 HG1 LYS 45 17.810 8.038 1.193 379 HD2 LYS 45 HD2 LYS 45 16.826 9.035 3.215 380 HD3 LYS 45 HD1 LYS 45 17.441 10.614 2.725 381 HE2 LYS 45 HE2 LYS 45 15.522 8.948 1.104 382 HE3 LYS 45 HE1 LYS 45 15.040 10.248 2.191 383 HZ1 LYS 45 HZ1 LYS 45 15.135 11.088 -0.027 384 HZ2 LYS 45 HZ2 LYS 45 16.709 10.503 -0.246 385 HZ3 LYS 45 HZ3 LYS 45 16.423 11.762 0.842 386 H ARG 46 HN ARG 46 20.470 5.797 3.000 387 HA ARG 46 HA ARG 46 18.460 4.251 1.793 388 HB2 ARG 46 HB2 ARG 46 20.985 3.263 3.139 389 HB3 ARG 46 HB1 ARG 46 19.997 2.353 2.004 390 HG2 ARG 46 HG2 ARG 46 20.482 4.148 0.311 391 HG3 ARG 46 HG1 ARG 46 21.660 4.794 1.455 392 HD2 ARG 46 HD2 ARG 46 21.668 2.074 0.158 393 HD3 ARG 46 HD1 ARG 46 22.802 3.393 -0.120 394 HE ARG 46 HE ARG 46 22.593 2.009 2.483 395 HH11 ARG 46 HH11 ARG 46 24.520 3.400 -0.099 396 HH12 ARG 46 HH12 ARG 46 26.027 2.882 0.582 397 HH21 ARG 46 HH21 ARG 46 24.586 1.352 3.380 398 HH22 ARG 46 HH22 ARG 46 26.066 1.731 2.556 399 H GLN 47 HN GLN 47 19.707 4.262 5.121 400 HA GLN 47 HA GLN 47 18.003 2.228 6.088 401 HB2 GLN 47 HB2 GLN 47 19.385 4.514 7.478 402 HB3 GLN 47 HB1 GLN 47 18.430 3.314 8.337 403 HG2 GLN 47 HG2 GLN 47 19.919 1.556 7.430 404 HG3 GLN 47 HG1 GLN 47 20.917 2.827 6.722 405 HE21 GLN 47 HE21 GLN 47 21.521 0.805 8.766 406 HE22 GLN 47 HE22 GLN 47 22.085 1.687 10.141 407 H HIS 48 HN HIS 48 17.630 5.690 5.712 408 HA HIS 48 HA HIS 48 15.192 5.952 7.123 409 HB2 HIS 48 HB2 HIS 48 16.776 7.823 6.400 410 HB3 HIS 48 HB1 HIS 48 16.096 7.663 4.786 411 HD1 HIS 48 HD1 HIS 48 15.410 9.058 8.151 412 HD2 HIS 48 HD2 HIS 48 13.414 8.585 4.540 413 HE1 HIS 48 HE1 HIS 48 13.421 10.585 8.275 414 HE2 HIS 48 HE2 HIS 48 12.369 10.447 5.995 415 H ILE 49 HN ILE 49 15.977 5.287 3.739 416 HA ILE 49 HA ILE 49 13.314 5.200 2.775 417 HB ILE 49 HB ILE 49 15.841 3.904 1.734 418 HG12 ILE 49 HG12 ILE 49 14.317 6.350 0.807 419 HG13 ILE 49 HG11 ILE 49 15.804 6.378 1.748 420 HG21 ILE 49 HG21 ILE 49 13.863 2.665 0.972 421 HG22 ILE 49 HG22 ILE 49 14.669 3.506 -0.353 422 HG23 ILE 49 HG23 ILE 49 13.183 4.161 0.331 423 HD11 ILE 49 HD11 ILE 49 16.976 5.284 -0.107 424 HD12 ILE 49 HD12 ILE 49 16.259 6.823 -0.582 425 HD13 ILE 49 HD13 ILE 49 15.485 5.308 -1.046 426 H TYR 50 HN TYR 50 15.533 2.691 3.977 427 HA TYR 50 HA TYR 50 13.883 0.469 3.613 428 HB2 TYR 50 HB2 TYR 50 16.271 0.324 4.194 429 HB3 TYR 50 HB1 TYR 50 15.933 0.999 5.782 430 HD1 TYR 50 HD1 TYR 50 15.850 -0.484 7.536 431 HD2 TYR 50 HD2 TYR 50 14.766 -1.868 3.657 432 HE1 TYR 50 HE1 TYR 50 15.548 -2.749 8.435 433 HE2 TYR 50 HE2 TYR 50 14.460 -4.136 4.552 434 HH TYR 50 HH TYR 50 14.251 -4.811 7.835 435 H GLN 51 HN GLN 51 14.094 2.786 6.274 436 HA GLN 51 HA GLN 51 12.282 1.429 7.986 437 HB2 GLN 51 HB2 GLN 51 13.933 3.223 8.683 438 HB3 GLN 51 HB1 GLN 51 12.843 4.399 7.963 439 HG2 GLN 51 HG2 GLN 51 12.543 4.241 10.380 440 HG3 GLN 51 HG1 GLN 51 11.087 3.770 9.503 441 HE21 GLN 51 HE21 GLN 51 10.294 2.582 11.216 442 HE22 GLN 51 HE22 GLN 51 10.970 1.059 11.686 443 H ARG 52 HN ARG 52 11.894 3.956 5.544 444 HA ARG 52 HA ARG 52 9.157 4.442 5.978 445 HB2 ARG 52 HB2 ARG 52 10.841 4.709 3.488 446 HB3 ARG 52 HB1 ARG 52 9.164 5.225 3.577 447 HG2 ARG 52 HG2 ARG 52 11.411 6.285 5.280 448 HG3 ARG 52 HG1 ARG 52 10.729 7.082 3.863 449 HD2 ARG 52 HD2 ARG 52 8.501 7.019 5.064 450 HD3 ARG 52 HD1 ARG 52 9.394 6.529 6.504 451 HE ARG 52 HE ARG 52 10.270 8.969 5.168 452 HH11 ARG 52 HH11 ARG 52 8.460 7.529 7.805 453 HH12 ARG 52 HH12 ARG 52 8.442 8.988 8.742 454 HH21 ARG 52 HH21 ARG 52 10.241 10.882 6.410 455 HH22 ARG 52 HH22 ARG 52 9.460 10.886 7.959 456 H CYS 53 HN CYS 53 10.832 2.133 3.872 457 HA CYS 53 HA CYS 53 8.625 0.946 2.687 458 HB2 CYS 53 HB2 CYS 53 10.915 0.405 2.017 459 HB3 CYS 53 HB1 CYS 53 11.204 -0.379 3.573 460 HG CYS 53 HG CYS 53 10.587 -1.966 1.021 461 H ILE 54 HN ILE 54 10.027 0.323 5.871 462 HA ILE 54 HA ILE 54 8.305 -1.884 6.473 463 HB ILE 54 HB ILE 54 9.949 -0.102 8.270 464 HG12 ILE 54 HG12 ILE 54 10.381 -2.931 7.273 465 HG13 ILE 54 HG11 ILE 54 11.258 -1.500 6.730 466 HG21 ILE 54 HG21 ILE 54 8.061 -1.033 9.507 467 HG22 ILE 54 HG22 ILE 54 9.587 -1.744 10.034 468 HG23 ILE 54 HG23 ILE 54 8.509 -2.653 8.975 469 HD11 ILE 54 HD11 ILE 54 12.219 -1.234 8.945 470 HD12 ILE 54 HD12 ILE 54 12.563 -2.837 8.294 471 HD13 ILE 54 HD13 ILE 54 11.310 -2.631 9.518 472 H GLN 55 HN GLN 55 8.289 1.561 7.117 473 HA GLN 55 HA GLN 55 6.045 1.712 8.779 474 HB2 GLN 55 HB2 GLN 55 7.582 3.561 8.514 475 HB3 GLN 55 HB1 GLN 55 7.194 3.692 6.807 476 HG2 GLN 55 HG2 GLN 55 4.913 4.367 7.386 477 HG3 GLN 55 HG1 GLN 55 5.326 4.259 9.097 478 HE21 GLN 55 HE21 GLN 55 4.456 6.546 7.475 479 HE22 GLN 55 HE22 GLN 55 5.686 7.748 7.664 480 H LEU 56 HN LEU 56 6.295 1.943 5.234 481 HA LEU 56 HA LEU 56 3.527 2.447 4.856 482 HB2 LEU 56 HB2 LEU 56 5.540 1.386 2.867 483 HB3 LEU 56 HB1 LEU 56 3.974 2.065 2.479 484 HG LEU 56 HG LEU 56 6.306 3.561 3.685 485 HD11 LEU 56 HD11 LEU 56 6.644 3.000 1.345 486 HD12 LEU 56 HD12 LEU 56 6.362 4.730 1.543 487 HD13 LEU 56 HD13 LEU 56 5.072 3.689 0.939 488 HD21 LEU 56 HD21 LEU 56 3.563 4.529 2.886 489 HD22 LEU 56 HD22 LEU 56 4.922 5.567 3.318 490 HD23 LEU 56 HD23 LEU 56 4.231 4.476 4.516 491 H LYS 57 HN LYS 57 5.523 -0.446 4.906 492 HA LYS 57 HA LYS 57 3.696 -2.297 3.899 493 HB2 LYS 57 HB2 LYS 57 6.037 -2.860 4.360 494 HB3 LYS 57 HB1 LYS 57 5.757 -2.673 6.086 495 HG2 LYS 57 HG2 LYS 57 4.074 -4.533 5.911 496 HG3 LYS 57 HG1 LYS 57 4.644 -4.791 4.264 497 HD2 LYS 57 HD2 LYS 57 6.406 -4.875 6.709 498 HD3 LYS 57 HD1 LYS 57 5.693 -6.295 5.948 499 HE2 LYS 57 HE2 LYS 57 7.512 -4.352 4.532 500 HE3 LYS 57 HE1 LYS 57 8.063 -5.840 5.297 501 HZ1 LYS 57 HZ1 LYS 57 6.097 -5.671 3.078 502 HZ2 LYS 57 HZ2 LYS 57 6.627 -7.095 3.816 503 HZ3 LYS 57 HZ3 LYS 57 7.712 -6.146 2.933 504 H GLN 58 HN GLN 58 4.029 -0.888 7.094 505 HA GLN 58 HA GLN 58 2.083 -2.569 8.354 506 HB2 GLN 58 HB2 GLN 58 3.331 0.065 9.146 507 HB3 GLN 58 HB1 GLN 58 2.197 -0.813 10.161 508 HG2 GLN 58 HG2 GLN 58 3.692 -2.623 10.434 509 HG3 GLN 58 HG1 GLN 58 4.755 -2.023 9.161 510 HE21 GLN 58 HE21 GLN 58 6.133 -0.334 9.584 511 HE22 GLN 58 HE22 GLN 58 6.486 0.202 11.191 512 H ALA 59 HN ALA 59 2.097 0.620 6.886 513 HA ALA 59 HA ALA 59 -0.547 1.356 7.532 514 HB1 ALA 59 HB1 ALA 59 1.168 2.953 6.811 515 HB2 ALA 59 HB2 ALA 59 -0.295 3.072 5.836 516 HB3 ALA 59 HB3 ALA 59 1.128 2.254 5.193 517 H ILE 60 HN ILE 60 0.840 -0.265 4.701 518 HA ILE 60 HA ILE 60 -1.564 -0.447 3.221 519 HB ILE 60 HB ILE 60 0.889 -2.219 3.141 520 HG12 ILE 60 HG12 ILE 60 0.065 0.079 1.349 521 HG13 ILE 60 HG11 ILE 60 1.277 0.186 2.622 522 HG21 ILE 60 HG21 ILE 60 -1.336 -1.950 1.128 523 HG22 ILE 60 HG22 ILE 60 -1.086 -3.327 2.201 524 HG23 ILE 60 HG23 ILE 60 0.109 -2.948 0.959 525 HD11 ILE 60 HD11 ILE 60 1.434 -1.543 0.160 526 HD12 ILE 60 HD12 ILE 60 2.647 -1.464 1.437 527 HD13 ILE 60 HD13 ILE 60 2.318 -0.044 0.445 528 H ASP 61 HN ASP 61 0.004 -2.593 5.542 529 HA ASP 61 HA ASP 61 -1.781 -4.755 5.424 530 HB2 ASP 61 HB2 ASP 61 0.368 -4.890 6.607 531 HB3 ASP 61 HB1 ASP 61 -0.186 -3.702 7.784 532 H GLU 62 HN GLU 62 -1.909 -1.711 7.158 533 HA GLU 62 HA GLU 62 -4.085 -2.261 8.841 534 HB2 GLU 62 HB2 GLU 62 -2.600 -0.337 9.154 535 HB3 GLU 62 HB1 GLU 62 -3.181 0.371 7.653 536 HG2 GLU 62 HG2 GLU 62 -4.227 1.474 9.502 537 HG3 GLU 62 HG1 GLU 62 -5.435 0.523 8.641 538 H ASN 63 HN ASN 63 -3.948 -0.803 5.604 539 HA ASN 63 HA ASN 63 -6.729 -0.432 5.297 540 HB2 ASN 63 HB2 ASN 63 -4.490 -0.748 3.302 541 HB3 ASN 63 HB1 ASN 63 -6.161 -0.537 2.794 542 HD21 ASN 63 HD21 ASN 63 -5.634 1.414 1.779 543 HD22 ASN 63 HD22 ASN 63 -5.328 2.854 2.688 544 H LYS 64 HN LYS 64 -4.588 -3.077 4.344 545 HA LYS 64 HA LYS 64 -6.426 -4.783 3.179 546 HB2 LYS 64 HB2 LYS 64 -3.957 -5.134 3.292 547 HB3 LYS 64 HB1 LYS 64 -4.139 -5.622 4.972 548 HG2 LYS 64 HG2 LYS 64 -5.616 -7.468 4.220 549 HG3 LYS 64 HG1 LYS 64 -5.265 -7.010 2.550 550 HD2 LYS 64 HD2 LYS 64 -3.232 -7.867 4.610 551 HD3 LYS 64 HD1 LYS 64 -3.854 -8.870 3.299 552 HE2 LYS 64 HE2 LYS 64 -2.923 -7.303 1.663 553 HE3 LYS 64 HE1 LYS 64 -2.306 -6.298 2.972 554 HZ1 LYS 64 HZ1 LYS 64 -1.463 -9.051 2.273 555 HZ2 LYS 64 HZ2 LYS 64 -1.002 -8.269 3.697 556 HZ3 LYS 64 HZ3 LYS 64 -0.537 -7.636 2.203 557 H ASN 65 HN ASN 65 -5.676 -4.369 6.611 558 HA ASN 65 HA ASN 65 -7.447 -6.398 7.530 559 HB2 ASN 65 HB2 ASN 65 -6.198 -4.030 8.925 560 HB3 ASN 65 HB1 ASN 65 -7.202 -5.214 9.751 561 HD21 ASN 65 HD21 ASN 65 -4.412 -4.543 10.158 562 HD22 ASN 65 HD22 ASN 65 -3.516 -6.001 9.917 563 H ALA 66 HN ALA 66 -7.757 -2.896 7.132 564 HA ALA 66 HA ALA 66 -10.325 -2.580 8.193 565 HB1 ALA 66 HB1 ALA 66 -10.447 -0.535 6.859 566 HB2 ALA 66 HB2 ALA 66 -9.058 -1.064 5.910 567 HB3 ALA 66 HB3 ALA 66 -8.866 -0.695 7.623 568 H LEU 67 HN LEU 67 -9.271 -3.285 4.899 569 HA LEU 67 HA LEU 67 -11.801 -3.432 3.693 570 HB2 LEU 67 HB2 LEU 67 -9.690 -3.234 2.464 571 HB3 LEU 67 HB1 LEU 67 -9.236 -4.847 2.974 572 HG LEU 67 HG LEU 67 -11.056 -5.804 1.665 573 HD11 LEU 67 HD11 LEU 67 -12.709 -4.072 1.810 574 HD12 LEU 67 HD12 LEU 67 -12.329 -4.348 0.110 575 HD13 LEU 67 HD13 LEU 67 -11.666 -2.944 0.945 576 HD21 LEU 67 HD21 LEU 67 -10.208 -5.245 -0.567 577 HD22 LEU 67 HD22 LEU 67 -8.903 -5.494 0.591 578 HD23 LEU 67 HD23 LEU 67 -9.357 -3.859 0.112 579 H GLN 68 HN GLN 68 -10.048 -5.675 5.655 580 HA GLN 68 HA GLN 68 -11.506 -8.003 4.777 581 HB2 GLN 68 HB2 GLN 68 -9.147 -8.039 5.710 582 HB3 GLN 68 HB1 GLN 68 -9.855 -7.742 7.292 583 HG2 GLN 68 HG2 GLN 68 -11.083 -9.818 7.173 584 HG3 GLN 68 HG1 GLN 68 -10.498 -10.102 5.536 585 HE21 GLN 68 HE21 GLN 68 -8.555 -8.804 8.146 586 HE22 GLN 68 HE22 GLN 68 -7.503 -10.169 8.290 587 H LYS 69 HN LYS 69 -11.870 -5.516 7.143 588 HA LYS 69 HA LYS 69 -14.005 -6.936 8.526 589 HB2 LYS 69 HB2 LYS 69 -12.371 -5.476 9.765 590 HB3 LYS 69 HB1 LYS 69 -13.047 -4.088 8.924 591 HG2 LYS 69 HG2 LYS 69 -15.228 -4.540 9.944 592 HG3 LYS 69 HG1 LYS 69 -14.534 -5.914 10.804 593 HD2 LYS 69 HD2 LYS 69 -12.959 -4.393 11.925 594 HD3 LYS 69 HD1 LYS 69 -13.713 -3.027 11.100 595 HE2 LYS 69 HE2 LYS 69 -15.088 -4.913 13.012 596 HE3 LYS 69 HE1 LYS 69 -14.546 -3.280 13.390 597 HZ1 LYS 69 HZ1 LYS 69 -16.587 -3.976 11.351 598 HZ2 LYS 69 HZ2 LYS 69 -16.089 -2.415 11.761 599 HZ3 LYS 69 HZ3 LYS 69 -16.915 -3.361 12.889 600 H LEU 70 HN LEU 70 -13.527 -4.466 6.116 601 HA LEU 70 HA LEU 70 -16.319 -3.732 5.980 602 HB2 LEU 70 HB2 LEU 70 -14.019 -3.139 4.109 603 HB3 LEU 70 HB1 LEU 70 -15.632 -2.471 3.954 604 HG LEU 70 HG LEU 70 -13.745 -1.978 6.259 605 HD11 LEU 70 HD11 LEU 70 -14.634 -0.182 4.006 606 HD12 LEU 70 HD12 LEU 70 -13.026 -0.876 4.209 607 HD13 LEU 70 HD13 LEU 70 -13.633 0.299 5.375 608 HD21 LEU 70 HD21 LEU 70 -16.055 -1.942 6.992 609 HD22 LEU 70 HD22 LEU 70 -16.482 -0.859 5.667 610 HD23 LEU 70 HD23 LEU 70 -15.405 -0.304 6.948 611 H SER 71 HN SER 71 -16.072 -6.438 5.819 612 HA SER 71 HA SER 71 -17.032 -6.975 3.121 613 HB2 SER 71 HB2 SER 71 -14.641 -7.600 3.093 614 HB3 SER 71 HB1 SER 71 -14.893 -8.620 4.510 615 HG SER 71 HG SER 71 -15.712 -10.125 3.288 616 H LYS 72 HN LYS 72 -18.988 -7.871 3.368 617 HA LYS 72 HA LYS 72 -19.383 -9.641 5.682 618 HB2 LYS 72 HB2 LYS 72 -21.850 -9.069 5.426 619 HB3 LYS 72 HB1 LYS 72 -20.815 -7.794 6.056 620 HG2 LYS 72 HG2 LYS 72 -20.802 -6.687 3.886 621 HG3 LYS 72 HG1 LYS 72 -21.759 -8.000 3.187 622 HD2 LYS 72 HD2 LYS 72 -23.615 -7.474 4.665 623 HD3 LYS 72 HD1 LYS 72 -22.657 -6.229 5.469 624 HE2 LYS 72 HE2 LYS 72 -23.440 -6.208 2.555 625 HE3 LYS 72 HE1 LYS 72 -24.258 -5.307 3.830 626 HZ1 LYS 72 HZ1 LYS 72 -22.724 -3.876 2.707 627 HZ2 LYS 72 HZ2 LYS 72 -21.450 -4.957 2.941 628 HZ3 LYS 72 HZ3 LYS 72 -22.133 -4.164 4.266 629 H ALA 73 HN ALA 73 -18.319 -11.076 3.980 630 HA ALA 73 HA ALA 73 -19.745 -11.871 1.670 631 HB1 ALA 73 HB1 ALA 73 -17.341 -12.213 1.923 632 HB2 ALA 73 HB2 ALA 73 -18.172 -13.727 1.568 633 HB3 ALA 73 HB3 ALA 73 -17.640 -13.378 3.212 634 H ASP 74 HN ASP 74 -19.926 -12.831 5.002 635 HA ASP 74 HA ASP 74 -21.297 -15.293 4.569 636 HB2 ASP 74 HB2 ASP 74 -21.227 -13.528 7.031 637 HB3 ASP 74 HB1 ASP 74 -21.837 -15.176 6.980 638 H GLU 75 HN GLU 75 -22.208 -12.043 4.362 639 HA GLU 75 HA GLU 75 -25.026 -12.506 4.864 640 HB2 GLU 75 HB2 GLU 75 -23.459 -10.094 3.948 641 HB3 GLU 75 HB1 GLU 75 -25.213 -10.104 4.064 642 HG2 GLU 75 HG2 GLU 75 -23.367 -10.687 6.365 643 HG3 GLU 75 HG1 GLU 75 -24.053 -9.100 6.016 644 H SER 76 HN SER 76 -26.619 -12.536 3.304 645 HA SER 76 HA SER 76 -25.783 -13.525 0.735 646 HB2 SER 76 HB2 SER 76 -28.594 -12.966 1.704 647 HB3 SER 76 HB1 SER 76 -28.113 -14.017 0.372 648 HG SER 76 HG SER 76 -26.874 -15.184 2.082 649 H ALA 77 HN ALA 77 -24.729 -11.259 0.470 650 HA ALA 77 HA ALA 77 -26.561 -9.242 -0.533 651 HB1 ALA 77 HB1 ALA 77 -24.638 -8.561 0.833 652 HB2 ALA 77 HB2 ALA 77 -24.570 -7.856 -0.781 653 HB3 ALA 77 HB3 ALA 77 -23.547 -9.233 -0.379 654 HA PRO 78 HA PRO 78 -26.081 -11.101 -4.587 655 HB2 PRO 78 HB2 PRO 78 -27.939 -9.612 -5.853 656 HB3 PRO 78 HB1 PRO 78 -28.378 -10.912 -4.740 657 HG2 PRO 78 HG2 PRO 78 -28.327 -7.960 -4.289 658 HG3 PRO 78 HG1 PRO 78 -29.511 -9.160 -3.741 659 HD2 PRO 78 HD2 PRO 78 -27.514 -8.141 -2.153 660 HD3 PRO 78 HD1 PRO 78 -28.266 -9.726 -1.900 661 H VAL 79 HN VAL 79 -23.981 -9.579 -4.047 662 HA VAL 79 HA VAL 79 -23.725 -7.896 -6.435 663 HB VAL 79 HB VAL 79 -22.124 -6.440 -5.050 664 HG11 VAL 79 HG11 VAL 79 -23.957 -5.014 -4.254 665 HG12 VAL 79 HG12 VAL 79 -25.084 -6.351 -4.481 666 HG13 VAL 79 HG13 VAL 79 -24.270 -5.640 -5.873 667 HG21 VAL 79 HG21 VAL 79 -23.717 -7.650 -2.792 668 HG22 VAL 79 HG22 VAL 79 -22.583 -6.306 -2.661 669 HG23 VAL 79 HG23 VAL 79 -22.000 -7.913 -3.092 670 H ALA 80 HN ALA 80 -22.868 -9.918 -7.242 671 HA ALA 80 HA ALA 80 -20.678 -11.263 -6.134 672 HB1 ALA 80 HB1 ALA 80 -21.564 -11.184 -9.007 673 HB2 ALA 80 HB2 ALA 80 -22.174 -12.274 -7.762 674 HB3 ALA 80 HB3 ALA 80 -20.493 -12.383 -8.284 675 H ASN 81 HN ASN 81 -20.823 -8.573 -8.396 676 HA ASN 81 HA ASN 81 -18.080 -8.716 -9.159 677 HB2 ASN 81 HB2 ASN 81 -19.896 -7.507 -10.456 678 HB3 ASN 81 HB1 ASN 81 -19.808 -6.239 -9.239 679 HD21 ASN 81 HD21 ASN 81 -17.129 -8.115 -10.541 680 HD22 ASN 81 HD22 ASN 81 -16.325 -6.777 -11.287 681 H TYR 82 HN TYR 82 -19.817 -7.156 -6.564 682 HA TYR 82 HA TYR 82 -17.754 -5.510 -5.582 683 HB2 TYR 82 HB2 TYR 82 -20.092 -5.359 -4.786 684 HB3 TYR 82 HB1 TYR 82 -19.954 -6.951 -4.056 685 HD1 TYR 82 HD1 TYR 82 -18.295 -7.234 -2.104 686 HD2 TYR 82 HD2 TYR 82 -19.503 -3.427 -3.587 687 HE1 TYR 82 HE1 TYR 82 -17.611 -6.198 0.009 688 HE2 TYR 82 HE2 TYR 82 -18.803 -2.388 -1.475 689 HH TYR 82 HH TYR 82 -16.887 -3.965 0.819 690 H ASN 83 HN ASN 83 -18.543 -8.911 -5.057 691 HA ASN 83 HA ASN 83 -16.546 -9.350 -3.074 692 HB2 ASN 83 HB2 ASN 83 -18.155 -11.231 -4.798 693 HB3 ASN 83 HB1 ASN 83 -16.972 -11.799 -3.627 694 HD21 ASN 83 HD21 ASN 83 -19.875 -12.185 -3.732 695 HD22 ASN 83 HD22 ASN 83 -20.480 -11.583 -2.226 696 H GLN 84 HN GLN 84 -16.660 -9.663 -6.568 697 HA GLN 84 HA GLN 84 -14.176 -11.013 -6.830 698 HB2 GLN 84 HB2 GLN 84 -15.967 -10.994 -8.567 699 HB3 GLN 84 HB1 GLN 84 -15.591 -9.307 -8.882 700 HG2 GLN 84 HG2 GLN 84 -14.529 -10.633 -10.548 701 HG3 GLN 84 HG1 GLN 84 -13.286 -9.984 -9.483 702 HE21 GLN 84 HE21 GLN 84 -13.220 -12.292 -11.250 703 HE22 GLN 84 HE22 GLN 84 -12.824 -13.651 -10.260 704 H ARG 85 HN ARG 85 -15.112 -7.587 -7.253 705 HA ARG 85 HA ARG 85 -12.492 -6.700 -7.855 706 HB2 ARG 85 HB2 ARG 85 -14.404 -5.289 -8.403 707 HB3 ARG 85 HB1 ARG 85 -14.816 -5.145 -6.697 708 HG2 ARG 85 HG2 ARG 85 -12.521 -4.130 -6.371 709 HG3 ARG 85 HG1 ARG 85 -12.424 -4.029 -8.125 710 HD2 ARG 85 HD2 ARG 85 -14.091 -2.425 -8.249 711 HD3 ARG 85 HD1 ARG 85 -14.765 -2.862 -6.675 712 HE ARG 85 HE ARG 85 -12.199 -1.976 -6.190 713 HH11 ARG 85 HH11 ARG 85 -15.068 -0.587 -7.626 714 HH12 ARG 85 HH12 ARG 85 -14.737 1.007 -7.028 715 HH21 ARG 85 HH21 ARG 85 -11.758 0.086 -5.405 716 HH22 ARG 85 HH22 ARG 85 -12.862 1.390 -5.756 717 H LYS 86 HN LYS 86 -14.150 -7.350 -4.884 718 HA LYS 86 HA LYS 86 -12.635 -5.905 -3.059 719 HB2 LYS 86 HB2 LYS 86 -14.653 -7.030 -2.407 720 HB3 LYS 86 HB1 LYS 86 -13.991 -8.597 -2.851 721 HG2 LYS 86 HG2 LYS 86 -12.281 -8.268 -1.015 722 HG3 LYS 86 HG1 LYS 86 -13.231 -6.866 -0.500 723 HD2 LYS 86 HD2 LYS 86 -14.092 -9.760 -0.591 724 HD3 LYS 86 HD1 LYS 86 -13.936 -8.720 0.824 725 HE2 LYS 86 HE2 LYS 86 -15.825 -7.399 0.150 726 HE3 LYS 86 HE1 LYS 86 -15.910 -8.217 -1.409 727 HZ1 LYS 86 HZ1 LYS 86 -16.442 -10.276 -0.229 728 HZ2 LYS 86 HZ2 LYS 86 -17.579 -9.067 0.088 729 HZ3 LYS 86 HZ3 LYS 86 -16.405 -9.447 1.249 730 H GLU 87 HN GLU 87 -12.058 -9.053 -4.526 731 HA GLU 87 HA GLU 87 -9.669 -9.604 -3.073 732 HB2 GLU 87 HB2 GLU 87 -10.813 -10.794 -5.598 733 HB3 GLU 87 HB1 GLU 87 -9.358 -11.389 -4.808 734 HG2 GLU 87 HG2 GLU 87 -12.145 -11.339 -3.674 735 HG3 GLU 87 HG1 GLU 87 -11.209 -12.756 -4.152 736 H GLU 88 HN GLU 88 -10.417 -8.046 -6.119 737 HA GLU 88 HA GLU 88 -7.770 -7.870 -7.093 738 HB2 GLU 88 HB2 GLU 88 -10.192 -6.147 -7.617 739 HB3 GLU 88 HB1 GLU 88 -8.666 -5.966 -8.470 740 HG2 GLU 88 HG2 GLU 88 -10.437 -8.399 -8.472 741 HG3 GLU 88 HG1 GLU 88 -10.223 -7.250 -9.792 742 H GLU 89 HN GLU 89 -9.697 -5.772 -4.991 743 HA GLU 89 HA GLU 89 -7.775 -3.713 -4.745 744 HB2 GLU 89 HB2 GLU 89 -9.810 -4.565 -2.675 745 HB3 GLU 89 HB1 GLU 89 -8.996 -3.012 -2.761 746 HG2 GLU 89 HG2 GLU 89 -10.903 -4.085 -4.828 747 HG3 GLU 89 HG1 GLU 89 -11.310 -2.922 -3.570 748 H HIS 90 HN HIS 90 -8.300 -6.735 -2.987 749 HA HIS 90 HA HIS 90 -6.253 -6.513 -1.081 750 HB2 HIS 90 HB2 HIS 90 -7.528 -8.844 -2.475 751 HB3 HIS 90 HB1 HIS 90 -6.051 -9.115 -1.569 752 HD1 HIS 90 HD1 HIS 90 -6.257 -9.418 0.888 753 HD2 HIS 90 HD2 HIS 90 -9.740 -7.947 -0.828 754 HE1 HIS 90 HE1 HIS 90 -8.004 -9.548 2.689 755 HE2 HIS 90 HE2 HIS 90 -10.149 -8.926 1.525 756 H THR 91 HN THR 91 -6.203 -7.603 -4.432 757 HA THR 91 HA THR 91 -3.531 -8.433 -4.537 758 HB THR 91 HB THR 91 -5.205 -7.374 -6.822 759 HG1 THR 91 HG1 THR 91 -6.286 -9.073 -5.741 760 HG21 THR 91 HG21 THR 91 -2.890 -9.316 -6.795 761 HG22 THR 91 HG22 THR 91 -2.816 -7.644 -7.352 762 HG23 THR 91 HG23 THR 91 -3.814 -8.817 -8.212 763 H LEU 92 HN LEU 92 -5.033 -5.308 -5.372 764 HA LEU 92 HA LEU 92 -2.782 -3.963 -6.240 765 HB2 LEU 92 HB2 LEU 92 -4.997 -3.011 -6.425 766 HB3 LEU 92 HB1 LEU 92 -5.138 -2.902 -4.681 767 HG LEU 92 HG LEU 92 -3.276 -1.252 -4.673 768 HD11 LEU 92 HD11 LEU 92 -2.601 -0.217 -6.777 769 HD12 LEU 92 HD12 LEU 92 -3.576 -1.384 -7.668 770 HD13 LEU 92 HD13 LEU 92 -2.179 -1.929 -6.741 771 HD21 LEU 92 HD21 LEU 92 -5.634 -0.544 -6.410 772 HD22 LEU 92 HD22 LEU 92 -4.593 0.600 -5.563 773 HD23 LEU 92 HD23 LEU 92 -5.600 -0.522 -4.647 774 H LEU 93 HN LEU 93 -4.003 -4.151 -2.887 775 HA LEU 93 HA LEU 93 -1.934 -2.574 -1.784 776 HB2 LEU 93 HB2 LEU 93 -3.639 -4.693 -0.462 777 HB3 LEU 93 HB1 LEU 93 -2.630 -3.539 0.387 778 HG LEU 93 HG LEU 93 -4.993 -2.825 -1.352 779 HD11 LEU 93 HD11 LEU 93 -6.096 -2.247 0.748 780 HD12 LEU 93 HD12 LEU 93 -4.702 -2.841 1.647 781 HD13 LEU 93 HD13 LEU 93 -5.676 -3.958 0.693 782 HD21 LEU 93 HD21 LEU 93 -3.298 -1.081 -1.341 783 HD22 LEU 93 HD22 LEU 93 -3.244 -1.123 0.422 784 HD23 LEU 93 HD23 LEU 93 -4.706 -0.581 -0.404 785 H ASP 94 HN ASP 94 -2.292 -6.015 -2.313 786 HA ASP 94 HA ASP 94 0.108 -6.825 -1.041 787 HB2 ASP 94 HB2 ASP 94 -1.731 -8.394 -1.526 788 HB3 ASP 94 HB1 ASP 94 -1.454 -8.182 -3.252 789 H LYS 95 HN LYS 95 -0.545 -5.318 -4.049 790 HA LYS 95 HA LYS 95 1.756 -6.387 -5.451 791 HB2 LYS 95 HB2 LYS 95 -0.267 -5.840 -6.735 792 HB3 LYS 95 HB1 LYS 95 -0.186 -4.175 -6.175 793 HG2 LYS 95 HG2 LYS 95 1.881 -3.830 -7.399 794 HG3 LYS 95 HG1 LYS 95 1.885 -5.522 -7.908 795 HD2 LYS 95 HD2 LYS 95 -0.205 -5.176 -9.115 796 HD3 LYS 95 HD1 LYS 95 -0.249 -3.496 -8.582 797 HE2 LYS 95 HE2 LYS 95 0.575 -3.771 -10.900 798 HE3 LYS 95 HE1 LYS 95 1.742 -2.995 -9.833 799 HZ1 LYS 95 HZ1 LYS 95 2.746 -4.682 -11.276 800 HZ2 LYS 95 HZ2 LYS 95 1.775 -5.874 -10.571 801 HZ3 LYS 95 HZ3 LYS 95 2.931 -5.062 -9.642 802 H LEU 96 HN LEU 96 0.682 -3.427 -3.881 803 HA LEU 96 HA LEU 96 2.985 -1.874 -4.411 804 HB2 LEU 96 HB2 LEU 96 1.028 -1.671 -2.117 805 HB3 LEU 96 HB1 LEU 96 2.172 -0.435 -2.599 806 HG LEU 96 HG LEU 96 -0.114 -1.419 -4.309 807 HD11 LEU 96 HD11 LEU 96 -1.109 0.784 -3.823 808 HD12 LEU 96 HD12 LEU 96 0.177 1.080 -2.652 809 HD13 LEU 96 HD13 LEU 96 -0.969 -0.235 -2.391 810 HD21 LEU 96 HD21 LEU 96 0.411 0.528 -5.695 811 HD22 LEU 96 HD22 LEU 96 1.767 -0.597 -5.618 812 HD23 LEU 96 HD23 LEU 96 1.797 0.887 -4.664 813 H THR 97 HN THR 97 2.104 -4.175 -1.906 814 HA THR 97 HA THR 97 4.241 -3.594 -0.137 815 HB THR 97 HB THR 97 2.678 -6.168 -0.480 816 HG1 THR 97 HG1 THR 97 1.281 -4.453 0.028 817 HG21 THR 97 HG21 THR 97 4.742 -6.476 0.790 818 HG22 THR 97 HG22 THR 97 3.332 -6.611 1.844 819 HG23 THR 97 HG23 THR 97 4.300 -5.136 1.849 820 H GLN 98 HN GLN 98 3.765 -5.801 -2.840 821 HA GLN 98 HA GLN 98 6.126 -7.285 -2.614 822 HB2 GLN 98 HB2 GLN 98 4.235 -7.928 -4.037 823 HB3 GLN 98 HB1 GLN 98 4.546 -6.554 -5.085 824 HG2 GLN 98 HG2 GLN 98 6.751 -7.510 -5.627 825 HG3 GLN 98 HG1 GLN 98 6.351 -8.918 -4.644 826 HE21 GLN 98 HE21 GLN 98 6.504 -10.306 -6.398 827 HE22 GLN 98 HE22 GLN 98 5.310 -10.352 -7.646 828 H GLN 99 HN GLN 99 5.420 -4.282 -4.372 829 HA GLN 99 HA GLN 99 7.899 -4.034 -5.661 830 HB2 GLN 99 HB2 GLN 99 6.003 -1.857 -4.766 831 HB3 GLN 99 HB1 GLN 99 7.338 -1.633 -5.887 832 HG2 GLN 99 HG2 GLN 99 4.860 -3.281 -6.295 833 HG3 GLN 99 HG1 GLN 99 5.338 -1.817 -7.154 834 HE21 GLN 99 HE21 GLN 99 7.006 -1.933 -8.685 835 HE22 GLN 99 HE22 GLN 99 7.484 -3.440 -9.384 836 H LEU 100 HN LEU 100 6.794 -2.896 -2.511 837 HA LEU 100 HA LEU 100 9.216 -1.548 -1.852 838 HB2 LEU 100 HB2 LEU 100 7.005 -2.621 -0.099 839 HB3 LEU 100 HB1 LEU 100 8.311 -1.601 0.468 840 HG LEU 100 HG LEU 100 6.207 -0.802 -1.545 841 HD11 LEU 100 HD11 LEU 100 5.316 -1.006 0.707 842 HD12 LEU 100 HD12 LEU 100 5.424 0.689 0.230 843 HD13 LEU 100 HD13 LEU 100 6.620 0.004 1.329 844 HD21 LEU 100 HD21 LEU 100 8.486 0.745 -0.324 845 HD22 LEU 100 HD22 LEU 100 7.175 1.456 -1.263 846 HD23 LEU 100 HD23 LEU 100 8.287 0.317 -2.022 847 H GLN 101 HN GLN 101 7.995 -4.784 -1.422 848 HA GLN 101 HA GLN 101 9.877 -5.714 0.456 849 HB2 GLN 101 HB2 GLN 101 7.728 -6.817 0.019 850 HB3 GLN 101 HB1 GLN 101 8.255 -7.229 -1.601 851 HG2 GLN 101 HG2 GLN 101 9.766 -8.201 0.792 852 HG3 GLN 101 HG1 GLN 101 8.308 -9.023 0.248 853 HE21 GLN 101 HE21 GLN 101 11.033 -10.009 0.347 854 HE22 GLN 101 HE22 GLN 101 11.451 -10.461 -1.269 855 H GLY 102 HN GLY 102 10.008 -5.295 -2.996 856 HA2 GLY 102 HA2 GLY 102 12.210 -7.125 -3.411 857 HA3 GLY 102 HA1 GLY 102 11.566 -5.978 -4.583 858 H LEU 103 HN LEU 103 11.693 -3.685 -3.028 859 HA LEU 103 HA LEU 103 14.394 -2.907 -3.405 860 HB2 LEU 103 HB2 LEU 103 12.493 -1.380 -3.711 861 HB3 LEU 103 HB1 LEU 103 12.109 -1.506 -2.006 862 HG LEU 103 HG LEU 103 14.275 -0.439 -1.460 863 HD11 LEU 103 HD11 LEU 103 15.553 0.635 -3.249 864 HD12 LEU 103 HD12 LEU 103 14.499 -0.112 -4.449 865 HD13 LEU 103 HD13 LEU 103 15.529 -1.118 -3.430 866 HD21 LEU 103 HD21 LEU 103 13.643 1.799 -2.151 867 HD22 LEU 103 HD22 LEU 103 12.217 0.883 -1.665 868 HD23 LEU 103 HD23 LEU 103 12.561 1.139 -3.377 869 H ALA 104 HN ALA 104 12.397 -3.579 -0.565 870 HA ALA 104 HA ALA 104 14.086 -2.654 1.424 871 HB1 ALA 104 HB1 ALA 104 12.887 -4.181 2.931 872 HB2 ALA 104 HB2 ALA 104 12.169 -4.976 1.528 873 HB3 ALA 104 HB3 ALA 104 11.799 -3.285 1.872 874 H VAL 105 HN VAL 105 13.944 -5.907 -0.010 875 HA VAL 105 HA VAL 105 15.977 -7.013 1.604 876 HB VAL 105 HB VAL 105 15.022 -7.840 -1.138 877 HG11 VAL 105 HG11 VAL 105 16.065 -10.004 -0.665 878 HG12 VAL 105 HG12 VAL 105 16.754 -9.342 0.818 879 HG13 VAL 105 HG13 VAL 105 17.257 -8.707 -0.750 880 HG21 VAL 105 HG21 VAL 105 14.356 -8.836 1.624 881 HG22 VAL 105 HG22 VAL 105 13.826 -9.591 0.122 882 HG23 VAL 105 HG23 VAL 105 13.284 -7.963 0.531 883 H THR 106 HN THR 106 16.029 -5.373 -1.510 884 HA THR 106 HA THR 106 18.741 -5.827 -2.099 885 HB THR 106 HB THR 106 16.950 -3.563 -3.000 886 HG1 THR 106 HG1 THR 106 16.000 -5.284 -3.872 887 HG21 THR 106 HG21 THR 106 18.466 -3.365 -4.905 888 HG22 THR 106 HG22 THR 106 19.501 -4.620 -4.225 889 HG23 THR 106 HG23 THR 106 19.324 -3.076 -3.391 890 H ILE 107 HN ILE 107 17.110 -3.331 -0.212 891 HA ILE 107 HA ILE 107 19.481 -1.733 0.101 892 HB ILE 107 HB ILE 107 16.898 -1.611 1.660 893 HG12 ILE 107 HG12 ILE 107 17.803 0.054 -0.702 894 HG13 ILE 107 HG11 ILE 107 16.604 -1.234 -0.781 895 HG21 ILE 107 HG21 ILE 107 17.630 0.700 2.180 896 HG22 ILE 107 HG22 ILE 107 19.182 0.340 1.426 897 HG23 ILE 107 HG23 ILE 107 18.679 -0.541 2.867 898 HD11 ILE 107 HD11 ILE 107 16.358 1.278 0.855 899 HD12 ILE 107 HD12 ILE 107 15.146 0.005 0.705 900 HD13 ILE 107 HD13 ILE 107 15.581 0.981 -0.700 901 H SER 108 HN SER 108 18.104 -4.452 1.767 902 HA SER 108 HA SER 108 19.461 -3.781 4.257 903 HB2 SER 108 HB2 SER 108 18.387 -5.981 5.028 904 HB3 SER 108 HB1 SER 108 17.300 -4.641 4.674 905 HG SER 108 HG SER 108 16.645 -5.613 2.856 906 H ARG 109 HN ARG 109 19.832 -5.662 1.432 907 HA ARG 109 HA ARG 109 22.234 -6.913 2.560 908 HB2 ARG 109 HB2 ARG 109 20.664 -8.526 1.586 909 HB3 ARG 109 HB1 ARG 109 20.673 -7.638 0.068 910 HG2 ARG 109 HG2 ARG 109 23.008 -8.165 -0.267 911 HG3 ARG 109 HG1 ARG 109 23.070 -8.984 1.293 912 HD2 ARG 109 HD2 ARG 109 21.307 -9.793 -1.015 913 HD3 ARG 109 HD1 ARG 109 22.855 -10.538 -0.621 914 HE ARG 109 HE ARG 109 20.905 -10.519 1.522 915 HH11 ARG 109 HH11 ARG 109 22.255 -12.285 -1.181 916 HH12 ARG 109 HH12 ARG 109 21.724 -13.830 -0.602 917 HH21 ARG 109 HH21 ARG 109 20.191 -12.546 2.283 918 HH22 ARG 109 HH22 ARG 109 20.543 -13.979 1.371 919 H GLU 110 HN GLU 110 23.642 -5.233 2.382 920 HA GLU 110 HA GLU 110 23.780 -3.589 0.030 921 HB2 GLU 110 HB2 GLU 110 25.449 -3.740 2.539 922 HB3 GLU 110 HB1 GLU 110 25.764 -2.590 1.245 923 HG2 GLU 110 HG2 GLU 110 23.688 -1.503 1.588 924 HG3 GLU 110 HG1 GLU 110 23.120 -2.782 2.658 925 H ASN 111 HN ASN 111 24.110 -5.952 -0.994 926 HA ASN 111 HA ASN 111 26.983 -6.123 -1.619 927 HB2 ASN 111 HB2 ASN 111 25.017 -8.424 -1.428 928 HB3 ASN 111 HB1 ASN 111 26.692 -8.562 -1.952 929 HD21 ASN 111 HD21 ASN 111 28.340 -8.385 -0.427 930 HD22 ASN 111 HD22 ASN 111 28.034 -8.524 1.268 931 H ILE 112 HN ILE 112 25.331 -4.462 -2.981 932 HA ILE 112 HA ILE 112 23.838 -5.610 -5.078 933 HB ILE 112 HB ILE 112 25.068 -2.854 -4.980 934 HG12 ILE 112 HG12 ILE 112 22.285 -3.714 -4.168 935 HG13 ILE 112 HG11 ILE 112 23.586 -3.420 -3.029 936 HG21 ILE 112 HG21 ILE 112 23.291 -2.260 -6.550 937 HG22 ILE 112 HG22 ILE 112 22.766 -3.943 -6.583 938 HG23 ILE 112 HG23 ILE 112 24.355 -3.502 -7.209 939 HD11 ILE 112 HD11 ILE 112 22.387 -1.397 -4.904 940 HD12 ILE 112 HD12 ILE 112 23.700 -1.095 -3.766 941 HD13 ILE 112 HD13 ILE 112 22.095 -1.516 -3.168 942 H THR 113 HN THR 113 24.623 -6.793 -6.635 943 HA THR 113 HA THR 113 25.944 -7.719 -8.211 944 HB THR 113 HB THR 113 27.198 -6.220 -9.735 945 HG1 THR 113 HG1 THR 113 26.870 -4.457 -7.665 946 HG21 THR 113 HG21 THR 113 25.244 -5.010 -10.590 947 HG22 THR 113 HG22 THR 113 24.392 -5.340 -9.083 948 HG23 THR 113 HG23 THR 113 24.853 -6.671 -10.145 949 H GLU 114 HN GLU 114 27.057 -7.276 -5.444 950 HA GLU 114 HA GLU 114 29.909 -7.430 -6.081 951 HB2 GLU 114 HB2 GLU 114 28.518 -7.145 -3.413 952 HB3 GLU 114 HB1 GLU 114 30.255 -7.248 -3.634 953 HG2 GLU 114 HG2 GLU 114 30.120 -5.195 -5.047 954 HG3 GLU 114 HG1 GLU 114 28.425 -5.064 -4.582 955 H VAL 115 HN VAL 115 30.968 -9.291 -6.006 956 HA VAL 115 HA VAL 115 29.364 -11.651 -5.353 957 HB VAL 115 HB VAL 115 31.053 -12.869 -6.810 958 HG11 VAL 115 HG11 VAL 115 28.770 -12.340 -7.508 959 HG12 VAL 115 HG12 VAL 115 29.896 -12.220 -8.859 960 HG13 VAL 115 HG13 VAL 115 29.306 -10.757 -8.071 961 HG21 VAL 115 HG21 VAL 115 32.768 -11.091 -6.799 962 HG22 VAL 115 HG22 VAL 115 31.674 -10.058 -7.717 963 HG23 VAL 115 HG23 VAL 115 32.283 -11.550 -8.429 964 H GLY 116 HN GLY 116 30.472 -10.456 -3.197 965 HA2 GLY 116 HA2 GLY 116 32.908 -11.879 -2.483 966 HA3 GLY 116 HA1 GLY 116 31.999 -10.777 -1.454 967 H ALA 117 HN ALA 117 31.900 -13.981 -2.917 968 HA ALA 117 HA ALA 117 30.857 -15.928 -2.361 969 HB1 ALA 117 HB1 ALA 117 32.535 -15.820 -0.597 970 HB2 ALA 117 HB2 ALA 117 31.063 -16.614 -0.037 971 HB3 ALA 117 HB3 ALA 117 31.401 -14.949 0.434 972 HA PRO 118 HA PRO 118 26.736 -14.234 -1.133 973 HB2 PRO 118 HB2 PRO 118 25.631 -13.618 -3.496 974 HB3 PRO 118 HB1 PRO 118 26.699 -12.491 -2.655 975 HG2 PRO 118 HG2 PRO 118 27.212 -14.136 -5.059 976 HG3 PRO 118 HG1 PRO 118 27.939 -12.599 -4.570 977 HD2 PRO 118 HD2 PRO 118 29.018 -15.226 -4.250 978 HD3 PRO 118 HD1 PRO 118 29.714 -13.697 -3.688 979 H THR 119 HN THR 119 25.878 -16.173 -0.542 980 HA THR 119 HA THR 119 25.040 -17.989 -2.704 981 HB THR 119 HB THR 119 25.808 -18.838 0.100 982 HG1 THR 119 HG1 THR 119 27.290 -19.225 -2.308 983 HG21 THR 119 HG21 THR 119 25.279 -20.437 -2.411 984 HG22 THR 119 HG22 THR 119 24.205 -20.322 -1.018 985 HG23 THR 119 HG23 THR 119 25.781 -21.097 -0.855 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 -41.474 14.611 17.416 2 H2 GLY 1 HT2 GLY 1 -42.943 13.844 17.750 3 H3 GLY 1 HT3 GLY 1 -42.712 14.626 16.269 4 HA2 GLY 1 HA1 GLY 1 -41.220 12.237 17.189 5 HA3 GLY 1 HA2 GLY 1 -42.543 12.224 16.031 6 HA PRO 2 HA PRO 2 -38.368 13.250 13.973 7 HB2 PRO 2 HB2 PRO 2 -37.416 10.810 13.330 8 HB3 PRO 2 HB1 PRO 2 -37.034 11.590 14.867 9 HG2 PRO 2 HG2 PRO 2 -39.049 9.463 14.269 10 HG3 PRO 2 HG1 PRO 2 -37.945 9.605 15.649 11 HD2 PRO 2 HD2 PRO 2 -40.583 10.303 15.750 12 HD3 PRO 2 HD1 PRO 2 -39.335 11.046 16.767 13 H MET 3 HN MET 3 -38.096 13.208 11.713 14 HA MET 3 HA MET 3 -40.442 12.229 10.265 15 HB2 MET 3 HB2 MET 3 -39.890 14.595 9.994 16 HB3 MET 3 HB1 MET 3 -38.275 14.171 9.442 17 HG2 MET 3 HG2 MET 3 -39.214 13.085 7.480 18 HG3 MET 3 HG1 MET 3 -40.842 13.467 8.037 19 HE1 MET 3 HE1 MET 3 -40.451 16.434 9.201 20 HE2 MET 3 HE2 MET 3 -41.812 15.907 8.212 21 HE3 MET 3 HE3 MET 3 -40.919 17.365 7.778 22 H ALA 4 HN ALA 4 -40.297 10.349 9.265 23 HA ALA 4 HA ALA 4 -37.734 9.157 8.681 24 HB1 ALA 4 HB1 ALA 4 -40.522 8.150 8.124 25 HB2 ALA 4 HB2 ALA 4 -39.558 7.787 9.556 26 HB3 ALA 4 HB3 ALA 4 -39.032 7.217 7.973 27 H MET 5 HN MET 5 -36.721 10.121 7.008 28 HA MET 5 HA MET 5 -38.101 10.025 4.417 29 HB2 MET 5 HB2 MET 5 -38.089 12.368 5.219 30 HB3 MET 5 HB1 MET 5 -36.335 12.305 5.330 31 HG2 MET 5 HG2 MET 5 -36.209 11.899 2.915 32 HG3 MET 5 HG1 MET 5 -37.965 12.011 2.818 33 HE1 MET 5 HE1 MET 5 -38.603 14.400 4.851 34 HE2 MET 5 HE2 MET 5 -39.338 14.222 3.258 35 HE3 MET 5 HE3 MET 5 -38.612 15.759 3.727 36 H LEU 6 HN LEU 6 -36.960 8.044 4.176 37 HA LEU 6 HA LEU 6 -34.069 8.086 4.067 38 HB2 LEU 6 HB2 LEU 6 -35.962 5.913 3.153 39 HB3 LEU 6 HB1 LEU 6 -34.248 5.744 3.479 40 HG LEU 6 HG LEU 6 -36.385 6.324 5.533 41 HD11 LEU 6 HD11 LEU 6 -36.477 4.042 4.707 42 HD12 LEU 6 HD12 LEU 6 -35.863 4.081 6.359 43 HD13 LEU 6 HD13 LEU 6 -34.752 3.847 5.011 44 HD21 LEU 6 HD21 LEU 6 -34.602 6.025 7.176 45 HD22 LEU 6 HD22 LEU 6 -34.268 7.388 6.110 46 HD23 LEU 6 HD23 LEU 6 -33.425 5.858 5.876 47 H ALA 7 HN ALA 7 -33.768 9.698 2.468 48 HA ALA 7 HA ALA 7 -34.985 9.389 -0.125 49 HB1 ALA 7 HB1 ALA 7 -32.959 11.402 0.825 50 HB2 ALA 7 HB2 ALA 7 -34.711 11.604 0.858 51 HB3 ALA 7 HB3 ALA 7 -33.867 11.471 -0.685 52 H ARG 8 HN ARG 8 -33.629 7.150 0.180 53 HA ARG 8 HA ARG 8 -32.160 5.752 -0.838 54 HB2 ARG 8 HB2 ARG 8 -32.050 7.986 -2.868 55 HB3 ARG 8 HB1 ARG 8 -31.483 6.342 -3.134 56 HG2 ARG 8 HG2 ARG 8 -33.718 5.483 -2.899 57 HG3 ARG 8 HG1 ARG 8 -34.324 7.085 -2.473 58 HD2 ARG 8 HD2 ARG 8 -33.647 7.904 -4.688 59 HD3 ARG 8 HD1 ARG 8 -33.101 6.282 -5.109 60 HE ARG 8 HE ARG 8 -35.553 5.680 -4.597 61 HH11 ARG 8 HH11 ARG 8 -34.469 8.672 -6.057 62 HH12 ARG 8 HH12 ARG 8 -35.935 8.915 -6.951 63 HH21 ARG 8 HH21 ARG 8 -37.489 6.001 -5.770 64 HH22 ARG 8 HH22 ARG 8 -37.650 7.399 -6.787 65 H ARG 9 HN ARG 9 -30.747 6.290 1.055 66 HA ARG 9 HA ARG 9 -28.319 7.707 0.238 67 HB2 ARG 9 HB2 ARG 9 -29.276 6.783 2.946 68 HB3 ARG 9 HB1 ARG 9 -27.673 7.444 2.662 69 HG2 ARG 9 HG2 ARG 9 -28.653 9.549 1.933 70 HG3 ARG 9 HG1 ARG 9 -30.271 8.886 2.170 71 HD2 ARG 9 HD2 ARG 9 -28.174 9.297 4.297 72 HD3 ARG 9 HD1 ARG 9 -29.631 10.264 4.068 73 HE ARG 9 HE ARG 9 -30.379 7.583 4.372 74 HH11 ARG 9 HH11 ARG 9 -29.017 10.189 6.277 75 HH12 ARG 9 HH12 ARG 9 -29.635 9.575 7.777 76 HH21 ARG 9 HH21 ARG 9 -31.180 6.777 6.330 77 HH22 ARG 9 HH22 ARG 9 -30.867 7.629 7.811 78 H GLN 10 HN GLN 10 -26.390 6.698 0.041 79 HA GLN 10 HA GLN 10 -26.292 3.816 0.587 80 HB2 GLN 10 HB2 GLN 10 -26.804 4.142 -1.813 81 HB3 GLN 10 HB1 GLN 10 -25.358 5.129 -1.975 82 HG2 GLN 10 HG2 GLN 10 -24.905 2.931 -2.810 83 HG3 GLN 10 HG1 GLN 10 -23.990 3.182 -1.325 84 HE21 GLN 10 HE21 GLN 10 -27.421 2.493 -1.467 85 HE22 GLN 10 HE22 GLN 10 -27.329 0.925 -0.746 86 H ARG 11 HN ARG 11 -24.488 3.227 1.613 87 HA ARG 11 HA ARG 11 -22.244 5.115 1.653 88 HB2 ARG 11 HB2 ARG 11 -23.112 4.594 3.861 89 HB3 ARG 11 HB1 ARG 11 -22.962 2.870 3.547 90 HG2 ARG 11 HG2 ARG 11 -20.526 3.133 3.382 91 HG3 ARG 11 HG1 ARG 11 -20.703 4.845 3.770 92 HD2 ARG 11 HD2 ARG 11 -21.601 4.321 5.930 93 HD3 ARG 11 HD1 ARG 11 -21.653 2.603 5.537 94 HE ARG 11 HE ARG 11 -19.028 3.808 5.405 95 HH11 ARG 11 HH11 ARG 11 -21.385 2.165 7.396 96 HH12 ARG 11 HH12 ARG 11 -20.206 1.516 8.490 97 HH21 ARG 11 HH21 ARG 11 -17.459 2.965 6.859 98 HH22 ARG 11 HH22 ARG 11 -17.972 1.983 8.195 99 H ASP 12 HN ASP 12 -20.317 4.556 0.827 100 HA ASP 12 HA ASP 12 -19.945 1.750 0.017 101 HB2 ASP 12 HB2 ASP 12 -19.330 4.261 -1.550 102 HB3 ASP 12 HB1 ASP 12 -18.581 2.714 -1.930 103 HA PRO 13 HA PRO 13 -16.499 2.788 2.865 104 HB2 PRO 13 HB2 PRO 13 -16.394 -0.175 2.914 105 HB3 PRO 13 HB1 PRO 13 -16.428 0.968 4.260 106 HG2 PRO 13 HG2 PRO 13 -18.571 -0.507 3.653 107 HG3 PRO 13 HG1 PRO 13 -18.740 1.172 4.198 108 HD2 PRO 13 HD2 PRO 13 -18.926 0.045 1.428 109 HD3 PRO 13 HD1 PRO 13 -19.908 1.309 2.201 110 H LEU 14 HN LEU 14 -16.736 0.543 0.176 111 HA LEU 14 HA LEU 14 -13.984 0.124 -0.281 112 HB2 LEU 14 HB2 LEU 14 -16.297 0.144 -2.223 113 HB3 LEU 14 HB1 LEU 14 -14.685 -0.422 -2.611 114 HG LEU 14 HG LEU 14 -16.459 -1.653 -0.497 115 HD11 LEU 14 HD11 LEU 14 -16.790 -3.469 -2.083 116 HD12 LEU 14 HD12 LEU 14 -15.857 -2.595 -3.295 117 HD13 LEU 14 HD13 LEU 14 -17.400 -1.948 -2.733 118 HD21 LEU 14 HD21 LEU 14 -14.151 -2.064 -0.006 119 HD22 LEU 14 HD22 LEU 14 -13.819 -2.485 -1.686 120 HD23 LEU 14 HD23 LEU 14 -14.835 -3.536 -0.699 121 H GLN 15 HN GLN 15 -16.205 2.659 -1.299 122 HA GLN 15 HA GLN 15 -14.447 3.920 -3.128 123 HB2 GLN 15 HB2 GLN 15 -16.824 4.342 -3.250 124 HB3 GLN 15 HB1 GLN 15 -16.845 4.962 -1.606 125 HG2 GLN 15 HG2 GLN 15 -15.446 6.853 -2.324 126 HG3 GLN 15 HG1 GLN 15 -15.495 6.241 -3.976 127 HE21 GLN 15 HE21 GLN 15 -18.263 5.361 -3.741 128 HE22 GLN 15 HE22 GLN 15 -19.228 6.793 -3.799 129 H ALA 16 HN ALA 16 -15.154 4.458 0.303 130 HA ALA 16 HA ALA 16 -13.392 6.649 0.638 131 HB1 ALA 16 HB1 ALA 16 -15.181 6.139 2.224 132 HB2 ALA 16 HB2 ALA 16 -13.613 6.213 3.026 133 HB3 ALA 16 HB3 ALA 16 -14.354 4.649 2.679 134 H LEU 17 HN LEU 17 -13.035 3.171 1.149 135 HA LEU 17 HA LEU 17 -10.409 3.224 2.127 136 HB2 LEU 17 HB2 LEU 17 -11.883 1.279 2.321 137 HB3 LEU 17 HB1 LEU 17 -11.803 1.043 0.584 138 HG LEU 17 HG LEU 17 -9.349 0.670 0.801 139 HD11 LEU 17 HD11 LEU 17 -8.957 1.854 2.881 140 HD12 LEU 17 HD12 LEU 17 -8.436 0.174 3.018 141 HD13 LEU 17 HD13 LEU 17 -9.956 0.689 3.752 142 HD21 LEU 17 HD21 LEU 17 -9.540 -1.581 1.674 143 HD22 LEU 17 HD22 LEU 17 -10.934 -1.188 0.669 144 HD23 LEU 17 HD23 LEU 17 -11.082 -1.177 2.426 145 H ARG 18 HN ARG 18 -11.630 2.982 -1.203 146 HA ARG 18 HA ARG 18 -9.185 2.489 -2.463 147 HB2 ARG 18 HB2 ARG 18 -11.182 2.248 -3.745 148 HB3 ARG 18 HB1 ARG 18 -11.663 3.911 -3.439 149 HG2 ARG 18 HG2 ARG 18 -10.126 4.769 -4.947 150 HG3 ARG 18 HG1 ARG 18 -9.132 3.314 -4.912 151 HD2 ARG 18 HD2 ARG 18 -11.924 3.375 -6.032 152 HD3 ARG 18 HD1 ARG 18 -10.488 3.678 -7.006 153 HE ARG 18 HE ARG 18 -10.263 1.232 -5.565 154 HH11 ARG 18 HH11 ARG 18 -11.771 2.660 -8.391 155 HH12 ARG 18 HH12 ARG 18 -11.833 1.162 -9.266 156 HH21 ARG 18 HH21 ARG 18 -10.336 -0.722 -6.705 157 HH22 ARG 18 HH22 ARG 18 -11.033 -0.765 -8.306 158 H ARG 19 HN ARG 19 -10.588 5.500 -1.314 159 HA ARG 19 HA ARG 19 -8.637 7.226 -2.429 160 HB2 ARG 19 HB2 ARG 19 -10.766 8.058 -1.530 161 HB3 ARG 19 HB1 ARG 19 -10.287 7.554 0.086 162 HG2 ARG 19 HG2 ARG 19 -8.400 9.136 -0.010 163 HG3 ARG 19 HG1 ARG 19 -8.962 9.673 -1.595 164 HD2 ARG 19 HD2 ARG 19 -11.091 10.358 -0.593 165 HD3 ARG 19 HD1 ARG 19 -10.505 9.847 0.989 166 HE ARG 19 HE ARG 19 -8.635 11.633 0.068 167 HH11 ARG 19 HH11 ARG 19 -12.069 11.697 0.735 168 HH12 ARG 19 HH12 ARG 19 -12.094 13.393 1.103 169 HH21 ARG 19 HH21 ARG 19 -8.661 13.863 0.547 170 HH22 ARG 19 HH22 ARG 19 -10.155 14.630 0.982 171 H ARG 20 HN ARG 20 -8.898 5.542 0.672 172 HA ARG 20 HA ARG 20 -6.505 6.542 1.786 173 HB2 ARG 20 HB2 ARG 20 -8.346 5.445 3.076 174 HB3 ARG 20 HB1 ARG 20 -7.866 3.904 2.388 175 HG2 ARG 20 HG2 ARG 20 -6.997 4.160 4.642 176 HG3 ARG 20 HG1 ARG 20 -5.678 4.098 3.472 177 HD2 ARG 20 HD2 ARG 20 -5.516 6.537 3.531 178 HD3 ARG 20 HD1 ARG 20 -6.831 6.599 4.702 179 HE ARG 20 HE ARG 20 -4.870 4.961 5.794 180 HH11 ARG 20 HH11 ARG 20 -5.146 8.270 4.689 181 HH12 ARG 20 HH12 ARG 20 -4.049 8.896 5.887 182 HH21 ARG 20 HH21 ARG 20 -3.387 5.772 7.349 183 HH22 ARG 20 HH22 ARG 20 -3.027 7.468 7.383 184 H ASN 21 HN ASN 21 -7.231 3.705 -0.197 185 HA ASN 21 HA ASN 21 -4.628 2.605 -0.176 186 HB2 ASN 21 HB2 ASN 21 -6.862 2.384 -2.205 187 HB3 ASN 21 HB1 ASN 21 -5.334 1.529 -2.368 188 HD21 ASN 21 HD21 ASN 21 -7.959 0.388 -2.129 189 HD22 ASN 21 HD22 ASN 21 -7.929 -0.582 -0.695 190 H GLN 22 HN GLN 22 -6.153 5.059 -2.202 191 HA GLN 22 HA GLN 22 -4.022 5.303 -4.040 192 HB2 GLN 22 HB2 GLN 22 -6.361 6.194 -4.372 193 HB3 GLN 22 HB1 GLN 22 -5.944 7.499 -3.268 194 HG2 GLN 22 HG2 GLN 22 -4.157 8.208 -4.754 195 HG3 GLN 22 HG1 GLN 22 -4.526 6.880 -5.851 196 HE21 GLN 22 HE21 GLN 22 -4.511 9.711 -6.404 197 HE22 GLN 22 HE22 GLN 22 -6.101 10.114 -6.944 198 H GLU 23 HN GLU 23 -4.580 6.560 -0.853 199 HA GLU 23 HA GLU 23 -2.633 8.637 -0.917 200 HB2 GLU 23 HB2 GLU 23 -3.779 7.057 1.390 201 HB3 GLU 23 HB1 GLU 23 -2.658 8.393 1.589 202 HG2 GLU 23 HG2 GLU 23 -4.327 9.839 0.397 203 HG3 GLU 23 HG1 GLU 23 -5.457 8.488 0.503 204 H LEU 24 HN LEU 24 -2.619 5.263 0.143 205 HA LEU 24 HA LEU 24 0.124 5.183 0.847 206 HB2 LEU 24 HB2 LEU 24 -1.649 2.910 -0.046 207 HB3 LEU 24 HB1 LEU 24 -0.103 2.749 0.760 208 HG LEU 24 HG LEU 24 -2.645 3.863 1.946 209 HD11 LEU 24 HD11 LEU 24 -1.011 1.423 2.620 210 HD12 LEU 24 HD12 LEU 24 -2.541 1.423 1.742 211 HD13 LEU 24 HD13 LEU 24 -2.490 1.947 3.425 212 HD21 LEU 24 HD21 LEU 24 0.106 3.636 3.164 213 HD22 LEU 24 HD22 LEU 24 -1.369 4.062 4.032 214 HD23 LEU 24 HD23 LEU 24 -0.745 5.133 2.777 215 H LYS 25 HN LYS 25 -1.631 4.599 -2.140 216 HA LYS 25 HA LYS 25 0.429 3.516 -3.676 217 HB2 LYS 25 HB2 LYS 25 -1.988 3.713 -4.334 218 HB3 LYS 25 HB1 LYS 25 -1.716 5.421 -4.642 219 HG2 LYS 25 HG2 LYS 25 -0.002 4.780 -6.326 220 HG3 LYS 25 HG1 LYS 25 -0.461 3.095 -6.076 221 HD2 LYS 25 HD2 LYS 25 -2.296 5.301 -7.012 222 HD3 LYS 25 HD1 LYS 25 -1.573 4.062 -8.039 223 HE2 LYS 25 HE2 LYS 25 -2.741 2.341 -6.669 224 HE3 LYS 25 HE1 LYS 25 -3.548 3.643 -5.798 225 HZ1 LYS 25 HZ1 LYS 25 -3.778 3.062 -8.701 226 HZ2 LYS 25 HZ2 LYS 25 -4.492 4.380 -7.928 227 HZ3 LYS 25 HZ3 LYS 25 -4.973 2.809 -7.530 228 H GLN 26 HN GLN 26 -0.415 6.888 -3.012 229 HA GLN 26 HA GLN 26 1.572 8.048 -4.664 230 HB2 GLN 26 HB2 GLN 26 -0.440 9.248 -3.847 231 HB3 GLN 26 HB1 GLN 26 0.222 9.205 -2.221 232 HG2 GLN 26 HG2 GLN 26 2.083 10.588 -2.902 233 HG3 GLN 26 HG1 GLN 26 1.511 10.572 -4.570 234 HE21 GLN 26 HE21 GLN 26 -0.625 10.790 -1.826 235 HE22 GLN 26 HE22 GLN 26 -1.133 12.420 -2.105 236 H GLN 27 HN GLN 27 1.519 6.917 -1.359 237 HA GLN 27 HA GLN 27 3.955 8.143 -0.545 238 HB2 GLN 27 HB2 GLN 27 2.444 5.774 0.574 239 HB3 GLN 27 HB1 GLN 27 3.822 6.536 1.362 240 HG2 GLN 27 HG2 GLN 27 2.599 8.598 1.609 241 HG3 GLN 27 HG1 GLN 27 1.254 7.948 0.680 242 HE21 GLN 27 HE21 GLN 27 3.027 6.125 3.093 243 HE22 GLN 27 HE22 GLN 27 1.740 6.024 4.234 244 H VAL 28 HN VAL 28 3.086 5.080 -2.013 245 HA VAL 28 HA VAL 28 5.645 3.866 -1.840 246 HB VAL 28 HB VAL 28 3.352 3.348 -3.746 247 HG11 VAL 28 HG11 VAL 28 5.842 1.719 -3.261 248 HG12 VAL 28 HG12 VAL 28 5.438 2.592 -4.739 249 HG13 VAL 28 HG13 VAL 28 4.460 1.213 -4.232 250 HG21 VAL 28 HG21 VAL 28 2.947 1.382 -2.333 251 HG22 VAL 28 HG22 VAL 28 2.807 2.883 -1.417 252 HG23 VAL 28 HG23 VAL 28 4.256 1.888 -1.265 253 H ASP 29 HN ASP 29 3.980 5.690 -4.409 254 HA ASP 29 HA ASP 29 6.043 5.631 -6.304 255 HB2 ASP 29 HB2 ASP 29 3.778 7.552 -5.826 256 HB3 ASP 29 HB1 ASP 29 4.988 7.887 -7.058 257 H SER 30 HN SER 30 5.430 7.816 -3.606 258 HA SER 30 HA SER 30 7.496 9.647 -4.146 259 HB2 SER 30 HB2 SER 30 5.653 10.011 -2.486 260 HB3 SER 30 HB1 SER 30 6.439 8.851 -1.418 261 HG SER 30 HG SER 30 8.353 10.464 -1.944 262 H LEU 31 HN LEU 31 7.443 6.647 -2.263 263 HA LEU 31 HA LEU 31 10.046 6.764 -1.257 264 HB2 LEU 31 HB2 LEU 31 8.444 5.122 -0.461 265 HB3 LEU 31 HB1 LEU 31 8.394 4.362 -2.041 266 HG LEU 31 HG LEU 31 10.797 3.754 -1.773 267 HD11 LEU 31 HD11 LEU 31 11.748 3.843 0.501 268 HD12 LEU 31 HD12 LEU 31 10.372 4.821 1.010 269 HD13 LEU 31 HD13 LEU 31 11.493 5.439 -0.205 270 HD21 LEU 31 HD21 LEU 31 10.403 1.912 -0.274 271 HD22 LEU 31 HD22 LEU 31 8.957 2.192 -1.244 272 HD23 LEU 31 HD23 LEU 31 9.015 2.737 0.432 273 H LEU 32 HN LEU 32 8.816 5.290 -4.223 274 HA LEU 32 HA LEU 32 11.235 4.300 -5.200 275 HB2 LEU 32 HB2 LEU 32 8.777 5.234 -6.683 276 HB3 LEU 32 HB1 LEU 32 10.074 4.292 -7.395 277 HG LEU 32 HG LEU 32 8.310 3.369 -5.127 278 HD11 LEU 32 HD11 LEU 32 7.068 3.568 -7.213 279 HD12 LEU 32 HD12 LEU 32 7.309 1.875 -6.781 280 HD13 LEU 32 HD13 LEU 32 8.294 2.612 -8.045 281 HD21 LEU 32 HD21 LEU 32 10.506 2.358 -5.033 282 HD22 LEU 32 HD22 LEU 32 10.405 1.923 -6.740 283 HD23 LEU 32 HD23 LEU 32 9.316 1.173 -5.572 284 H SER 33 HN SER 33 9.784 7.481 -5.409 285 HA SER 33 HA SER 33 11.512 8.529 -7.386 286 HB2 SER 33 HB2 SER 33 10.041 10.013 -5.197 287 HB3 SER 33 HB1 SER 33 10.689 10.714 -6.679 288 HG SER 33 HG SER 33 8.639 8.741 -6.512 289 H GLU 34 HN GLU 34 11.674 8.390 -3.861 290 HA GLU 34 HA GLU 34 14.023 10.049 -3.729 291 HB2 GLU 34 HB2 GLU 34 12.377 8.568 -1.719 292 HB3 GLU 34 HB1 GLU 34 13.991 9.104 -1.283 293 HG2 GLU 34 HG2 GLU 34 12.495 10.765 -0.534 294 HG3 GLU 34 HG1 GLU 34 13.305 11.416 -1.953 295 H SER 35 HN SER 35 13.323 6.706 -4.086 296 HA SER 35 HA SER 35 15.688 5.686 -2.892 297 HB2 SER 35 HB2 SER 35 13.773 4.376 -4.831 298 HB3 SER 35 HB1 SER 35 15.030 3.537 -3.920 299 HG SER 35 HG SER 35 12.833 4.976 -2.828 300 H GLN 36 HN GLN 36 15.249 7.292 -5.847 301 HA GLN 36 HA GLN 36 17.472 5.815 -7.063 302 HB2 GLN 36 HB2 GLN 36 15.387 7.586 -8.339 303 HB3 GLN 36 HB1 GLN 36 16.770 6.917 -9.193 304 HG2 GLN 36 HG2 GLN 36 14.597 5.318 -7.856 305 HG3 GLN 36 HG1 GLN 36 14.728 5.635 -9.582 306 HE21 GLN 36 HE21 GLN 36 14.841 3.464 -10.097 307 HE22 GLN 36 HE22 GLN 36 16.240 2.503 -9.766 308 H LEU 37 HN LEU 37 17.198 8.239 -5.078 309 HA LEU 37 HA LEU 37 18.566 10.358 -6.451 310 HB2 LEU 37 HB2 LEU 37 18.163 9.885 -3.496 311 HB3 LEU 37 HB1 LEU 37 18.747 11.371 -4.217 312 HG LEU 37 HG LEU 37 15.994 10.206 -4.610 313 HD11 LEU 37 HD11 LEU 37 16.312 11.048 -2.359 314 HD12 LEU 37 HD12 LEU 37 15.252 12.119 -3.274 315 HD13 LEU 37 HD13 LEU 37 16.934 12.569 -2.997 316 HD21 LEU 37 HD21 LEU 37 16.622 11.422 -6.568 317 HD22 LEU 37 HD22 LEU 37 17.257 12.749 -5.598 318 HD23 LEU 37 HD23 LEU 37 15.524 12.427 -5.626 319 H LYS 38 HN LYS 38 20.716 10.871 -6.394 320 HA LYS 38 HA LYS 38 22.580 8.780 -5.836 321 HB2 LYS 38 HB2 LYS 38 23.012 11.694 -6.518 322 HB3 LYS 38 HB1 LYS 38 24.310 10.522 -6.356 323 HG2 LYS 38 HG2 LYS 38 23.286 9.212 -8.198 324 HG3 LYS 38 HG1 LYS 38 22.106 10.510 -8.409 325 HD2 LYS 38 HD2 LYS 38 23.917 12.092 -8.854 326 HD3 LYS 38 HD1 LYS 38 25.105 10.811 -8.616 327 HE2 LYS 38 HE2 LYS 38 24.124 9.590 -10.518 328 HE3 LYS 38 HE1 LYS 38 23.001 10.925 -10.773 329 HZ1 LYS 38 HZ1 LYS 38 24.893 11.084 -12.250 330 HZ2 LYS 38 HZ2 LYS 38 25.962 11.088 -10.943 331 HZ3 LYS 38 HZ3 LYS 38 24.894 12.382 -11.167 332 H GLU 39 HN GLU 39 21.441 11.616 -4.157 333 HA GLU 39 HA GLU 39 23.434 11.631 -2.128 334 HB2 GLU 39 HB2 GLU 39 20.633 12.755 -2.164 335 HB3 GLU 39 HB1 GLU 39 21.788 13.026 -0.869 336 HG2 GLU 39 HG2 GLU 39 23.305 14.105 -2.469 337 HG3 GLU 39 HG1 GLU 39 22.100 13.877 -3.736 338 H ALA 40 HN ALA 40 20.763 9.624 -2.750 339 HA ALA 40 HA ALA 40 20.267 8.857 -0.029 340 HB1 ALA 40 HB1 ALA 40 19.360 7.640 -2.626 341 HB2 ALA 40 HB2 ALA 40 18.457 8.769 -1.615 342 HB3 ALA 40 HB3 ALA 40 18.806 7.144 -1.028 343 H LEU 41 HN LEU 41 22.775 8.318 -2.042 344 HA LEU 41 HA LEU 41 23.290 5.553 -1.525 345 HB2 LEU 41 HB2 LEU 41 24.223 6.776 -3.469 346 HB3 LEU 41 HB1 LEU 41 25.200 7.732 -2.372 347 HG LEU 41 HG LEU 41 26.338 5.633 -1.645 348 HD11 LEU 41 HD11 LEU 41 24.618 4.033 -2.211 349 HD12 LEU 41 HD12 LEU 41 26.106 3.650 -3.076 350 HD13 LEU 41 HD13 LEU 41 24.772 4.435 -3.921 351 HD21 LEU 41 HD21 LEU 41 27.679 5.390 -3.689 352 HD22 LEU 41 HD22 LEU 41 27.367 7.079 -3.292 353 HD23 LEU 41 HD23 LEU 41 26.456 6.294 -4.583 354 H GLU 42 HN GLU 42 23.537 8.377 0.315 355 HA GLU 42 HA GLU 42 25.815 7.846 1.872 356 HB2 GLU 42 HB2 GLU 42 23.314 9.381 2.610 357 HB3 GLU 42 HB1 GLU 42 24.807 9.394 3.532 358 HG2 GLU 42 HG2 GLU 42 24.427 10.410 0.727 359 HG3 GLU 42 HG1 GLU 42 24.645 11.378 2.187 360 HA PRO 43 HA PRO 43 24.765 4.258 4.077 361 HB2 PRO 43 HB2 PRO 43 25.784 4.874 6.602 362 HB3 PRO 43 HB1 PRO 43 26.686 4.157 5.267 363 HG2 PRO 43 HG2 PRO 43 26.546 6.997 6.155 364 HG3 PRO 43 HG1 PRO 43 27.926 6.086 5.515 365 HD2 PRO 43 HD2 PRO 43 26.607 7.865 4.012 366 HD3 PRO 43 HD1 PRO 43 27.235 6.352 3.314 367 H ASN 44 HN ASN 44 24.160 7.170 6.081 368 HA ASN 44 HA ASN 44 22.182 5.817 7.646 369 HB2 ASN 44 HB2 ASN 44 22.923 8.742 7.461 370 HB3 ASN 44 HB1 ASN 44 21.653 8.140 8.517 371 HD21 ASN 44 HD21 ASN 44 25.058 8.426 8.020 372 HD22 ASN 44 HD22 ASN 44 25.543 7.781 9.553 373 H LYS 45 HN LYS 45 22.049 8.222 5.036 374 HA LYS 45 HA LYS 45 19.254 8.474 5.018 375 HB2 LYS 45 HB2 LYS 45 20.940 10.018 3.936 376 HB3 LYS 45 HB1 LYS 45 21.067 8.845 2.635 377 HG2 LYS 45 HG2 LYS 45 18.875 9.227 1.917 378 HG3 LYS 45 HG1 LYS 45 18.421 10.008 3.434 379 HD2 LYS 45 HD2 LYS 45 20.033 11.842 2.878 380 HD3 LYS 45 HD1 LYS 45 20.252 11.092 1.295 381 HE2 LYS 45 HE2 LYS 45 17.967 11.444 0.726 382 HE3 LYS 45 HE1 LYS 45 17.569 11.927 2.373 383 HZ1 LYS 45 HZ1 LYS 45 19.325 13.425 0.503 384 HZ2 LYS 45 HZ2 LYS 45 18.966 13.883 2.086 385 HZ3 LYS 45 HZ3 LYS 45 17.743 13.842 0.922 386 H ARG 46 HN ARG 46 21.415 6.191 3.474 387 HA ARG 46 HA ARG 46 19.588 4.928 1.757 388 HB2 ARG 46 HB2 ARG 46 22.078 4.573 1.826 389 HB3 ARG 46 HB1 ARG 46 21.848 3.605 3.274 390 HG2 ARG 46 HG2 ARG 46 20.411 2.073 1.960 391 HG3 ARG 46 HG1 ARG 46 20.800 3.010 0.517 392 HD2 ARG 46 HD2 ARG 46 22.694 1.440 2.255 393 HD3 ARG 46 HD1 ARG 46 22.250 1.109 0.582 394 HE ARG 46 HE ARG 46 23.396 3.681 0.771 395 HH11 ARG 46 HH11 ARG 46 24.274 0.293 0.928 396 HH12 ARG 46 HH12 ARG 46 25.906 0.565 0.392 397 HH21 ARG 46 HH21 ARG 46 25.556 4.047 0.110 398 HH22 ARG 46 HH22 ARG 46 26.630 2.693 -0.072 399 H GLN 47 HN GLN 47 20.328 4.437 5.176 400 HA GLN 47 HA GLN 47 18.567 2.253 5.563 401 HB2 GLN 47 HB2 GLN 47 19.800 4.231 7.471 402 HB3 GLN 47 HB1 GLN 47 18.748 2.930 8.008 403 HG2 GLN 47 HG2 GLN 47 21.134 2.312 6.325 404 HG3 GLN 47 HG1 GLN 47 21.327 2.629 8.045 405 HE21 GLN 47 HE21 GLN 47 18.446 1.095 6.823 406 HE22 GLN 47 HE22 GLN 47 18.785 -0.474 7.454 407 H HIS 48 HN HIS 48 18.182 5.723 5.595 408 HA HIS 48 HA HIS 48 15.706 5.877 6.905 409 HB2 HIS 48 HB2 HIS 48 17.189 7.843 6.345 410 HB3 HIS 48 HB1 HIS 48 16.643 7.708 4.676 411 HD1 HIS 48 HD1 HIS 48 15.441 8.666 8.111 412 HD2 HIS 48 HD2 HIS 48 14.102 8.747 4.171 413 HE1 HIS 48 HE1 HIS 48 13.352 10.072 8.128 414 HE2 HIS 48 HE2 HIS 48 12.643 10.220 5.719 415 H ILE 49 HN ILE 49 16.533 5.168 3.554 416 HA ILE 49 HA ILE 49 13.901 5.204 2.513 417 HB ILE 49 HB ILE 49 16.279 3.551 1.631 418 HG12 ILE 49 HG12 ILE 49 15.222 6.183 0.575 419 HG13 ILE 49 HG11 ILE 49 16.646 6.003 1.594 420 HG21 ILE 49 HG21 ILE 49 15.125 3.311 -0.496 421 HG22 ILE 49 HG22 ILE 49 13.750 4.221 0.129 422 HG23 ILE 49 HG23 ILE 49 14.148 2.644 0.815 423 HD11 ILE 49 HD11 ILE 49 17.811 4.832 -0.116 424 HD12 ILE 49 HD12 ILE 49 17.108 6.280 -0.839 425 HD13 ILE 49 HD13 ILE 49 16.355 4.709 -1.100 426 H TYR 50 HN TYR 50 15.915 2.488 3.654 427 HA TYR 50 HA TYR 50 14.051 0.469 3.657 428 HB2 TYR 50 HB2 TYR 50 16.436 0.157 4.156 429 HB3 TYR 50 HB1 TYR 50 16.239 0.992 5.690 430 HD1 TYR 50 HD1 TYR 50 16.344 -0.435 7.523 431 HD2 TYR 50 HD2 TYR 50 14.526 -1.842 3.937 432 HE1 TYR 50 HE1 TYR 50 15.819 -2.569 8.626 433 HE2 TYR 50 HE2 TYR 50 14.009 -3.976 5.031 434 HH TYR 50 HH TYR 50 14.260 -4.426 8.403 435 H GLN 51 HN GLN 51 14.564 2.962 6.114 436 HA GLN 51 HA GLN 51 12.697 1.998 8.005 437 HB2 GLN 51 HB2 GLN 51 14.506 3.843 8.273 438 HB3 GLN 51 HB1 GLN 51 13.297 4.926 7.594 439 HG2 GLN 51 HG2 GLN 51 13.238 5.079 9.987 440 HG3 GLN 51 HG1 GLN 51 11.758 4.302 9.424 441 HE21 GLN 51 HE21 GLN 51 11.406 3.335 11.421 442 HE22 GLN 51 HE22 GLN 51 12.350 1.996 11.979 443 H ARG 52 HN ARG 52 12.383 4.267 5.295 444 HA ARG 52 HA ARG 52 9.688 4.967 5.661 445 HB2 ARG 52 HB2 ARG 52 11.484 4.857 3.268 446 HB3 ARG 52 HB1 ARG 52 9.769 5.132 3.042 447 HG2 ARG 52 HG2 ARG 52 9.965 7.109 4.552 448 HG3 ARG 52 HG1 ARG 52 11.717 6.867 4.535 449 HD2 ARG 52 HD2 ARG 52 11.769 7.120 2.134 450 HD3 ARG 52 HD1 ARG 52 10.014 7.225 2.070 451 HE ARG 52 HE ARG 52 11.244 9.267 3.687 452 HH11 ARG 52 HH11 ARG 52 10.128 8.355 0.503 453 HH12 ARG 52 HH12 ARG 52 10.139 9.978 -0.124 454 HH21 ARG 52 HH21 ARG 52 11.227 11.419 2.896 455 HH22 ARG 52 HH22 ARG 52 10.739 11.723 1.260 456 H CYS 53 HN CYS 53 11.207 2.246 4.088 457 HA CYS 53 HA CYS 53 8.918 1.321 2.705 458 HB2 CYS 53 HB2 CYS 53 11.210 0.644 2.080 459 HB3 CYS 53 HB1 CYS 53 11.348 -0.258 3.594 460 HG CYS 53 HG CYS 53 10.625 -1.574 0.895 461 H ILE 54 HN ILE 54 10.367 0.397 5.799 462 HA ILE 54 HA ILE 54 8.585 -1.602 6.526 463 HB ILE 54 HB ILE 54 10.054 0.371 8.271 464 HG12 ILE 54 HG12 ILE 54 10.634 -2.515 7.550 465 HG13 ILE 54 HG11 ILE 54 11.482 -1.109 6.907 466 HG21 ILE 54 HG21 ILE 54 9.654 -1.169 10.126 467 HG22 ILE 54 HG22 ILE 54 8.644 -2.168 9.082 468 HG23 ILE 54 HG23 ILE 54 8.142 -0.525 9.485 469 HD11 ILE 54 HD11 ILE 54 12.761 -2.234 8.650 470 HD12 ILE 54 HD12 ILE 54 11.443 -1.966 9.793 471 HD13 ILE 54 HD13 ILE 54 12.327 -0.592 9.128 472 H GLN 55 HN GLN 55 8.350 1.892 7.031 473 HA GLN 55 HA GLN 55 5.991 1.851 8.570 474 HB2 GLN 55 HB2 GLN 55 7.075 4.016 6.765 475 HB3 GLN 55 HB1 GLN 55 5.794 4.237 7.949 476 HG2 GLN 55 HG2 GLN 55 7.332 3.698 9.746 477 HG3 GLN 55 HG1 GLN 55 8.620 3.408 8.575 478 HE21 GLN 55 HE21 GLN 55 9.917 5.004 9.471 479 HE22 GLN 55 HE22 GLN 55 9.580 6.687 9.271 480 H LEU 56 HN LEU 56 6.436 2.495 5.097 481 HA LEU 56 HA LEU 56 3.764 2.692 4.409 482 HB2 LEU 56 HB2 LEU 56 5.911 1.518 2.646 483 HB3 LEU 56 HB1 LEU 56 4.435 2.299 2.124 484 HG LEU 56 HG LEU 56 6.795 3.622 3.462 485 HD11 LEU 56 HD11 LEU 56 7.138 3.033 1.120 486 HD12 LEU 56 HD12 LEU 56 7.049 4.780 1.347 487 HD13 LEU 56 HD13 LEU 56 5.667 3.905 0.685 488 HD21 LEU 56 HD21 LEU 56 5.582 5.732 3.054 489 HD22 LEU 56 HD22 LEU 56 4.779 4.697 4.232 490 HD23 LEU 56 HD23 LEU 56 4.164 4.798 2.584 491 H LYS 57 HN LYS 57 5.756 -0.190 4.728 492 HA LYS 57 HA LYS 57 3.960 -2.028 3.584 493 HB2 LYS 57 HB2 LYS 57 6.255 -2.664 3.980 494 HB3 LYS 57 HB1 LYS 57 6.090 -2.369 5.705 495 HG2 LYS 57 HG2 LYS 57 4.527 -4.241 5.877 496 HG3 LYS 57 HG1 LYS 57 4.693 -4.537 4.145 497 HD2 LYS 57 HD2 LYS 57 6.984 -5.135 4.385 498 HD3 LYS 57 HD1 LYS 57 7.022 -4.565 6.054 499 HE2 LYS 57 HE2 LYS 57 6.922 -7.002 5.941 500 HE3 LYS 57 HE1 LYS 57 5.489 -6.331 6.711 501 HZ1 LYS 57 HZ1 LYS 57 4.286 -6.613 4.637 502 HZ2 LYS 57 HZ2 LYS 57 4.926 -8.086 5.160 503 HZ3 LYS 57 HZ3 LYS 57 5.668 -7.249 3.895 504 H GLN 58 HN GLN 58 4.448 -0.998 6.930 505 HA GLN 58 HA GLN 58 2.412 -2.524 8.099 506 HB2 GLN 58 HB2 GLN 58 4.135 -1.410 9.414 507 HB3 GLN 58 HB1 GLN 58 3.521 0.163 8.929 508 HG2 GLN 58 HG2 GLN 58 2.845 -0.393 11.188 509 HG3 GLN 58 HG1 GLN 58 1.449 -0.258 10.123 510 HE21 GLN 58 HE21 GLN 58 3.606 -3.023 10.219 511 HE22 GLN 58 HE22 GLN 58 2.449 -4.133 10.866 512 H ALA 59 HN ALA 59 2.333 0.647 6.554 513 HA ALA 59 HA ALA 59 -0.301 1.327 7.235 514 HB1 ALA 59 HB1 ALA 59 1.330 2.942 6.406 515 HB2 ALA 59 HB2 ALA 59 -0.147 2.965 5.443 516 HB3 ALA 59 HB3 ALA 59 1.299 2.166 4.824 517 H ILE 60 HN ILE 60 1.032 -0.432 4.460 518 HA ILE 60 HA ILE 60 -1.387 -0.682 3.032 519 HB ILE 60 HB ILE 60 1.026 -2.507 3.061 520 HG12 ILE 60 HG12 ILE 60 0.186 -0.324 1.138 521 HG13 ILE 60 HG11 ILE 60 1.481 -0.198 2.326 522 HG21 ILE 60 HG21 ILE 60 -1.261 -2.403 1.099 523 HG22 ILE 60 HG22 ILE 60 -0.955 -3.692 2.261 524 HG23 ILE 60 HG23 ILE 60 0.185 -3.401 0.947 525 HD11 ILE 60 HD11 ILE 60 1.398 -2.046 -0.048 526 HD12 ILE 60 HD12 ILE 60 2.673 -2.015 1.169 527 HD13 ILE 60 HD13 ILE 60 2.403 -0.609 0.141 528 H ASP 61 HN ASP 61 0.134 -2.656 5.523 529 HA ASP 61 HA ASP 61 -1.712 -4.787 5.501 530 HB2 ASP 61 HB2 ASP 61 0.520 -4.821 6.660 531 HB3 ASP 61 HB1 ASP 61 -0.158 -3.758 7.894 532 H GLU 62 HN GLU 62 -1.692 -1.675 7.115 533 HA GLU 62 HA GLU 62 -3.864 -2.048 8.846 534 HB2 GLU 62 HB2 GLU 62 -2.326 -0.144 9.002 535 HB3 GLU 62 HB1 GLU 62 -2.909 0.469 7.461 536 HG2 GLU 62 HG2 GLU 62 -3.964 1.762 9.107 537 HG3 GLU 62 HG1 GLU 62 -5.185 0.628 8.534 538 H ASN 63 HN ASN 63 -3.719 -0.818 5.520 539 HA ASN 63 HA ASN 63 -6.504 -0.383 5.243 540 HB2 ASN 63 HB2 ASN 63 -4.307 -0.794 3.218 541 HB3 ASN 63 HB1 ASN 63 -5.980 -0.515 2.751 542 HD21 ASN 63 HD21 ASN 63 -5.375 1.389 1.695 543 HD22 ASN 63 HD22 ASN 63 -4.983 2.829 2.573 544 H LYS 64 HN LYS 64 -4.402 -3.115 4.423 545 HA LYS 64 HA LYS 64 -6.315 -4.775 3.256 546 HB2 LYS 64 HB2 LYS 64 -3.900 -5.239 3.226 547 HB3 LYS 64 HB1 LYS 64 -3.934 -5.552 4.955 548 HG2 LYS 64 HG2 LYS 64 -5.408 -7.468 4.576 549 HG3 LYS 64 HG1 LYS 64 -5.356 -7.155 2.839 550 HD2 LYS 64 HD2 LYS 64 -2.948 -7.525 2.829 551 HD3 LYS 64 HD1 LYS 64 -2.969 -7.785 4.573 552 HE2 LYS 64 HE2 LYS 64 -4.401 -9.741 4.272 553 HE3 LYS 64 HE1 LYS 64 -4.403 -9.479 2.528 554 HZ1 LYS 64 HZ1 LYS 64 -2.048 -10.140 4.210 555 HZ2 LYS 64 HZ2 LYS 64 -1.979 -9.786 2.560 556 HZ3 LYS 64 HZ3 LYS 64 -2.806 -11.159 3.093 557 H ASN 65 HN ASN 65 -5.435 -4.342 6.658 558 HA ASN 65 HA ASN 65 -7.144 -6.345 7.688 559 HB2 ASN 65 HB2 ASN 65 -5.972 -3.874 8.970 560 HB3 ASN 65 HB1 ASN 65 -6.886 -5.086 9.859 561 HD21 ASN 65 HD21 ASN 65 -4.141 -4.268 10.207 562 HD22 ASN 65 HD22 ASN 65 -3.162 -5.671 9.950 563 H ALA 66 HN ALA 66 -7.608 -2.932 6.999 564 HA ALA 66 HA ALA 66 -10.157 -2.650 8.167 565 HB1 ALA 66 HB1 ALA 66 -10.387 -0.669 6.738 566 HB2 ALA 66 HB2 ALA 66 -8.966 -1.170 5.821 567 HB3 ALA 66 HB3 ALA 66 -8.806 -0.723 7.517 568 H LEU 67 HN LEU 67 -9.124 -3.468 4.884 569 HA LEU 67 HA LEU 67 -11.731 -3.679 3.810 570 HB2 LEU 67 HB2 LEU 67 -9.719 -3.323 2.454 571 HB3 LEU 67 HB1 LEU 67 -9.153 -4.926 2.866 572 HG LEU 67 HG LEU 67 -10.971 -5.942 1.631 573 HD11 LEU 67 HD11 LEU 67 -12.485 -4.496 0.273 574 HD12 LEU 67 HD12 LEU 67 -11.900 -3.111 1.193 575 HD13 LEU 67 HD13 LEU 67 -12.763 -4.414 2.010 576 HD21 LEU 67 HD21 LEU 67 -9.585 -3.761 0.081 577 HD22 LEU 67 HD22 LEU 67 -10.397 -5.154 -0.628 578 HD23 LEU 67 HD23 LEU 67 -8.973 -5.386 0.385 579 H GLN 68 HN GLN 68 -9.457 -6.116 5.055 580 HA GLN 68 HA GLN 68 -11.095 -8.347 4.608 581 HB2 GLN 68 HB2 GLN 68 -8.655 -8.376 5.141 582 HB3 GLN 68 HB1 GLN 68 -9.053 -7.979 6.805 583 HG2 GLN 68 HG2 GLN 68 -10.207 -10.061 7.084 584 HG3 GLN 68 HG1 GLN 68 -10.007 -10.446 5.374 585 HE21 GLN 68 HE21 GLN 68 -8.414 -10.154 8.451 586 HE22 GLN 68 HE22 GLN 68 -6.981 -11.011 8.017 587 H LYS 69 HN LYS 69 -11.233 -5.887 7.021 588 HA LYS 69 HA LYS 69 -12.928 -7.352 8.835 589 HB2 LYS 69 HB2 LYS 69 -11.439 -5.493 9.574 590 HB3 LYS 69 HB1 LYS 69 -12.406 -4.373 8.627 591 HG2 LYS 69 HG2 LYS 69 -14.343 -4.849 10.037 592 HG3 LYS 69 HG1 LYS 69 -13.371 -5.973 10.991 593 HD2 LYS 69 HD2 LYS 69 -11.874 -4.158 11.626 594 HD3 LYS 69 HD1 LYS 69 -12.812 -3.029 10.648 595 HE2 LYS 69 HE2 LYS 69 -13.393 -2.830 13.001 596 HE3 LYS 69 HE1 LYS 69 -14.763 -3.419 12.064 597 HZ1 LYS 69 HZ1 LYS 69 -12.946 -5.095 13.711 598 HZ2 LYS 69 HZ2 LYS 69 -14.269 -5.660 12.820 599 HZ3 LYS 69 HZ3 LYS 69 -14.516 -4.629 14.136 600 H LEU 70 HN LEU 70 -13.287 -5.525 5.973 601 HA LEU 70 HA LEU 70 -16.099 -4.935 6.361 602 HB2 LEU 70 HB2 LEU 70 -14.661 -3.286 5.282 603 HB3 LEU 70 HB1 LEU 70 -14.202 -4.452 4.059 604 HG LEU 70 HG LEU 70 -16.603 -4.486 3.311 605 HD11 LEU 70 HD11 LEU 70 -16.804 -2.094 5.134 606 HD12 LEU 70 HD12 LEU 70 -17.627 -3.637 5.350 607 HD13 LEU 70 HD13 LEU 70 -18.021 -2.614 3.970 608 HD21 LEU 70 HD21 LEU 70 -15.110 -1.872 3.195 609 HD22 LEU 70 HD22 LEU 70 -16.434 -2.341 2.127 610 HD23 LEU 70 HD23 LEU 70 -14.919 -3.244 2.104 611 H SER 71 HN SER 71 -17.710 -5.648 4.847 612 HA SER 71 HA SER 71 -18.817 -7.081 3.489 613 HB2 SER 71 HB2 SER 71 -16.853 -6.696 1.946 614 HB3 SER 71 HB1 SER 71 -16.110 -8.140 2.630 615 HG SER 71 HG SER 71 -18.537 -8.858 1.953 616 H LYS 72 HN LYS 72 -19.043 -7.806 5.900 617 HA LYS 72 HA LYS 72 -18.013 -10.281 6.730 618 HB2 LYS 72 HB2 LYS 72 -20.056 -10.345 8.212 619 HB3 LYS 72 HB1 LYS 72 -19.132 -8.851 8.322 620 HG2 LYS 72 HG2 LYS 72 -20.764 -7.794 6.760 621 HG3 LYS 72 HG1 LYS 72 -21.719 -9.278 6.824 622 HD2 LYS 72 HD2 LYS 72 -21.932 -9.010 9.272 623 HD3 LYS 72 HD1 LYS 72 -21.037 -7.492 9.167 624 HE2 LYS 72 HE2 LYS 72 -22.781 -6.619 7.648 625 HE3 LYS 72 HE1 LYS 72 -23.684 -8.114 7.866 626 HZ1 LYS 72 HZ1 LYS 72 -23.883 -7.631 10.211 627 HZ2 LYS 72 HZ2 LYS 72 -24.496 -6.346 9.298 628 HZ3 LYS 72 HZ3 LYS 72 -22.979 -6.211 10.031 629 H ALA 73 HN ALA 73 -18.765 -12.393 6.502 630 HA ALA 73 HA ALA 73 -19.555 -13.024 3.904 631 HB1 ALA 73 HB1 ALA 73 -19.563 -14.825 6.312 632 HB2 ALA 73 HB2 ALA 73 -18.153 -14.442 5.326 633 HB3 ALA 73 HB3 ALA 73 -19.506 -15.328 4.623 634 H ASP 74 HN ASP 74 -21.526 -12.421 6.671 635 HA ASP 74 HA ASP 74 -23.795 -13.900 5.633 636 HB2 ASP 74 HB2 ASP 74 -23.399 -13.670 8.090 637 HB3 ASP 74 HB1 ASP 74 -23.711 -11.944 7.943 638 H GLU 75 HN GLU 75 -22.517 -10.708 5.386 639 HA GLU 75 HA GLU 75 -24.861 -9.899 3.831 640 HB2 GLU 75 HB2 GLU 75 -25.002 -9.077 6.252 641 HB3 GLU 75 HB1 GLU 75 -23.633 -8.046 5.870 642 HG2 GLU 75 HG2 GLU 75 -26.186 -7.958 4.294 643 HG3 GLU 75 HG1 GLU 75 -25.953 -7.016 5.762 644 H SER 76 HN SER 76 -23.713 -9.995 1.957 645 HA SER 76 HA SER 76 -21.959 -7.739 1.464 646 HB2 SER 76 HB2 SER 76 -21.111 -10.586 0.856 647 HB3 SER 76 HB1 SER 76 -20.284 -9.144 0.276 648 HG SER 76 HG SER 76 -20.723 -9.673 3.029 649 H ALA 77 HN ALA 77 -22.998 -6.768 -0.135 650 HA ALA 77 HA ALA 77 -24.852 -8.118 -1.828 651 HB1 ALA 77 HB1 ALA 77 -25.225 -5.828 -1.074 652 HB2 ALA 77 HB2 ALA 77 -25.210 -5.926 -2.834 653 HB3 ALA 77 HB3 ALA 77 -23.805 -5.295 -1.975 654 HA PRO 78 HA PRO 78 -21.701 -8.829 -4.979 655 HB2 PRO 78 HB2 PRO 78 -22.668 -11.175 -5.851 656 HB3 PRO 78 HB1 PRO 78 -21.799 -11.056 -4.318 657 HG2 PRO 78 HG2 PRO 78 -24.678 -11.453 -4.823 658 HG3 PRO 78 HG1 PRO 78 -23.713 -11.892 -3.405 659 HD2 PRO 78 HD2 PRO 78 -25.399 -9.587 -3.755 660 HD3 PRO 78 HD1 PRO 78 -24.434 -10.029 -2.335 661 H VAL 79 HN VAL 79 -23.349 -6.867 -5.640 662 HA VAL 79 HA VAL 79 -25.373 -7.489 -7.516 663 HB VAL 79 HB VAL 79 -23.917 -4.871 -7.146 664 HG11 VAL 79 HG11 VAL 79 -26.569 -5.473 -8.450 665 HG12 VAL 79 HG12 VAL 79 -25.096 -4.961 -9.274 666 HG13 VAL 79 HG13 VAL 79 -25.908 -3.863 -8.160 667 HG21 VAL 79 HG21 VAL 79 -26.480 -5.867 -5.914 668 HG22 VAL 79 HG22 VAL 79 -25.816 -4.242 -5.739 669 HG23 VAL 79 HG23 VAL 79 -24.946 -5.625 -5.078 670 H ALA 80 HN ALA 80 -22.430 -5.591 -8.277 671 HA ALA 80 HA ALA 80 -21.880 -7.370 -10.498 672 HB1 ALA 80 HB1 ALA 80 -22.540 -4.463 -10.937 673 HB2 ALA 80 HB2 ALA 80 -23.465 -5.856 -11.494 674 HB3 ALA 80 HB3 ALA 80 -21.860 -5.545 -12.152 675 H ASN 81 HN ASN 81 -20.836 -4.003 -10.046 676 HA ASN 81 HA ASN 81 -18.113 -4.852 -10.395 677 HB2 ASN 81 HB2 ASN 81 -17.535 -2.473 -10.280 678 HB3 ASN 81 HB1 ASN 81 -18.866 -2.746 -11.398 679 HD21 ASN 81 HD21 ASN 81 -20.871 -1.900 -10.943 680 HD22 ASN 81 HD22 ASN 81 -21.151 -0.795 -9.645 681 H TYR 82 HN TYR 82 -20.155 -4.402 -7.723 682 HA TYR 82 HA TYR 82 -18.402 -3.583 -5.715 683 HB2 TYR 82 HB2 TYR 82 -20.923 -3.969 -5.539 684 HB3 TYR 82 HB1 TYR 82 -20.565 -5.681 -5.357 685 HD1 TYR 82 HD1 TYR 82 -18.946 -6.299 -3.362 686 HD2 TYR 82 HD2 TYR 82 -21.078 -2.621 -3.657 687 HE1 TYR 82 HE1 TYR 82 -18.739 -5.988 -0.938 688 HE2 TYR 82 HE2 TYR 82 -20.859 -2.299 -1.230 689 HH TYR 82 HH TYR 82 -20.508 -3.696 0.795 690 H ASN 83 HN ASN 83 -18.888 -6.760 -7.174 691 HA ASN 83 HA ASN 83 -17.311 -8.203 -5.299 692 HB2 ASN 83 HB2 ASN 83 -18.041 -8.910 -8.152 693 HB3 ASN 83 HB1 ASN 83 -17.353 -10.020 -6.975 694 HD21 ASN 83 HD21 ASN 83 -19.858 -10.199 -8.421 695 HD22 ASN 83 HD22 ASN 83 -21.098 -10.295 -7.218 696 H GLN 84 HN GLN 84 -16.662 -6.836 -8.501 697 HA GLN 84 HA GLN 84 -14.027 -7.887 -8.644 698 HB2 GLN 84 HB2 GLN 84 -15.414 -7.284 -10.643 699 HB3 GLN 84 HB1 GLN 84 -15.168 -5.587 -10.241 700 HG2 GLN 84 HG2 GLN 84 -13.620 -6.320 -11.970 701 HG3 GLN 84 HG1 GLN 84 -12.763 -5.859 -10.498 702 HE21 GLN 84 HE21 GLN 84 -10.962 -7.094 -10.855 703 HE22 GLN 84 HE22 GLN 84 -10.983 -8.824 -10.830 704 H ARG 85 HN ARG 85 -15.377 -4.732 -7.779 705 HA ARG 85 HA ARG 85 -12.930 -3.332 -7.689 706 HB2 ARG 85 HB2 ARG 85 -15.280 -2.348 -7.694 707 HB3 ARG 85 HB1 ARG 85 -15.345 -2.727 -5.980 708 HG2 ARG 85 HG2 ARG 85 -13.231 -1.342 -5.747 709 HG3 ARG 85 HG1 ARG 85 -13.554 -0.779 -7.388 710 HD2 ARG 85 HD2 ARG 85 -15.238 -0.407 -4.924 711 HD3 ARG 85 HD1 ARG 85 -14.485 0.831 -5.924 712 HE ARG 85 HE ARG 85 -16.491 -0.831 -7.217 713 HH11 ARG 85 HH11 ARG 85 -15.683 2.225 -5.715 714 HH12 ARG 85 HH12 ARG 85 -17.139 3.012 -6.235 715 HH21 ARG 85 HH21 ARG 85 -18.415 0.196 -7.905 716 HH22 ARG 85 HH22 ARG 85 -18.685 1.864 -7.491 717 H LYS 86 HN LYS 86 -14.649 -5.284 -5.356 718 HA LYS 86 HA LYS 86 -13.117 -4.662 -3.083 719 HB2 LYS 86 HB2 LYS 86 -15.254 -5.776 -2.913 720 HB3 LYS 86 HB1 LYS 86 -14.664 -7.147 -3.844 721 HG2 LYS 86 HG2 LYS 86 -13.005 -7.554 -1.979 722 HG3 LYS 86 HG1 LYS 86 -13.890 -6.343 -1.039 723 HD2 LYS 86 HD2 LYS 86 -14.867 -9.010 -2.056 724 HD3 LYS 86 HD1 LYS 86 -14.746 -8.455 -0.390 725 HE2 LYS 86 HE2 LYS 86 -16.563 -6.927 -0.682 726 HE3 LYS 86 HE1 LYS 86 -16.597 -7.205 -2.424 727 HZ1 LYS 86 HZ1 LYS 86 -17.172 -9.551 -1.913 728 HZ2 LYS 86 HZ2 LYS 86 -18.350 -8.438 -1.437 729 HZ3 LYS 86 HZ3 LYS 86 -17.321 -9.124 -0.281 730 H GLU 87 HN GLU 87 -12.744 -7.115 -5.613 731 HA GLU 87 HA GLU 87 -10.420 -8.310 -4.462 732 HB2 GLU 87 HB2 GLU 87 -11.475 -8.412 -7.290 733 HB3 GLU 87 HB1 GLU 87 -10.143 -9.383 -6.684 734 HG2 GLU 87 HG2 GLU 87 -11.819 -10.237 -4.942 735 HG3 GLU 87 HG1 GLU 87 -13.050 -9.551 -6.002 736 H GLU 88 HN GLU 88 -11.025 -5.724 -6.735 737 HA GLU 88 HA GLU 88 -8.499 -5.458 -7.881 738 HB2 GLU 88 HB2 GLU 88 -10.604 -3.379 -7.281 739 HB3 GLU 88 HB1 GLU 88 -9.156 -3.044 -8.217 740 HG2 GLU 88 HG2 GLU 88 -11.228 -5.102 -8.944 741 HG3 GLU 88 HG1 GLU 88 -11.153 -3.468 -9.599 742 H GLU 89 HN GLU 89 -9.799 -4.058 -4.898 743 HA GLU 89 HA GLU 89 -7.515 -2.518 -4.283 744 HB2 GLU 89 HB2 GLU 89 -9.522 -3.686 -2.344 745 HB3 GLU 89 HB1 GLU 89 -8.423 -2.351 -2.030 746 HG2 GLU 89 HG2 GLU 89 -10.764 -2.391 -3.916 747 HG3 GLU 89 HG1 GLU 89 -10.582 -1.445 -2.440 748 H HIS 90 HN HIS 90 -8.450 -5.835 -3.449 749 HA HIS 90 HA HIS 90 -6.256 -6.420 -1.781 750 HB2 HIS 90 HB2 HIS 90 -8.093 -8.120 -3.436 751 HB3 HIS 90 HB1 HIS 90 -6.643 -8.845 -2.756 752 HD1 HIS 90 HD1 HIS 90 -6.527 -9.084 -0.177 753 HD2 HIS 90 HD2 HIS 90 -10.134 -7.599 -1.598 754 HE1 HIS 90 HE1 HIS 90 -8.145 -9.312 1.729 755 HE2 HIS 90 HE2 HIS 90 -10.360 -8.587 0.781 756 H THR 91 HN THR 91 -6.686 -6.732 -5.284 757 HA THR 91 HA THR 91 -4.188 -7.917 -5.822 758 HB THR 91 HB THR 91 -5.799 -6.169 -7.689 759 HG1 THR 91 HG1 THR 91 -6.448 -8.507 -6.510 760 HG21 THR 91 HG21 THR 91 -4.823 -7.584 -9.438 761 HG22 THR 91 HG22 THR 91 -3.901 -8.461 -8.218 762 HG23 THR 91 HG23 THR 91 -3.570 -6.755 -8.517 763 H LEU 92 HN LEU 92 -5.210 -4.553 -5.559 764 HA LEU 92 HA LEU 92 -2.830 -3.443 -6.669 765 HB2 LEU 92 HB2 LEU 92 -4.848 -2.142 -6.698 766 HB3 LEU 92 HB1 LEU 92 -5.015 -2.261 -4.958 767 HG LEU 92 HG LEU 92 -2.919 -0.918 -4.726 768 HD11 LEU 92 HD11 LEU 92 -3.252 -0.501 -7.693 769 HD12 LEU 92 HD12 LEU 92 -1.955 -1.415 -6.921 770 HD13 LEU 92 HD13 LEU 92 -2.097 0.321 -6.645 771 HD21 LEU 92 HD21 LEU 92 -3.976 1.202 -5.229 772 HD22 LEU 92 HD22 LEU 92 -5.155 0.077 -4.552 773 HD23 LEU 92 HD23 LEU 92 -5.136 0.398 -6.286 774 H LEU 93 HN LEU 93 -4.037 -3.802 -3.337 775 HA LEU 93 HA LEU 93 -1.800 -2.613 -2.110 776 HB2 LEU 93 HB2 LEU 93 -3.777 -4.600 -0.984 777 HB3 LEU 93 HB1 LEU 93 -2.618 -3.695 -0.033 778 HG LEU 93 HG LEU 93 -4.868 -2.491 -1.647 779 HD11 LEU 93 HD11 LEU 93 -4.533 -2.853 1.327 780 HD12 LEU 93 HD12 LEU 93 -5.685 -3.700 0.295 781 HD13 LEU 93 HD13 LEU 93 -5.836 -1.960 0.542 782 HD21 LEU 93 HD21 LEU 93 -2.876 -1.220 0.228 783 HD22 LEU 93 HD22 LEU 93 -4.256 -0.407 -0.509 784 HD23 LEU 93 HD23 LEU 93 -2.942 -1.008 -1.520 785 H ASP 94 HN ASP 94 -2.455 -5.891 -3.136 786 HA ASP 94 HA ASP 94 -0.362 -7.097 -1.638 787 HB2 ASP 94 HB2 ASP 94 -2.302 -8.359 -2.606 788 HB3 ASP 94 HB1 ASP 94 -1.593 -8.132 -4.205 789 H LYS 95 HN LYS 95 -0.561 -5.952 -5.038 790 HA LYS 95 HA LYS 95 2.034 -6.726 -5.750 791 HB2 LYS 95 HB2 LYS 95 0.138 -5.988 -7.276 792 HB3 LYS 95 HB1 LYS 95 0.541 -4.332 -6.832 793 HG2 LYS 95 HG2 LYS 95 1.565 -4.855 -8.948 794 HG3 LYS 95 HG1 LYS 95 2.832 -4.696 -7.728 795 HD2 LYS 95 HD2 LYS 95 3.028 -7.089 -7.542 796 HD3 LYS 95 HD1 LYS 95 1.642 -7.328 -8.604 797 HE2 LYS 95 HE2 LYS 95 3.767 -7.720 -9.760 798 HE3 LYS 95 HE1 LYS 95 2.876 -6.376 -10.469 799 HZ1 LYS 95 HZ1 LYS 95 4.314 -4.833 -9.377 800 HZ2 LYS 95 HZ2 LYS 95 5.275 -5.953 -10.198 801 HZ3 LYS 95 HZ3 LYS 95 5.095 -6.067 -8.522 802 H LEU 96 HN LEU 96 0.771 -3.689 -4.438 803 HA LEU 96 HA LEU 96 3.158 -2.263 -4.350 804 HB2 LEU 96 HB2 LEU 96 0.894 -2.178 -2.353 805 HB3 LEU 96 HB1 LEU 96 2.159 -0.975 -2.506 806 HG LEU 96 HG LEU 96 0.102 -1.618 -4.620 807 HD11 LEU 96 HD11 LEU 96 0.359 0.746 -2.768 808 HD12 LEU 96 HD12 LEU 96 -0.889 -0.499 -2.705 809 HD13 LEU 96 HD13 LEU 96 -0.801 0.594 -4.087 810 HD21 LEU 96 HD21 LEU 96 2.196 -0.873 -5.600 811 HD22 LEU 96 HD22 LEU 96 2.231 0.513 -4.512 812 HD23 LEU 96 HD23 LEU 96 0.969 0.387 -5.736 813 H THR 97 HN THR 97 1.808 -4.513 -1.952 814 HA THR 97 HA THR 97 3.841 -4.402 -0.065 815 HB THR 97 HB THR 97 2.311 -6.888 -0.874 816 HG1 THR 97 HG1 THR 97 0.924 -5.096 -0.332 817 HG21 THR 97 HG21 THR 97 3.625 -6.122 1.739 818 HG22 THR 97 HG22 THR 97 4.225 -7.325 0.595 819 HG23 THR 97 HG23 THR 97 2.698 -7.593 1.438 820 H GLN 98 HN GLN 98 3.627 -6.299 -3.050 821 HA GLN 98 HA GLN 98 5.969 -7.810 -2.721 822 HB2 GLN 98 HB2 GLN 98 4.713 -6.828 -5.290 823 HB3 GLN 98 HB1 GLN 98 5.897 -8.119 -5.161 824 HG2 GLN 98 HG2 GLN 98 4.332 -9.479 -3.924 825 HG3 GLN 98 HG1 GLN 98 3.154 -8.166 -3.925 826 HE21 GLN 98 HE21 GLN 98 1.604 -9.391 -4.990 827 HE22 GLN 98 HE22 GLN 98 1.747 -9.780 -6.675 828 H GLN 99 HN GLN 99 5.407 -4.648 -4.196 829 HA GLN 99 HA GLN 99 7.979 -4.236 -5.240 830 HB2 GLN 99 HB2 GLN 99 5.999 -2.181 -4.239 831 HB3 GLN 99 HB1 GLN 99 7.393 -1.839 -5.253 832 HG2 GLN 99 HG2 GLN 99 6.441 -3.195 -7.035 833 HG3 GLN 99 HG1 GLN 99 5.047 -3.561 -6.018 834 HE21 GLN 99 HE21 GLN 99 3.599 -2.625 -7.447 835 HE22 GLN 99 HE22 GLN 99 3.491 -0.916 -7.677 836 H LEU 100 HN LEU 100 6.568 -3.288 -2.133 837 HA LEU 100 HA LEU 100 8.844 -1.820 -1.286 838 HB2 LEU 100 HB2 LEU 100 6.592 -2.988 0.348 839 HB3 LEU 100 HB1 LEU 100 7.739 -1.789 0.910 840 HG LEU 100 HG LEU 100 5.647 -1.410 -1.233 841 HD11 LEU 100 HD11 LEU 100 4.715 0.205 0.348 842 HD12 LEU 100 HD12 LEU 100 5.958 -0.229 1.520 843 HD13 LEU 100 HD13 LEU 100 4.761 -1.423 1.024 844 HD21 LEU 100 HD21 LEU 100 6.392 0.934 -1.262 845 HD22 LEU 100 HD22 LEU 100 7.638 -0.173 -1.833 846 HD23 LEU 100 HD23 LEU 100 7.739 0.505 -0.209 847 H GLN 101 HN GLN 101 7.605 -5.038 -0.472 848 HA GLN 101 HA GLN 101 9.579 -5.682 1.418 849 HB2 GLN 101 HB2 GLN 101 7.413 -6.878 1.151 850 HB3 GLN 101 HB1 GLN 101 8.002 -7.565 -0.353 851 HG2 GLN 101 HG2 GLN 101 8.193 -9.194 1.385 852 HG3 GLN 101 HG1 GLN 101 9.808 -8.683 0.901 853 HE21 GLN 101 HE21 GLN 101 10.699 -9.363 2.852 854 HE22 GLN 101 HE22 GLN 101 10.448 -8.507 4.335 855 H GLY 102 HN GLY 102 9.380 -6.215 -2.074 856 HA2 GLY 102 HA2 GLY 102 11.768 -7.690 -2.350 857 HA3 GLY 102 HA1 GLY 102 10.990 -6.758 -3.619 858 H LEU 103 HN LEU 103 11.123 -4.210 -2.500 859 HA LEU 103 HA LEU 103 13.779 -3.487 -3.196 860 HB2 LEU 103 HB2 LEU 103 11.842 -2.035 -3.617 861 HB3 LEU 103 HB1 LEU 103 11.596 -1.853 -1.891 862 HG LEU 103 HG LEU 103 13.796 -0.711 -1.724 863 HD11 LEU 103 HD11 LEU 103 14.880 -1.716 -3.660 864 HD12 LEU 103 HD12 LEU 103 14.902 0.042 -3.768 865 HD13 LEU 103 HD13 LEU 103 13.755 -0.885 -4.734 866 HD21 LEU 103 HD21 LEU 103 13.082 1.377 -2.782 867 HD22 LEU 103 HD22 LEU 103 11.749 0.588 -1.939 868 HD23 LEU 103 HD23 LEU 103 11.859 0.496 -3.697 869 H ALA 104 HN ALA 104 12.027 -3.627 -0.115 870 HA ALA 104 HA ALA 104 13.911 -2.420 1.532 871 HB1 ALA 104 HB1 ALA 104 11.650 -2.945 2.266 872 HB2 ALA 104 HB2 ALA 104 12.842 -3.624 3.375 873 HB3 ALA 104 HB3 ALA 104 12.022 -4.670 2.214 874 H VAL 105 HN VAL 105 13.570 -5.835 0.662 875 HA VAL 105 HA VAL 105 15.730 -6.750 2.227 876 HB VAL 105 HB VAL 105 14.419 -7.972 -0.199 877 HG11 VAL 105 HG11 VAL 105 15.433 -10.082 0.526 878 HG12 VAL 105 HG12 VAL 105 16.335 -9.208 1.764 879 HG13 VAL 105 HG13 VAL 105 16.646 -8.890 0.056 880 HG21 VAL 105 HG21 VAL 105 14.087 -8.496 2.747 881 HG22 VAL 105 HG22 VAL 105 13.304 -9.399 1.453 882 HG23 VAL 105 HG23 VAL 105 12.923 -7.693 1.695 883 H THR 106 HN THR 106 15.497 -5.617 -1.099 884 HA THR 106 HA THR 106 18.084 -6.351 -1.924 885 HB THR 106 HB THR 106 16.415 -4.038 -2.928 886 HG1 THR 106 HG1 THR 106 15.157 -5.778 -3.287 887 HG21 THR 106 HG21 THR 106 17.645 -4.349 -5.022 888 HG22 THR 106 HG22 THR 106 18.614 -5.617 -4.269 889 HG23 THR 106 HG23 THR 106 18.736 -3.953 -3.695 890 H ILE 107 HN ILE 107 16.864 -3.570 -0.173 891 HA ILE 107 HA ILE 107 19.292 -2.055 -0.436 892 HB ILE 107 HB ILE 107 16.975 -1.649 1.455 893 HG12 ILE 107 HG12 ILE 107 17.571 -0.246 -1.159 894 HG13 ILE 107 HG11 ILE 107 16.398 -1.547 -0.982 895 HG21 ILE 107 HG21 ILE 107 19.228 0.196 0.676 896 HG22 ILE 107 HG22 ILE 107 18.974 -0.548 2.256 897 HG23 ILE 107 HG23 ILE 107 17.830 0.650 1.649 898 HD11 ILE 107 HD11 ILE 107 16.293 1.112 0.417 899 HD12 ILE 107 HD12 ILE 107 15.107 -0.184 0.561 900 HD13 ILE 107 HD13 ILE 107 15.333 0.639 -0.984 901 H SER 108 HN SER 108 17.808 -4.083 2.056 902 HA SER 108 HA SER 108 19.823 -3.366 3.986 903 HB2 SER 108 HB2 SER 108 18.588 -5.116 5.391 904 HB3 SER 108 HB1 SER 108 17.683 -3.679 4.916 905 HG SER 108 HG SER 108 16.605 -4.852 3.388 906 H ARG 109 HN ARG 109 19.269 -5.985 1.750 907 HA ARG 109 HA ARG 109 21.434 -7.525 2.953 908 HB2 ARG 109 HB2 ARG 109 19.534 -8.158 0.699 909 HB3 ARG 109 HB1 ARG 109 20.927 -9.163 1.072 910 HG2 ARG 109 HG2 ARG 109 20.026 -9.427 3.381 911 HG3 ARG 109 HG1 ARG 109 18.572 -8.582 2.849 912 HD2 ARG 109 HD2 ARG 109 18.178 -10.303 1.165 913 HD3 ARG 109 HD1 ARG 109 19.651 -11.135 1.658 914 HE ARG 109 HE ARG 109 18.210 -10.961 3.950 915 HH11 ARG 109 HH11 ARG 109 17.501 -12.195 0.747 916 HH12 ARG 109 HH12 ARG 109 16.402 -13.408 1.326 917 HH21 ARG 109 HH21 ARG 109 16.772 -12.552 4.709 918 HH22 ARG 109 HH22 ARG 109 15.994 -13.615 3.582 919 H GLU 110 HN GLU 110 23.273 -8.142 1.800 920 HA GLU 110 HA GLU 110 25.133 -7.743 0.574 921 HB2 GLU 110 HB2 GLU 110 23.236 -6.535 -1.451 922 HB3 GLU 110 HB1 GLU 110 24.893 -7.030 -1.756 923 HG2 GLU 110 HG2 GLU 110 22.581 -8.821 -1.047 924 HG3 GLU 110 HG1 GLU 110 23.372 -8.683 -2.617 925 H ASN 111 HN ASN 111 24.197 -5.863 2.498 926 HA ASN 111 HA ASN 111 25.375 -3.365 1.468 927 HB2 ASN 111 HB2 ASN 111 22.913 -3.346 2.267 928 HB3 ASN 111 HB1 ASN 111 23.570 -3.552 3.886 929 HD21 ASN 111 HD21 ASN 111 24.773 -1.878 4.813 930 HD22 ASN 111 HD22 ASN 111 24.694 -0.258 4.208 931 H ILE 112 HN ILE 112 27.243 -4.968 2.036 932 HA ILE 112 HA ILE 112 27.753 -5.237 4.869 933 HB ILE 112 HB ILE 112 29.570 -6.081 2.619 934 HG12 ILE 112 HG12 ILE 112 27.448 -7.734 4.002 935 HG13 ILE 112 HG11 ILE 112 27.272 -7.056 2.394 936 HG21 ILE 112 HG21 ILE 112 30.445 -7.642 4.272 937 HG22 ILE 112 HG22 ILE 112 29.291 -7.038 5.462 938 HG23 ILE 112 HG23 ILE 112 30.565 -5.981 4.855 939 HD11 ILE 112 HD11 ILE 112 29.337 -9.065 3.245 940 HD12 ILE 112 HD12 ILE 112 29.163 -8.387 1.626 941 HD13 ILE 112 HD13 ILE 112 27.885 -9.397 2.301 942 H THR 113 HN THR 113 27.926 -2.951 5.277 943 HA THR 113 HA THR 113 30.479 -1.774 4.474 944 HB THR 113 HB THR 113 29.586 0.193 5.864 945 HG1 THR 113 HG1 THR 113 27.212 0.097 5.993 946 HG21 THR 113 HG21 THR 113 29.593 0.212 3.421 947 HG22 THR 113 HG22 THR 113 28.132 0.971 4.048 948 HG23 THR 113 HG23 THR 113 28.064 -0.667 3.400 949 H GLU 114 HN GLU 114 28.690 -1.858 7.540 950 HA GLU 114 HA GLU 114 31.099 -2.932 8.839 951 HB2 GLU 114 HB2 GLU 114 30.411 -1.767 10.890 952 HB3 GLU 114 HB1 GLU 114 30.686 -0.641 9.576 953 HG2 GLU 114 HG2 GLU 114 28.304 -0.450 9.196 954 HG3 GLU 114 HG1 GLU 114 27.995 -1.640 10.460 955 H VAL 115 HN VAL 115 28.419 -3.916 7.633 956 HA VAL 115 HA VAL 115 27.156 -5.181 9.907 957 HB VAL 115 HB VAL 115 26.500 -5.584 6.992 958 HG11 VAL 115 HG11 VAL 115 24.872 -5.973 9.499 959 HG12 VAL 115 HG12 VAL 115 25.540 -7.246 8.479 960 HG13 VAL 115 HG13 VAL 115 24.280 -6.185 7.851 961 HG21 VAL 115 HG21 VAL 115 24.767 -3.861 7.291 962 HG22 VAL 115 HG22 VAL 115 26.396 -3.209 7.466 963 HG23 VAL 115 HG23 VAL 115 25.411 -3.515 8.896 964 H GLY 116 HN GLY 116 28.966 -6.449 10.565 965 HA2 GLY 116 HA2 GLY 116 29.000 -9.065 10.185 966 HA3 GLY 116 HA1 GLY 116 29.878 -8.541 8.752 967 H ALA 117 HN ALA 117 31.868 -9.370 9.288 968 HA ALA 117 HA ALA 117 33.311 -7.850 11.309 969 HB1 ALA 117 HB1 ALA 117 33.266 -10.867 11.291 970 HB2 ALA 117 HB2 ALA 117 32.579 -9.822 12.536 971 HB3 ALA 117 HB3 ALA 117 34.324 -9.865 12.283 972 HA PRO 118 HA PRO 118 36.078 -8.257 7.796 973 HB2 PRO 118 HB2 PRO 118 37.591 -6.117 8.325 974 HB3 PRO 118 HB1 PRO 118 35.933 -5.943 7.738 975 HG2 PRO 118 HG2 PRO 118 37.005 -5.641 10.507 976 HG3 PRO 118 HG1 PRO 118 35.757 -4.695 9.681 977 HD2 PRO 118 HD2 PRO 118 35.288 -6.756 11.488 978 HD3 PRO 118 HD1 PRO 118 34.111 -6.131 10.319 979 H THR 119 HN THR 119 36.433 -9.680 10.420 980 HA THR 119 HA THR 119 39.227 -10.265 10.101 981 HB THR 119 HB THR 119 39.504 -8.478 11.644 982 HG1 THR 119 HG1 THR 119 39.520 -10.830 13.251 983 HG21 THR 119 HG21 THR 119 37.371 -9.753 13.359 984 HG22 THR 119 HG22 THR 119 37.226 -8.245 12.458 985 HG23 THR 119 HG23 THR 119 38.348 -8.356 13.814 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -28.454 19.322 4.277 2 H2 GLY 1 HT2 GLY 1 -27.730 19.044 2.775 3 H3 GLY 1 HT3 GLY 1 -29.400 19.292 2.876 4 HA2 GLY 1 HA1 GLY 1 -27.328 21.306 3.539 5 HA3 GLY 1 HA2 GLY 1 -28.250 21.264 2.045 6 HA PRO 2 HA PRO 2 -30.458 24.006 5.080 7 HB2 PRO 2 HB2 PRO 2 -31.067 25.956 3.286 8 HB3 PRO 2 HB1 PRO 2 -29.546 25.907 4.185 9 HG2 PRO 2 HG2 PRO 2 -30.122 25.039 1.381 10 HG3 PRO 2 HG1 PRO 2 -28.726 25.932 2.014 11 HD2 PRO 2 HD2 PRO 2 -28.643 23.280 1.483 12 HD3 PRO 2 HD1 PRO 2 -27.697 24.021 2.788 13 H MET 3 HN MET 3 -31.280 22.743 1.927 14 HA MET 3 HA MET 3 -34.109 23.294 2.245 15 HB2 MET 3 HB2 MET 3 -32.696 21.595 0.177 16 HB3 MET 3 HB1 MET 3 -34.382 22.081 0.128 17 HG2 MET 3 HG2 MET 3 -33.687 24.427 -0.042 18 HG3 MET 3 HG1 MET 3 -32.001 23.915 -0.038 19 HE1 MET 3 HE1 MET 3 -30.909 22.427 -1.969 20 HE2 MET 3 HE2 MET 3 -31.792 21.874 -3.393 21 HE3 MET 3 HE3 MET 3 -32.191 21.228 -1.803 22 H ALA 4 HN ALA 4 -32.187 20.332 1.818 23 HA ALA 4 HA ALA 4 -33.842 18.995 3.819 24 HB1 ALA 4 HB1 ALA 4 -34.170 17.042 2.371 25 HB2 ALA 4 HB2 ALA 4 -33.392 17.902 1.042 26 HB3 ALA 4 HB3 ALA 4 -34.925 18.485 1.692 27 H MET 5 HN MET 5 -32.823 17.217 4.800 28 HA MET 5 HA MET 5 -29.924 17.135 4.364 29 HB2 MET 5 HB2 MET 5 -31.639 16.407 6.728 30 HB3 MET 5 HB1 MET 5 -29.955 15.920 6.617 31 HG2 MET 5 HG2 MET 5 -30.996 18.743 6.610 32 HG3 MET 5 HG1 MET 5 -30.189 17.926 7.948 33 HE1 MET 5 HE1 MET 5 -29.165 20.729 7.032 34 HE2 MET 5 HE2 MET 5 -27.426 20.455 6.956 35 HE3 MET 5 HE3 MET 5 -28.372 19.754 8.268 36 H LEU 6 HN LEU 6 -29.383 15.612 2.953 37 HA LEU 6 HA LEU 6 -30.940 13.202 2.645 38 HB2 LEU 6 HB2 LEU 6 -28.430 14.197 1.293 39 HB3 LEU 6 HB1 LEU 6 -29.125 12.626 0.957 40 HG LEU 6 HG LEU 6 -29.796 14.113 -0.780 41 HD11 LEU 6 HD11 LEU 6 -31.488 12.531 -0.008 42 HD12 LEU 6 HD12 LEU 6 -32.209 14.012 -0.636 43 HD13 LEU 6 HD13 LEU 6 -32.115 13.748 1.104 44 HD21 LEU 6 HD21 LEU 6 -31.045 16.173 -0.370 45 HD22 LEU 6 HD22 LEU 6 -29.434 16.238 0.343 46 HD23 LEU 6 HD23 LEU 6 -30.841 15.951 1.366 47 H ALA 7 HN ALA 7 -30.722 12.088 4.555 48 HA ALA 7 HA ALA 7 -28.202 11.490 5.736 49 HB1 ALA 7 HB1 ALA 7 -30.283 11.565 7.028 50 HB2 ALA 7 HB2 ALA 7 -29.455 10.017 7.199 51 HB3 ALA 7 HB3 ALA 7 -30.868 10.150 6.153 52 H ARG 8 HN ARG 8 -26.759 10.281 4.682 53 HA ARG 8 HA ARG 8 -27.506 7.619 3.838 54 HB2 ARG 8 HB2 ARG 8 -27.959 8.962 1.833 55 HB3 ARG 8 HB1 ARG 8 -26.318 9.588 1.882 56 HG2 ARG 8 HG2 ARG 8 -25.412 7.419 1.407 57 HG3 ARG 8 HG1 ARG 8 -27.009 6.678 1.539 58 HD2 ARG 8 HD2 ARG 8 -26.151 8.710 -0.517 59 HD3 ARG 8 HD1 ARG 8 -26.382 6.984 -0.797 60 HE ARG 8 HE ARG 8 -28.781 7.579 0.055 61 HH11 ARG 8 HH11 ARG 8 -26.753 9.432 -2.112 62 HH12 ARG 8 HH12 ARG 8 -28.087 10.196 -2.912 63 HH21 ARG 8 HH21 ARG 8 -30.542 8.589 -0.990 64 HH22 ARG 8 HH22 ARG 8 -30.244 9.721 -2.272 65 H ARG 9 HN ARG 9 -26.113 6.639 5.163 66 HA ARG 9 HA ARG 9 -23.324 7.511 5.189 67 HB2 ARG 9 HB2 ARG 9 -24.848 5.567 6.916 68 HB3 ARG 9 HB1 ARG 9 -23.110 5.795 7.026 69 HG2 ARG 9 HG2 ARG 9 -23.499 8.183 7.537 70 HG3 ARG 9 HG1 ARG 9 -25.234 7.859 7.547 71 HD2 ARG 9 HD2 ARG 9 -24.342 7.842 9.807 72 HD3 ARG 9 HD1 ARG 9 -24.920 6.240 9.350 73 HE ARG 9 HE ARG 9 -22.145 6.507 8.799 74 HH11 ARG 9 HH11 ARG 9 -24.420 6.038 11.421 75 HH12 ARG 9 HH12 ARG 9 -23.272 5.225 12.442 76 HH21 ARG 9 HH21 ARG 9 -20.629 5.449 10.147 77 HH22 ARG 9 HH22 ARG 9 -21.125 4.889 11.712 78 H GLN 10 HN GLN 10 -21.650 5.802 5.138 79 HA GLN 10 HA GLN 10 -20.494 4.312 3.888 80 HB2 GLN 10 HB2 GLN 10 -23.072 2.767 4.190 81 HB3 GLN 10 HB1 GLN 10 -21.585 2.083 3.551 82 HG2 GLN 10 HG2 GLN 10 -20.469 2.641 5.690 83 HG3 GLN 10 HG1 GLN 10 -22.027 3.171 6.320 84 HE21 GLN 10 HE21 GLN 10 -20.247 1.026 7.199 85 HE22 GLN 10 HE22 GLN 10 -21.195 -0.418 7.168 86 H ARG 11 HN ARG 11 -21.560 6.355 2.413 87 HA ARG 11 HA ARG 11 -22.893 5.379 0.079 88 HB2 ARG 11 HB2 ARG 11 -23.142 7.715 0.844 89 HB3 ARG 11 HB1 ARG 11 -21.435 7.994 0.530 90 HG2 ARG 11 HG2 ARG 11 -21.800 7.572 -1.847 91 HG3 ARG 11 HG1 ARG 11 -23.512 7.292 -1.533 92 HD2 ARG 11 HD2 ARG 11 -23.124 9.552 -2.373 93 HD3 ARG 11 HD1 ARG 11 -23.747 9.582 -0.725 94 HE ARG 11 HE ARG 11 -20.971 9.641 -0.564 95 HH11 ARG 11 HH11 ARG 11 -23.538 11.667 -1.806 96 HH12 ARG 11 HH12 ARG 11 -22.677 13.146 -1.529 97 HH21 ARG 11 HH21 ARG 11 -19.835 11.580 -0.190 98 HH22 ARG 11 HH22 ARG 11 -20.562 13.096 -0.626 99 H ASP 12 HN ASP 12 -21.730 3.781 -0.838 100 HA ASP 12 HA ASP 12 -20.108 2.669 -1.977 101 HB2 ASP 12 HB2 ASP 12 -20.479 4.760 -3.453 102 HB3 ASP 12 HB1 ASP 12 -18.940 5.317 -2.804 103 HA PRO 13 HA PRO 13 -17.165 3.389 1.566 104 HB2 PRO 13 HB2 PRO 13 -17.206 0.427 1.489 105 HB3 PRO 13 HB1 PRO 13 -17.395 1.515 2.868 106 HG2 PRO 13 HG2 PRO 13 -19.484 0.177 1.876 107 HG3 PRO 13 HG1 PRO 13 -19.656 1.840 2.471 108 HD2 PRO 13 HD2 PRO 13 -19.474 0.841 -0.346 109 HD3 PRO 13 HD1 PRO 13 -20.505 2.119 0.335 110 H LEU 14 HN LEU 14 -17.099 1.305 -1.252 111 HA LEU 14 HA LEU 14 -14.355 0.642 -1.203 112 HB2 LEU 14 HB2 LEU 14 -16.131 0.964 -3.630 113 HB3 LEU 14 HB1 LEU 14 -14.583 0.130 -3.585 114 HG LEU 14 HG LEU 14 -17.126 -0.727 -2.195 115 HD11 LEU 14 HD11 LEU 14 -17.013 -2.634 -3.699 116 HD12 LEU 14 HD12 LEU 14 -15.565 -1.970 -4.450 117 HD13 LEU 14 HD13 LEU 14 -17.105 -1.124 -4.603 118 HD21 LEU 14 HD21 LEU 14 -15.260 -1.291 -0.782 119 HD22 LEU 14 HD22 LEU 14 -14.372 -1.952 -2.154 120 HD23 LEU 14 HD23 LEU 14 -15.836 -2.752 -1.585 121 H GLN 15 HN GLN 15 -16.107 3.302 -2.789 122 HA GLN 15 HA GLN 15 -13.888 4.507 -4.003 123 HB2 GLN 15 HB2 GLN 15 -16.204 5.128 -4.531 124 HB3 GLN 15 HB1 GLN 15 -16.394 5.819 -2.926 125 HG2 GLN 15 HG2 GLN 15 -14.556 7.416 -3.485 126 HG3 GLN 15 HG1 GLN 15 -14.602 6.797 -5.135 127 HE21 GLN 15 HE21 GLN 15 -17.509 6.428 -5.044 128 HE22 GLN 15 HE22 GLN 15 -18.192 8.011 -5.177 129 H ALA 16 HN ALA 16 -15.301 5.044 -0.784 130 HA ALA 16 HA ALA 16 -13.580 7.148 -0.032 131 HB1 ALA 16 HB1 ALA 16 -15.002 5.170 1.746 132 HB2 ALA 16 HB2 ALA 16 -15.696 6.662 1.113 133 HB3 ALA 16 HB3 ALA 16 -14.339 6.729 2.237 134 H LEU 17 HN LEU 17 -13.444 3.661 0.600 135 HA LEU 17 HA LEU 17 -10.987 3.708 1.979 136 HB2 LEU 17 HB2 LEU 17 -12.624 1.827 1.985 137 HB3 LEU 17 HB1 LEU 17 -12.142 1.450 0.343 138 HG LEU 17 HG LEU 17 -9.894 0.892 1.091 139 HD11 LEU 17 HD11 LEU 17 -9.659 2.457 2.923 140 HD12 LEU 17 HD12 LEU 17 -9.361 0.813 3.488 141 HD13 LEU 17 HD13 LEU 17 -10.897 1.602 3.843 142 HD21 LEU 17 HD21 LEU 17 -10.433 -1.093 2.418 143 HD22 LEU 17 HD22 LEU 17 -11.579 -0.863 1.097 144 HD23 LEU 17 HD23 LEU 17 -12.035 -0.434 2.746 145 H ARG 18 HN ARG 18 -11.790 3.439 -1.434 146 HA ARG 18 HA ARG 18 -9.245 2.841 -2.438 147 HB2 ARG 18 HB2 ARG 18 -11.425 2.825 -3.717 148 HB3 ARG 18 HB1 ARG 18 -11.309 4.577 -3.799 149 HG2 ARG 18 HG2 ARG 18 -9.180 4.361 -5.007 150 HG3 ARG 18 HG1 ARG 18 -9.353 2.606 -4.960 151 HD2 ARG 18 HD2 ARG 18 -10.104 3.397 -7.099 152 HD3 ARG 18 HD1 ARG 18 -11.499 2.836 -6.180 153 HE ARG 18 HE ARG 18 -10.854 5.693 -6.168 154 HH11 ARG 18 HH11 ARG 18 -12.972 3.087 -7.151 155 HH12 ARG 18 HH12 ARG 18 -14.243 4.144 -7.673 156 HH21 ARG 18 HH21 ARG 18 -12.540 7.097 -6.847 157 HH22 ARG 18 HH22 ARG 18 -14.003 6.419 -7.490 158 H ARG 19 HN ARG 19 -10.711 5.891 -1.474 159 HA ARG 19 HA ARG 19 -8.699 7.607 -2.452 160 HB2 ARG 19 HB2 ARG 19 -10.479 7.926 -0.024 161 HB3 ARG 19 HB1 ARG 19 -9.534 9.213 -0.757 162 HG2 ARG 19 HG2 ARG 19 -11.801 7.718 -2.056 163 HG3 ARG 19 HG1 ARG 19 -11.865 9.353 -1.405 164 HD2 ARG 19 HD2 ARG 19 -10.202 8.403 -3.732 165 HD3 ARG 19 HD1 ARG 19 -11.633 9.430 -3.810 166 HE ARG 19 HE ARG 19 -9.780 10.688 -2.150 167 HH11 ARG 19 HH11 ARG 19 -10.142 9.810 -5.517 168 HH12 ARG 19 HH12 ARG 19 -9.098 11.070 -6.091 169 HH21 ARG 19 HH21 ARG 19 -8.406 12.346 -2.896 170 HH22 ARG 19 HH22 ARG 19 -8.110 12.516 -4.598 171 H ARG 20 HN ARG 20 -9.079 5.849 0.574 172 HA ARG 20 HA ARG 20 -6.730 6.812 1.823 173 HB2 ARG 20 HB2 ARG 20 -8.598 5.744 3.043 174 HB3 ARG 20 HB1 ARG 20 -8.211 4.211 2.276 175 HG2 ARG 20 HG2 ARG 20 -6.043 4.189 3.389 176 HG3 ARG 20 HG1 ARG 20 -6.404 5.748 4.127 177 HD2 ARG 20 HD2 ARG 20 -8.261 4.775 5.349 178 HD3 ARG 20 HD1 ARG 20 -7.993 3.218 4.562 179 HE ARG 20 HE ARG 20 -5.645 4.107 5.900 180 HH11 ARG 20 HH11 ARG 20 -8.806 2.741 6.543 181 HH12 ARG 20 HH12 ARG 20 -8.287 1.886 7.963 182 HH21 ARG 20 HH21 ARG 20 -4.963 2.980 7.764 183 HH22 ARG 20 HH22 ARG 20 -6.105 2.019 8.651 184 H ASN 21 HN ASN 21 -7.410 3.956 -0.174 185 HA ASN 21 HA ASN 21 -4.807 2.851 -0.037 186 HB2 ASN 21 HB2 ASN 21 -6.982 2.550 -2.118 187 HB3 ASN 21 HB1 ASN 21 -5.459 1.675 -2.184 188 HD21 ASN 21 HD21 ASN 21 -8.152 0.638 -1.946 189 HD22 ASN 21 HD22 ASN 21 -8.178 -0.286 -0.488 190 H GLN 22 HN GLN 22 -6.290 5.154 -2.280 191 HA GLN 22 HA GLN 22 -4.162 5.349 -4.102 192 HB2 GLN 22 HB2 GLN 22 -6.403 6.246 -4.560 193 HB3 GLN 22 HB1 GLN 22 -6.182 7.455 -3.303 194 HG2 GLN 22 HG2 GLN 22 -4.265 8.364 -4.598 195 HG3 GLN 22 HG1 GLN 22 -4.656 7.227 -5.887 196 HE21 GLN 22 HE21 GLN 22 -4.627 10.137 -5.948 197 HE22 GLN 22 HE22 GLN 22 -6.219 10.630 -6.401 198 H GLU 23 HN GLU 23 -4.698 6.749 -0.974 199 HA GLU 23 HA GLU 23 -2.779 8.832 -1.128 200 HB2 GLU 23 HB2 GLU 23 -4.641 8.701 0.534 201 HB3 GLU 23 HB1 GLU 23 -3.805 7.367 1.312 202 HG2 GLU 23 HG2 GLU 23 -1.923 8.843 1.810 203 HG3 GLU 23 HG1 GLU 23 -2.782 10.181 1.044 204 H LEU 24 HN LEU 24 -2.730 5.542 0.218 205 HA LEU 24 HA LEU 24 0.016 5.561 0.909 206 HB2 LEU 24 HB2 LEU 24 -1.825 3.251 0.295 207 HB3 LEU 24 HB1 LEU 24 -0.198 3.074 0.917 208 HG LEU 24 HG LEU 24 -2.503 4.401 2.349 209 HD11 LEU 24 HD11 LEU 24 -2.283 2.501 3.880 210 HD12 LEU 24 HD12 LEU 24 -1.048 1.807 2.832 211 HD13 LEU 24 HD13 LEU 24 -2.704 1.984 2.247 212 HD21 LEU 24 HD21 LEU 24 -0.955 4.496 4.261 213 HD22 LEU 24 HD22 LEU 24 -0.411 5.496 2.914 214 HD23 LEU 24 HD23 LEU 24 0.349 3.933 3.216 215 H LYS 25 HN LYS 25 -1.731 4.630 -2.007 216 HA LYS 25 HA LYS 25 0.363 3.413 -3.390 217 HB2 LYS 25 HB2 LYS 25 -1.999 3.378 -4.118 218 HB3 LYS 25 HB1 LYS 25 -1.885 5.081 -4.536 219 HG2 LYS 25 HG2 LYS 25 -0.172 4.539 -6.210 220 HG3 LYS 25 HG1 LYS 25 -0.335 2.831 -5.801 221 HD2 LYS 25 HD2 LYS 25 -2.675 2.883 -6.483 222 HD3 LYS 25 HD1 LYS 25 -2.531 4.599 -6.871 223 HE2 LYS 25 HE2 LYS 25 -0.838 4.072 -8.556 224 HE3 LYS 25 HE1 LYS 25 -0.988 2.359 -8.170 225 HZ1 LYS 25 HZ1 LYS 25 -2.261 2.914 -10.127 226 HZ2 LYS 25 HZ2 LYS 25 -3.131 4.087 -9.276 227 HZ3 LYS 25 HZ3 LYS 25 -3.303 2.453 -8.878 228 H GLN 26 HN GLN 26 -0.599 6.820 -3.239 229 HA GLN 26 HA GLN 26 1.369 7.781 -5.020 230 HB2 GLN 26 HB2 GLN 26 -0.669 9.043 -4.327 231 HB3 GLN 26 HB1 GLN 26 0.053 9.269 -2.741 232 HG2 GLN 26 HG2 GLN 26 0.368 11.259 -4.022 233 HG3 GLN 26 HG1 GLN 26 1.930 10.470 -3.811 234 HE21 GLN 26 HE21 GLN 26 1.079 12.391 -5.813 235 HE22 GLN 26 HE22 GLN 26 1.326 11.637 -7.348 236 H GLN 27 HN GLN 27 1.364 7.083 -1.592 237 HA GLN 27 HA GLN 27 3.827 8.387 -1.013 238 HB2 GLN 27 HB2 GLN 27 2.268 6.259 0.452 239 HB3 GLN 27 HB1 GLN 27 3.747 6.978 1.080 240 HG2 GLN 27 HG2 GLN 27 2.690 9.177 1.075 241 HG3 GLN 27 HG1 GLN 27 1.217 8.470 0.418 242 HE21 GLN 27 HE21 GLN 27 3.188 6.914 2.855 243 HE22 GLN 27 HE22 GLN 27 2.054 7.070 4.144 244 H VAL 28 HN VAL 28 2.908 5.185 -2.120 245 HA VAL 28 HA VAL 28 5.444 3.958 -1.742 246 HB VAL 28 HB VAL 28 3.204 3.261 -3.657 247 HG11 VAL 28 HG11 VAL 28 5.308 2.357 -4.461 248 HG12 VAL 28 HG12 VAL 28 4.290 1.064 -3.827 249 HG13 VAL 28 HG13 VAL 28 5.641 1.670 -2.872 250 HG21 VAL 28 HG21 VAL 28 2.682 1.496 -2.041 251 HG22 VAL 28 HG22 VAL 28 2.561 3.094 -1.303 252 HG23 VAL 28 HG23 VAL 28 3.970 2.079 -0.987 253 H ASP 29 HN ASP 29 3.854 5.503 -4.535 254 HA ASP 29 HA ASP 29 5.954 5.274 -6.370 255 HB2 ASP 29 HB2 ASP 29 3.775 7.336 -6.064 256 HB3 ASP 29 HB1 ASP 29 4.982 7.460 -7.339 257 H SER 30 HN SER 30 5.382 7.596 -3.804 258 HA SER 30 HA SER 30 7.478 9.374 -4.500 259 HB2 SER 30 HB2 SER 30 6.160 8.924 -1.810 260 HB3 SER 30 HB1 SER 30 7.137 10.320 -2.258 261 HG SER 30 HG SER 30 4.681 9.526 -3.466 262 H LEU 31 HN LEU 31 7.271 6.567 -2.379 263 HA LEU 31 HA LEU 31 9.829 6.775 -1.216 264 HB2 LEU 31 HB2 LEU 31 7.892 5.304 -0.479 265 HB3 LEU 31 HB1 LEU 31 8.311 4.226 -1.790 266 HG LEU 31 HG LEU 31 9.113 3.530 0.488 267 HD11 LEU 31 HD11 LEU 31 11.365 2.869 -0.253 268 HD12 LEU 31 HD12 LEU 31 11.203 3.948 -1.639 269 HD13 LEU 31 HD13 LEU 31 10.126 2.561 -1.469 270 HD21 LEU 31 HD21 LEU 31 11.052 5.807 0.138 271 HD22 LEU 31 HD22 LEU 31 11.052 4.611 1.434 272 HD23 LEU 31 HD23 LEU 31 9.724 5.761 1.296 273 H LEU 32 HN LEU 32 8.636 4.944 -4.012 274 HA LEU 32 HA LEU 32 11.056 3.840 -4.828 275 HB2 LEU 32 HB2 LEU 32 8.667 4.673 -6.475 276 HB3 LEU 32 HB1 LEU 32 9.953 3.623 -7.037 277 HG LEU 32 HG LEU 32 8.099 2.995 -4.741 278 HD11 LEU 32 HD11 LEU 32 7.085 1.378 -6.271 279 HD12 LEU 32 HD12 LEU 32 8.115 1.969 -7.574 280 HD13 LEU 32 HD13 LEU 32 6.902 3.031 -6.858 281 HD21 LEU 32 HD21 LEU 32 9.032 0.731 -4.949 282 HD22 LEU 32 HD22 LEU 32 10.252 1.920 -4.496 283 HD23 LEU 32 HD23 LEU 32 10.173 1.327 -6.155 284 H SER 33 HN SER 33 9.630 6.988 -5.462 285 HA SER 33 HA SER 33 11.360 7.827 -7.503 286 HB2 SER 33 HB2 SER 33 9.256 8.996 -6.897 287 HB3 SER 33 HB1 SER 33 10.005 9.532 -5.394 288 HG SER 33 HG SER 33 10.716 10.225 -8.052 289 H GLU 34 HN GLU 34 11.647 7.968 -3.972 290 HA GLU 34 HA GLU 34 14.082 9.504 -4.074 291 HB2 GLU 34 HB2 GLU 34 12.801 8.033 -1.766 292 HB3 GLU 34 HB1 GLU 34 14.149 9.157 -1.648 293 HG2 GLU 34 HG2 GLU 34 12.703 10.944 -2.525 294 HG3 GLU 34 HG1 GLU 34 11.355 9.808 -2.548 295 H SER 35 HN SER 35 13.116 6.173 -3.797 296 HA SER 35 HA SER 35 15.671 5.111 -3.134 297 HB2 SER 35 HB2 SER 35 13.547 3.926 -2.660 298 HB3 SER 35 HB1 SER 35 13.277 3.739 -4.391 299 HG SER 35 HG SER 35 15.731 2.842 -3.723 300 H GLN 36 HN GLN 36 14.548 6.518 -5.937 301 HA GLN 36 HA GLN 36 16.004 4.733 -7.742 302 HB2 GLN 36 HB2 GLN 36 13.637 5.378 -8.265 303 HB3 GLN 36 HB1 GLN 36 14.161 7.050 -8.382 304 HG2 GLN 36 HG2 GLN 36 15.690 6.364 -10.221 305 HG3 GLN 36 HG1 GLN 36 14.962 4.760 -10.156 306 HE21 GLN 36 HE21 GLN 36 12.827 4.487 -10.828 307 HE22 GLN 36 HE22 GLN 36 12.018 5.676 -11.789 308 H LEU 37 HN LEU 37 16.340 7.514 -5.943 309 HA LEU 37 HA LEU 37 17.896 9.116 -7.713 310 HB2 LEU 37 HB2 LEU 37 17.723 9.131 -4.698 311 HB3 LEU 37 HB1 LEU 37 18.481 10.375 -5.671 312 HG LEU 37 HG LEU 37 15.544 9.688 -5.773 313 HD11 LEU 37 HD11 LEU 37 16.136 10.612 -3.604 314 HD12 LEU 37 HD12 LEU 37 15.213 11.780 -4.550 315 HD13 LEU 37 HD13 LEU 37 16.960 11.959 -4.389 316 HD21 LEU 37 HD21 LEU 37 15.393 11.870 -6.939 317 HD22 LEU 37 HD22 LEU 37 16.282 10.648 -7.843 318 HD23 LEU 37 HD23 LEU 37 17.155 11.921 -6.991 319 H LYS 38 HN LYS 38 20.051 9.199 -7.977 320 HA LYS 38 HA LYS 38 21.603 6.916 -7.273 321 HB2 LYS 38 HB2 LYS 38 22.622 9.537 -8.376 322 HB3 LYS 38 HB1 LYS 38 23.378 7.955 -8.518 323 HG2 LYS 38 HG2 LYS 38 21.423 7.216 -9.873 324 HG3 LYS 38 HG1 LYS 38 20.832 8.878 -9.838 325 HD2 LYS 38 HD2 LYS 38 22.981 9.593 -10.871 326 HD3 LYS 38 HD1 LYS 38 23.421 7.894 -11.025 327 HE2 LYS 38 HE2 LYS 38 21.070 9.278 -12.299 328 HE3 LYS 38 HE1 LYS 38 22.517 8.692 -13.114 329 HZ1 LYS 38 HZ1 LYS 38 20.443 7.042 -11.779 330 HZ2 LYS 38 HZ2 LYS 38 21.887 6.428 -12.409 331 HZ3 LYS 38 HZ3 LYS 38 20.752 7.138 -13.440 332 H GLU 39 HN GLU 39 21.193 10.130 -6.027 333 HA GLU 39 HA GLU 39 23.411 10.153 -4.256 334 HB2 GLU 39 HB2 GLU 39 20.832 11.707 -4.350 335 HB3 GLU 39 HB1 GLU 39 21.981 11.916 -3.039 336 HG2 GLU 39 HG2 GLU 39 22.248 13.633 -4.729 337 HG3 GLU 39 HG1 GLU 39 23.687 12.623 -4.618 338 H ALA 40 HN ALA 40 20.459 8.482 -4.230 339 HA ALA 40 HA ALA 40 20.169 8.334 -1.374 340 HB1 ALA 40 HB1 ALA 40 18.294 6.848 -1.848 341 HB2 ALA 40 HB2 ALA 40 18.736 6.846 -3.557 342 HB3 ALA 40 HB3 ALA 40 18.202 8.338 -2.786 343 H LEU 41 HN LEU 41 22.262 6.905 -3.466 344 HA LEU 41 HA LEU 41 22.329 4.277 -2.331 345 HB2 LEU 41 HB2 LEU 41 23.221 4.825 -4.590 346 HB3 LEU 41 HB1 LEU 41 24.503 5.746 -3.828 347 HG LEU 41 HG LEU 41 25.316 3.679 -2.741 348 HD11 LEU 41 HD11 LEU 41 23.175 2.350 -4.390 349 HD12 LEU 41 HD12 LEU 41 23.252 2.433 -2.629 350 HD13 LEU 41 HD13 LEU 41 24.462 1.513 -3.523 351 HD21 LEU 41 HD21 LEU 41 26.283 4.406 -4.856 352 HD22 LEU 41 HD22 LEU 41 25.052 3.506 -5.740 353 HD23 LEU 41 HD23 LEU 41 26.237 2.647 -4.757 354 H GLU 42 HN GLU 42 23.245 7.321 -1.280 355 HA GLU 42 HA GLU 42 25.413 6.845 0.415 356 HB2 GLU 42 HB2 GLU 42 24.756 9.094 0.084 357 HB3 GLU 42 HB1 GLU 42 23.081 8.753 0.486 358 HG2 GLU 42 HG2 GLU 42 24.159 10.054 2.219 359 HG3 GLU 42 HG1 GLU 42 23.683 8.472 2.823 360 HA PRO 43 HA PRO 43 23.615 3.648 2.991 361 HB2 PRO 43 HB2 PRO 43 25.794 4.579 4.803 362 HB3 PRO 43 HB1 PRO 43 25.368 2.939 4.300 363 HG2 PRO 43 HG2 PRO 43 27.468 4.180 3.240 364 HG3 PRO 43 HG1 PRO 43 26.422 3.147 2.249 365 HD2 PRO 43 HD2 PRO 43 26.600 6.123 2.362 366 HD3 PRO 43 HD1 PRO 43 26.248 5.060 0.983 367 H ASN 44 HN ASN 44 24.333 6.907 4.176 368 HA ASN 44 HA ASN 44 22.858 6.621 6.601 369 HB2 ASN 44 HB2 ASN 44 23.589 9.146 5.091 370 HB3 ASN 44 HB1 ASN 44 22.927 9.098 6.723 371 HD21 ASN 44 HD21 ASN 44 25.420 10.249 5.904 372 HD22 ASN 44 HD22 ASN 44 26.670 9.397 6.738 373 H LYS 45 HN LYS 45 22.046 8.129 3.457 374 HA LYS 45 HA LYS 45 19.353 8.658 4.125 375 HB2 LYS 45 HB2 LYS 45 20.550 9.813 2.312 376 HB3 LYS 45 HB1 LYS 45 20.672 8.305 1.423 377 HG2 LYS 45 HG2 LYS 45 18.917 9.607 0.461 378 HG3 LYS 45 HG1 LYS 45 18.191 8.237 1.301 379 HD2 LYS 45 HD2 LYS 45 16.836 10.004 1.941 380 HD3 LYS 45 HD1 LYS 45 17.962 9.877 3.289 381 HE2 LYS 45 HE2 LYS 45 18.219 11.811 0.987 382 HE3 LYS 45 HE1 LYS 45 17.556 12.211 2.568 383 HZ1 LYS 45 HZ1 LYS 45 19.804 12.916 2.504 384 HZ2 LYS 45 HZ2 LYS 45 20.344 11.426 1.935 385 HZ3 LYS 45 HZ3 LYS 45 19.747 11.562 3.512 386 H ARG 46 HN ARG 46 20.996 6.006 2.531 387 HA ARG 46 HA ARG 46 18.838 4.491 1.667 388 HB2 ARG 46 HB2 ARG 46 21.158 4.032 1.069 389 HB3 ARG 46 HB1 ARG 46 21.525 3.606 2.732 390 HG2 ARG 46 HG2 ARG 46 20.057 1.676 2.575 391 HG3 ARG 46 HG1 ARG 46 19.652 2.115 0.912 392 HD2 ARG 46 HD2 ARG 46 21.978 1.858 0.258 393 HD3 ARG 46 HD1 ARG 46 22.420 1.480 1.921 394 HE ARG 46 HE ARG 46 20.750 -0.467 1.543 395 HH11 ARG 46 HH11 ARG 46 22.963 0.856 -0.812 396 HH12 ARG 46 HH12 ARG 46 23.203 -0.652 -1.639 397 HH21 ARG 46 HH21 ARG 46 21.030 -2.450 0.451 398 HH22 ARG 46 HH22 ARG 46 22.082 -2.530 -0.937 399 H GLN 47 HN GLN 47 20.389 4.641 4.830 400 HA GLN 47 HA GLN 47 18.946 2.598 6.100 401 HB2 GLN 47 HB2 GLN 47 20.969 3.588 7.045 402 HB3 GLN 47 HB1 GLN 47 20.150 5.130 7.230 403 HG2 GLN 47 HG2 GLN 47 20.290 4.020 9.351 404 HG3 GLN 47 HG1 GLN 47 18.607 4.099 8.835 405 HE21 GLN 47 HE21 GLN 47 17.535 2.216 8.281 406 HE22 GLN 47 HE22 GLN 47 18.161 0.649 8.666 407 H HIS 48 HN HIS 48 18.308 6.027 5.645 408 HA HIS 48 HA HIS 48 15.994 6.120 7.299 409 HB2 HIS 48 HB2 HIS 48 17.489 8.085 6.543 410 HB3 HIS 48 HB1 HIS 48 16.596 8.029 5.029 411 HD1 HIS 48 HD1 HIS 48 16.359 9.163 8.538 412 HD2 HIS 48 HD2 HIS 48 13.853 8.811 5.244 413 HE1 HIS 48 HE1 HIS 48 14.333 10.545 9.079 414 HE2 HIS 48 HE2 HIS 48 12.753 10.133 7.173 415 H ILE 49 HN ILE 49 16.560 5.590 3.854 416 HA ILE 49 HA ILE 49 13.857 5.657 3.030 417 HB ILE 49 HB ILE 49 16.239 4.248 1.815 418 HG12 ILE 49 HG12 ILE 49 14.821 6.827 1.102 419 HG13 ILE 49 HG11 ILE 49 16.395 6.699 1.881 420 HG21 ILE 49 HG21 ILE 49 14.196 3.135 1.107 421 HG22 ILE 49 HG22 ILE 49 14.897 4.049 -0.228 422 HG23 ILE 49 HG23 ILE 49 13.496 4.684 0.635 423 HD11 ILE 49 HD11 ILE 49 17.300 5.638 -0.117 424 HD12 ILE 49 HD12 ILE 49 16.604 7.218 -0.483 425 HD13 ILE 49 HD13 ILE 49 15.720 5.748 -0.894 426 H TYR 50 HN TYR 50 15.983 2.936 3.946 427 HA TYR 50 HA TYR 50 14.214 0.851 3.734 428 HB2 TYR 50 HB2 TYR 50 16.565 0.541 4.315 429 HB3 TYR 50 HB1 TYR 50 16.313 1.330 5.865 430 HD1 TYR 50 HD1 TYR 50 16.360 -0.132 7.666 431 HD2 TYR 50 HD2 TYR 50 14.697 -1.475 3.984 432 HE1 TYR 50 HE1 TYR 50 15.852 -2.310 8.691 433 HE2 TYR 50 HE2 TYR 50 14.195 -3.654 5.000 434 HH TYR 50 HH TYR 50 15.003 -5.037 6.883 435 H GLN 51 HN GLN 51 14.486 3.189 6.382 436 HA GLN 51 HA GLN 51 12.632 1.917 8.106 437 HB2 GLN 51 HB2 GLN 51 14.255 3.705 8.809 438 HB3 GLN 51 HB1 GLN 51 13.254 4.875 7.957 439 HG2 GLN 51 HG2 GLN 51 12.728 4.948 10.294 440 HG3 GLN 51 HG1 GLN 51 11.358 4.271 9.417 441 HE21 GLN 51 HE21 GLN 51 10.523 3.182 11.153 442 HE22 GLN 51 HE22 GLN 51 11.292 1.807 11.867 443 H ARG 52 HN ARG 52 12.269 4.530 5.726 444 HA ARG 52 HA ARG 52 9.518 4.959 6.116 445 HB2 ARG 52 HB2 ARG 52 11.300 5.429 3.733 446 HB3 ARG 52 HB1 ARG 52 9.601 5.872 3.741 447 HG2 ARG 52 HG2 ARG 52 9.999 7.366 5.637 448 HG3 ARG 52 HG1 ARG 52 11.709 6.922 5.617 449 HD2 ARG 52 HD2 ARG 52 11.970 7.839 3.407 450 HD3 ARG 52 HD1 ARG 52 10.240 8.157 3.294 451 HE ARG 52 HE ARG 52 11.055 9.561 5.498 452 HH11 ARG 52 HH11 ARG 52 11.989 9.458 2.133 453 HH12 ARG 52 HH12 ARG 52 12.467 11.119 2.071 454 HH21 ARG 52 HH21 ARG 52 11.679 11.778 5.426 455 HH22 ARG 52 HH22 ARG 52 12.290 12.440 3.943 456 H CYS 53 HN CYS 53 11.278 2.675 4.155 457 HA CYS 53 HA CYS 53 9.102 1.760 2.592 458 HB2 CYS 53 HB2 CYS 53 11.506 1.279 2.084 459 HB3 CYS 53 HB1 CYS 53 11.534 0.164 3.452 460 HG CYS 53 HG CYS 53 10.364 -0.282 0.360 461 H ILE 54 HN ILE 54 10.498 0.617 5.643 462 HA ILE 54 HA ILE 54 8.719 -1.463 6.170 463 HB ILE 54 HB ILE 54 10.152 0.360 8.100 464 HG12 ILE 54 HG12 ILE 54 10.781 -2.443 7.140 465 HG13 ILE 54 HG11 ILE 54 11.616 -0.977 6.626 466 HG21 ILE 54 HG21 ILE 54 9.739 -1.341 9.803 467 HG22 ILE 54 HG22 ILE 54 8.771 -2.262 8.651 468 HG23 ILE 54 HG23 ILE 54 8.229 -0.670 9.187 469 HD11 ILE 54 HD11 ILE 54 12.403 -0.628 8.906 470 HD12 ILE 54 HD12 ILE 54 12.897 -2.203 8.285 471 HD13 ILE 54 HD13 ILE 54 11.556 -2.084 9.423 472 H GLN 55 HN GLN 55 8.491 1.981 6.978 473 HA GLN 55 HA GLN 55 6.169 1.835 8.543 474 HB2 GLN 55 HB2 GLN 55 7.173 4.103 6.817 475 HB3 GLN 55 HB1 GLN 55 5.908 4.254 8.026 476 HG2 GLN 55 HG2 GLN 55 8.760 3.458 8.568 477 HG3 GLN 55 HG1 GLN 55 8.076 5.061 8.826 478 HE21 GLN 55 HE21 GLN 55 5.531 4.013 9.797 479 HE22 GLN 55 HE22 GLN 55 5.838 3.416 11.390 480 H LEU 56 HN LEU 56 6.493 2.679 5.091 481 HA LEU 56 HA LEU 56 3.780 2.802 4.509 482 HB2 LEU 56 HB2 LEU 56 5.976 1.897 2.646 483 HB3 LEU 56 HB1 LEU 56 4.414 2.528 2.171 484 HG LEU 56 HG LEU 56 6.597 4.069 3.579 485 HD11 LEU 56 HD11 LEU 56 7.102 3.568 1.251 486 HD12 LEU 56 HD12 LEU 56 6.778 5.286 1.481 487 HD13 LEU 56 HD13 LEU 56 5.549 4.245 0.761 488 HD21 LEU 56 HD21 LEU 56 4.412 4.867 4.269 489 HD22 LEU 56 HD22 LEU 56 3.897 4.977 2.586 490 HD23 LEU 56 HD23 LEU 56 5.176 6.031 3.188 491 H LYS 57 HN LYS 57 5.952 0.030 4.563 492 HA LYS 57 HA LYS 57 4.193 -1.806 3.340 493 HB2 LYS 57 HB2 LYS 57 6.672 -2.103 3.701 494 HB3 LYS 57 HB1 LYS 57 6.326 -2.428 5.392 495 HG2 LYS 57 HG2 LYS 57 5.179 -4.434 4.868 496 HG3 LYS 57 HG1 LYS 57 5.139 -4.043 3.149 497 HD2 LYS 57 HD2 LYS 57 6.840 -5.706 3.534 498 HD3 LYS 57 HD1 LYS 57 7.616 -4.182 3.105 499 HE2 LYS 57 HE2 LYS 57 8.864 -5.096 4.896 500 HE3 LYS 57 HE1 LYS 57 7.919 -3.772 5.572 501 HZ1 LYS 57 HZ1 LYS 57 7.213 -6.651 5.738 502 HZ2 LYS 57 HZ2 LYS 57 6.332 -5.379 6.417 503 HZ3 LYS 57 HZ3 LYS 57 7.882 -5.732 6.989 504 H GLN 58 HN GLN 58 4.754 -0.923 6.716 505 HA GLN 58 HA GLN 58 2.803 -2.626 7.838 506 HB2 GLN 58 HB2 GLN 58 3.906 0.004 8.838 507 HB3 GLN 58 HB1 GLN 58 2.858 -1.044 9.779 508 HG2 GLN 58 HG2 GLN 58 4.523 -2.813 9.698 509 HG3 GLN 58 HG1 GLN 58 5.573 -1.790 8.716 510 HE21 GLN 58 HE21 GLN 58 4.301 -2.399 11.882 511 HE22 GLN 58 HE22 GLN 58 5.350 -1.321 12.735 512 H ALA 59 HN ALA 59 2.613 0.580 6.420 513 HA ALA 59 HA ALA 59 -0.006 1.184 7.311 514 HB1 ALA 59 HB1 ALA 59 0.058 2.988 5.684 515 HB2 ALA 59 HB2 ALA 59 1.491 2.283 4.937 516 HB3 ALA 59 HB3 ALA 59 1.571 2.904 6.585 517 H ILE 60 HN ILE 60 1.262 -0.236 4.311 518 HA ILE 60 HA ILE 60 -1.256 -0.476 3.027 519 HB ILE 60 HB ILE 60 1.233 -2.151 2.626 520 HG12 ILE 60 HG12 ILE 60 0.252 0.279 1.107 521 HG13 ILE 60 HG11 ILE 60 1.571 0.285 2.275 522 HG21 ILE 60 HG21 ILE 60 -1.176 -1.768 0.853 523 HG22 ILE 60 HG22 ILE 60 -0.765 -3.234 1.741 524 HG23 ILE 60 HG23 ILE 60 0.277 -2.674 0.433 525 HD11 ILE 60 HD11 ILE 60 2.437 0.238 0.023 526 HD12 ILE 60 HD12 ILE 60 1.502 -1.214 -0.332 527 HD13 ILE 60 HD13 ILE 60 2.812 -1.278 0.843 528 H ASP 61 HN ASP 61 0.645 -2.625 5.073 529 HA ASP 61 HA ASP 61 -1.030 -4.877 5.031 530 HB2 ASP 61 HB2 ASP 61 1.217 -4.974 5.989 531 HB3 ASP 61 HB1 ASP 61 0.766 -3.813 7.235 532 H GLU 62 HN GLU 62 -1.075 -1.964 6.971 533 HA GLU 62 HA GLU 62 -3.144 -2.609 8.732 534 HB2 GLU 62 HB2 GLU 62 -1.662 -0.636 8.950 535 HB3 GLU 62 HB1 GLU 62 -2.469 0.102 7.573 536 HG2 GLU 62 HG2 GLU 62 -3.364 1.083 9.528 537 HG3 GLU 62 HG1 GLU 62 -4.592 0.000 8.876 538 H ASN 63 HN ASN 63 -3.275 -0.979 5.562 539 HA ASN 63 HA ASN 63 -6.083 -0.746 5.457 540 HB2 ASN 63 HB2 ASN 63 -3.986 -0.833 3.291 541 HB3 ASN 63 HB1 ASN 63 -5.698 -0.683 2.920 542 HD21 ASN 63 HD21 ASN 63 -5.435 1.347 2.000 543 HD22 ASN 63 HD22 ASN 63 -5.099 2.753 2.953 544 H LYS 64 HN LYS 64 -3.879 -3.273 4.335 545 HA LYS 64 HA LYS 64 -5.723 -4.925 3.043 546 HB2 LYS 64 HB2 LYS 64 -3.309 -5.264 2.899 547 HB3 LYS 64 HB1 LYS 64 -3.241 -5.672 4.606 548 HG2 LYS 64 HG2 LYS 64 -4.761 -7.618 4.076 549 HG3 LYS 64 HG1 LYS 64 -4.466 -7.267 2.370 550 HD2 LYS 64 HD2 LYS 64 -2.300 -7.804 4.404 551 HD3 LYS 64 HD1 LYS 64 -2.978 -9.029 3.332 552 HE2 LYS 64 HE2 LYS 64 -1.674 -6.487 2.353 553 HE3 LYS 64 HE1 LYS 64 -0.807 -8.007 2.568 554 HZ1 LYS 64 HZ1 LYS 64 -2.325 -9.040 0.986 555 HZ2 LYS 64 HZ2 LYS 64 -1.501 -7.741 0.289 556 HZ3 LYS 64 HZ3 LYS 64 -3.116 -7.563 0.754 557 H ASN 65 HN ASN 65 -4.723 -4.880 6.455 558 HA ASN 65 HA ASN 65 -6.356 -7.086 7.203 559 HB2 ASN 65 HB2 ASN 65 -4.835 -5.004 8.732 560 HB3 ASN 65 HB1 ASN 65 -5.959 -6.063 9.574 561 HD21 ASN 65 HD21 ASN 65 -2.934 -5.827 7.923 562 HD22 ASN 65 HD22 ASN 65 -2.370 -7.418 8.303 563 H ALA 66 HN ALA 66 -6.821 -3.599 7.228 564 HA ALA 66 HA ALA 66 -9.294 -3.615 8.600 565 HB1 ALA 66 HB1 ALA 66 -7.956 -1.589 8.351 566 HB2 ALA 66 HB2 ALA 66 -9.582 -1.354 7.712 567 HB3 ALA 66 HB3 ALA 66 -8.229 -1.613 6.610 568 H LEU 67 HN LEU 67 -8.410 -3.746 5.189 569 HA LEU 67 HA LEU 67 -10.997 -3.660 4.114 570 HB2 LEU 67 HB2 LEU 67 -9.040 -3.285 2.750 571 HB3 LEU 67 HB1 LEU 67 -8.460 -4.909 3.062 572 HG LEU 67 HG LEU 67 -10.372 -5.825 1.810 573 HD11 LEU 67 HD11 LEU 67 -11.734 -4.293 0.436 574 HD12 LEU 67 HD12 LEU 67 -11.014 -2.930 1.293 575 HD13 LEU 67 HD13 LEU 67 -12.006 -4.096 2.167 576 HD21 LEU 67 HD21 LEU 67 -8.743 -3.775 0.323 577 HD22 LEU 67 HD22 LEU 67 -9.635 -5.103 -0.415 578 HD23 LEU 67 HD23 LEU 67 -8.277 -5.442 0.656 579 H GLN 68 HN GLN 68 -8.952 -6.416 5.025 580 HA GLN 68 HA GLN 68 -10.749 -8.401 4.122 581 HB2 GLN 68 HB2 GLN 68 -8.346 -8.792 4.534 582 HB3 GLN 68 HB1 GLN 68 -8.620 -8.602 6.261 583 HG2 GLN 68 HG2 GLN 68 -10.062 -10.563 6.257 584 HG3 GLN 68 HG1 GLN 68 -9.823 -10.744 4.520 585 HE21 GLN 68 HE21 GLN 68 -7.841 -11.464 3.750 586 HE22 GLN 68 HE22 GLN 68 -6.674 -12.217 4.777 587 H LYS 69 HN LYS 69 -10.552 -6.564 7.068 588 HA LYS 69 HA LYS 69 -12.417 -8.317 8.453 589 HB2 LYS 69 HB2 LYS 69 -10.425 -7.171 9.561 590 HB3 LYS 69 HB1 LYS 69 -11.325 -5.669 9.413 591 HG2 LYS 69 HG2 LYS 69 -13.135 -6.650 10.765 592 HG3 LYS 69 HG1 LYS 69 -12.160 -8.108 10.967 593 HD2 LYS 69 HD2 LYS 69 -10.373 -6.667 11.961 594 HD3 LYS 69 HD1 LYS 69 -11.517 -5.325 11.923 595 HE2 LYS 69 HE2 LYS 69 -11.462 -6.380 14.122 596 HE3 LYS 69 HE1 LYS 69 -13.041 -6.572 13.362 597 HZ1 LYS 69 HZ1 LYS 69 -10.910 -8.641 13.383 598 HZ2 LYS 69 HZ2 LYS 69 -12.475 -8.818 12.770 599 HZ3 LYS 69 HZ3 LYS 69 -12.237 -8.612 14.429 600 H LEU 70 HN LEU 70 -12.550 -5.697 6.351 601 HA LEU 70 HA LEU 70 -14.811 -4.321 7.343 602 HB2 LEU 70 HB2 LEU 70 -13.325 -3.321 5.709 603 HB3 LEU 70 HB1 LEU 70 -13.712 -4.571 4.545 604 HG LEU 70 HG LEU 70 -16.044 -3.736 4.463 605 HD11 LEU 70 HD11 LEU 70 -14.969 -1.537 6.224 606 HD12 LEU 70 HD12 LEU 70 -16.195 -2.728 6.661 607 HD13 LEU 70 HD13 LEU 70 -16.538 -1.525 5.418 608 HD21 LEU 70 HD21 LEU 70 -15.541 -1.723 3.180 609 HD22 LEU 70 HD22 LEU 70 -14.394 -3.015 2.822 610 HD23 LEU 70 HD23 LEU 70 -13.920 -1.680 3.874 611 H SER 71 HN SER 71 -14.596 -6.592 4.588 612 HA SER 71 HA SER 71 -17.142 -7.749 5.348 613 HB2 SER 71 HB2 SER 71 -16.741 -6.372 2.675 614 HB3 SER 71 HB1 SER 71 -18.141 -7.359 3.104 615 HG SER 71 HG SER 71 -17.767 -5.539 5.021 616 H LYS 72 HN LYS 72 -17.529 -9.782 4.374 617 HA LYS 72 HA LYS 72 -15.093 -11.084 3.440 618 HB2 LYS 72 HB2 LYS 72 -17.816 -12.305 4.016 619 HB3 LYS 72 HB1 LYS 72 -16.307 -13.178 3.792 620 HG2 LYS 72 HG2 LYS 72 -15.417 -12.282 5.866 621 HG3 LYS 72 HG1 LYS 72 -16.842 -11.254 6.068 622 HD2 LYS 72 HD2 LYS 72 -18.249 -13.285 6.196 623 HD3 LYS 72 HD1 LYS 72 -16.795 -14.278 6.074 624 HE2 LYS 72 HE2 LYS 72 -17.587 -14.012 8.396 625 HE3 LYS 72 HE1 LYS 72 -15.958 -13.386 8.154 626 HZ1 LYS 72 HZ1 LYS 72 -16.825 -11.160 8.086 627 HZ2 LYS 72 HZ2 LYS 72 -17.372 -11.911 9.496 628 HZ3 LYS 72 HZ3 LYS 72 -18.417 -11.720 8.181 629 H ALA 73 HN ALA 73 -14.705 -10.960 1.335 630 HA ALA 73 HA ALA 73 -16.714 -10.321 -0.574 631 HB1 ALA 73 HB1 ALA 73 -14.427 -9.538 -0.797 632 HB2 ALA 73 HB2 ALA 73 -14.923 -10.468 -2.212 633 HB3 ALA 73 HB3 ALA 73 -13.870 -11.199 -0.998 634 H ASP 74 HN ASP 74 -15.944 -13.241 0.830 635 HA ASP 74 HA ASP 74 -16.592 -14.821 -1.537 636 HB2 ASP 74 HB2 ASP 74 -15.875 -15.662 1.282 637 HB3 ASP 74 HB1 ASP 74 -16.246 -16.782 -0.021 638 H GLU 75 HN GLU 75 -18.253 -13.178 0.794 639 HA GLU 75 HA GLU 75 -20.570 -14.978 0.539 640 HB2 GLU 75 HB2 GLU 75 -19.588 -15.016 2.830 641 HB3 GLU 75 HB1 GLU 75 -19.876 -13.288 2.953 642 HG2 GLU 75 HG2 GLU 75 -21.559 -14.719 4.101 643 HG3 GLU 75 HG1 GLU 75 -22.228 -13.592 2.924 644 H SER 76 HN SER 76 -20.395 -13.298 -1.396 645 HA SER 76 HA SER 76 -22.466 -11.341 -0.919 646 HB2 SER 76 HB2 SER 76 -19.750 -10.429 -1.903 647 HB3 SER 76 HB1 SER 76 -21.185 -9.424 -1.720 648 HG SER 76 HG SER 76 -20.768 -10.623 0.598 649 H ALA 77 HN ALA 77 -22.311 -13.699 -2.497 650 HA ALA 77 HA ALA 77 -21.507 -13.431 -5.115 651 HB1 ALA 77 HB1 ALA 77 -23.903 -15.007 -4.200 652 HB2 ALA 77 HB2 ALA 77 -22.229 -15.546 -4.114 653 HB3 ALA 77 HB3 ALA 77 -22.978 -15.249 -5.680 654 HA PRO 78 HA PRO 78 -26.057 -11.808 -6.296 655 HB2 PRO 78 HB2 PRO 78 -26.363 -10.176 -3.810 656 HB3 PRO 78 HB1 PRO 78 -27.606 -10.937 -4.812 657 HG2 PRO 78 HG2 PRO 78 -26.927 -12.045 -2.514 658 HG3 PRO 78 HG1 PRO 78 -27.182 -13.061 -3.946 659 HD2 PRO 78 HD2 PRO 78 -24.619 -12.195 -2.667 660 HD3 PRO 78 HD1 PRO 78 -25.050 -13.757 -3.391 661 H VAL 79 HN VAL 79 -23.792 -9.948 -4.296 662 HA VAL 79 HA VAL 79 -24.036 -7.707 -6.172 663 HB VAL 79 HB VAL 79 -22.804 -6.386 -4.428 664 HG11 VAL 79 HG11 VAL 79 -25.409 -7.653 -3.598 665 HG12 VAL 79 HG12 VAL 79 -25.218 -6.252 -4.652 666 HG13 VAL 79 HG13 VAL 79 -24.749 -6.149 -2.956 667 HG21 VAL 79 HG21 VAL 79 -21.754 -8.265 -3.256 668 HG22 VAL 79 HG22 VAL 79 -23.341 -8.803 -2.706 669 HG23 VAL 79 HG23 VAL 79 -22.694 -7.255 -2.160 670 H ALA 80 HN ALA 80 -22.769 -9.669 -7.319 671 HA ALA 80 HA ALA 80 -20.066 -10.073 -6.898 672 HB1 ALA 80 HB1 ALA 80 -19.969 -10.888 -9.170 673 HB2 ALA 80 HB2 ALA 80 -21.495 -10.090 -9.546 674 HB3 ALA 80 HB3 ALA 80 -21.458 -11.425 -8.396 675 H ASN 81 HN ASN 81 -21.666 -7.533 -8.767 676 HA ASN 81 HA ASN 81 -19.377 -6.456 -9.974 677 HB2 ASN 81 HB2 ASN 81 -22.002 -5.169 -9.215 678 HB3 ASN 81 HB1 ASN 81 -20.734 -4.299 -10.071 679 HD21 ASN 81 HD21 ASN 81 -23.403 -4.922 -10.983 680 HD22 ASN 81 HD22 ASN 81 -23.226 -5.877 -12.415 681 H TYR 82 HN TYR 82 -20.775 -5.903 -6.803 682 HA TYR 82 HA TYR 82 -19.056 -3.784 -6.029 683 HB2 TYR 82 HB2 TYR 82 -21.211 -4.454 -4.891 684 HB3 TYR 82 HB1 TYR 82 -20.375 -5.859 -4.246 685 HD1 TYR 82 HD1 TYR 82 -18.628 -5.576 -2.523 686 HD2 TYR 82 HD2 TYR 82 -20.909 -2.254 -3.919 687 HE1 TYR 82 HE1 TYR 82 -17.874 -4.251 -0.598 688 HE2 TYR 82 HE2 TYR 82 -20.157 -0.927 -1.993 689 HH TYR 82 HH TYR 82 -17.583 -1.791 -0.064 690 H ASN 83 HN ASN 83 -18.847 -7.297 -5.876 691 HA ASN 83 HA ASN 83 -16.469 -7.419 -4.324 692 HB2 ASN 83 HB2 ASN 83 -17.628 -9.455 -6.236 693 HB3 ASN 83 HB1 ASN 83 -16.348 -9.769 -5.069 694 HD21 ASN 83 HD21 ASN 83 -18.970 -10.992 -5.343 695 HD22 ASN 83 HD22 ASN 83 -19.788 -10.737 -3.843 696 H GLN 84 HN GLN 84 -17.123 -6.963 -7.698 697 HA GLN 84 HA GLN 84 -14.598 -7.780 -8.686 698 HB2 GLN 84 HB2 GLN 84 -16.680 -5.950 -9.879 699 HB3 GLN 84 HB1 GLN 84 -15.255 -6.517 -10.738 700 HG2 GLN 84 HG2 GLN 84 -17.527 -8.179 -9.684 701 HG3 GLN 84 HG1 GLN 84 -17.119 -7.863 -11.370 702 HE21 GLN 84 HE21 GLN 84 -15.330 -8.888 -12.283 703 HE22 GLN 84 HE22 GLN 84 -14.604 -10.280 -11.561 704 H ARG 85 HN ARG 85 -15.873 -4.601 -7.719 705 HA ARG 85 HA ARG 85 -13.410 -3.263 -8.349 706 HB2 ARG 85 HB2 ARG 85 -15.739 -2.381 -6.637 707 HB3 ARG 85 HB1 ARG 85 -14.349 -1.373 -7.009 708 HG2 ARG 85 HG2 ARG 85 -14.924 -1.750 -9.453 709 HG3 ARG 85 HG1 ARG 85 -16.463 -2.386 -8.872 710 HD2 ARG 85 HD2 ARG 85 -15.362 0.350 -8.253 711 HD3 ARG 85 HD1 ARG 85 -16.583 0.003 -9.473 712 HE ARG 85 HE ARG 85 -17.899 -0.911 -7.474 713 HH11 ARG 85 HH11 ARG 85 -15.646 1.770 -7.269 714 HH12 ARG 85 HH12 ARG 85 -16.517 2.558 -5.990 715 HH21 ARG 85 HH21 ARG 85 -19.034 0.134 -5.794 716 HH22 ARG 85 HH22 ARG 85 -18.438 1.640 -5.156 717 H LYS 86 HN LYS 86 -14.808 -4.823 -5.583 718 HA LYS 86 HA LYS 86 -12.898 -4.062 -3.663 719 HB2 LYS 86 HB2 LYS 86 -14.954 -5.010 -2.926 720 HB3 LYS 86 HB1 LYS 86 -14.723 -6.451 -3.910 721 HG2 LYS 86 HG2 LYS 86 -13.092 -7.319 -2.458 722 HG3 LYS 86 HG1 LYS 86 -12.835 -5.756 -1.673 723 HD2 LYS 86 HD2 LYS 86 -15.358 -7.409 -1.485 724 HD3 LYS 86 HD1 LYS 86 -14.096 -7.324 -0.255 725 HE2 LYS 86 HE2 LYS 86 -15.899 -5.090 -1.188 726 HE3 LYS 86 HE1 LYS 86 -15.858 -5.851 0.400 727 HZ1 LYS 86 HZ1 LYS 86 -13.673 -4.952 0.773 728 HZ2 LYS 86 HZ2 LYS 86 -14.725 -3.695 0.368 729 HZ3 LYS 86 HZ3 LYS 86 -13.621 -4.272 -0.781 730 H GLU 87 HN GLU 87 -12.992 -6.579 -6.088 731 HA GLU 87 HA GLU 87 -10.739 -8.062 -5.345 732 HB2 GLU 87 HB2 GLU 87 -12.487 -8.552 -7.161 733 HB3 GLU 87 HB1 GLU 87 -11.546 -7.485 -8.195 734 HG2 GLU 87 HG2 GLU 87 -10.947 -9.761 -8.631 735 HG3 GLU 87 HG1 GLU 87 -9.591 -8.938 -7.862 736 H GLU 88 HN GLU 88 -11.087 -5.109 -7.255 737 HA GLU 88 HA GLU 88 -8.421 -4.843 -8.090 738 HB2 GLU 88 HB2 GLU 88 -10.659 -2.890 -7.697 739 HB3 GLU 88 HB1 GLU 88 -9.046 -2.314 -8.090 740 HG2 GLU 88 HG2 GLU 88 -10.648 -4.260 -9.732 741 HG3 GLU 88 HG1 GLU 88 -10.467 -2.539 -10.067 742 H GLU 89 HN GLU 89 -10.006 -4.024 -5.078 743 HA GLU 89 HA GLU 89 -8.011 -2.385 -3.960 744 HB2 GLU 89 HB2 GLU 89 -9.736 -4.336 -2.425 745 HB3 GLU 89 HB1 GLU 89 -9.006 -2.857 -1.822 746 HG2 GLU 89 HG2 GLU 89 -10.470 -1.547 -3.270 747 HG3 GLU 89 HG1 GLU 89 -11.205 -3.032 -3.866 748 H HIS 90 HN HIS 90 -8.536 -5.879 -3.846 749 HA HIS 90 HA HIS 90 -6.259 -6.453 -2.259 750 HB2 HIS 90 HB2 HIS 90 -7.985 -8.160 -4.045 751 HB3 HIS 90 HB1 HIS 90 -6.556 -8.815 -3.252 752 HD1 HIS 90 HD1 HIS 90 -6.850 -9.614 -0.910 753 HD2 HIS 90 HD2 HIS 90 -9.967 -7.158 -2.144 754 HE1 HIS 90 HE1 HIS 90 -8.528 -9.663 0.954 755 HE2 HIS 90 HE2 HIS 90 -10.487 -8.338 0.092 756 H THR 91 HN THR 91 -6.823 -6.474 -5.758 757 HA THR 91 HA THR 91 -4.331 -7.438 -6.567 758 HB THR 91 HB THR 91 -6.018 -5.392 -8.021 759 HG1 THR 91 HG1 THR 91 -6.334 -8.159 -7.606 760 HG21 THR 91 HG21 THR 91 -3.798 -5.748 -8.988 761 HG22 THR 91 HG22 THR 91 -5.066 -6.382 -10.036 762 HG23 THR 91 HG23 THR 91 -4.102 -7.484 -9.051 763 H LEU 92 HN LEU 92 -5.398 -4.116 -5.890 764 HA LEU 92 HA LEU 92 -3.025 -2.877 -6.825 765 HB2 LEU 92 HB2 LEU 92 -5.169 -1.702 -6.671 766 HB3 LEU 92 HB1 LEU 92 -5.146 -1.861 -4.928 767 HG LEU 92 HG LEU 92 -3.089 -0.451 -4.880 768 HD11 LEU 92 HD11 LEU 92 -2.332 -0.892 -7.166 769 HD12 LEU 92 HD12 LEU 92 -2.500 0.834 -6.857 770 HD13 LEU 92 HD13 LEU 92 -3.727 -0.016 -7.794 771 HD21 LEU 92 HD21 LEU 92 -4.255 1.641 -5.241 772 HD22 LEU 92 HD22 LEU 92 -5.336 0.469 -4.484 773 HD23 LEU 92 HD23 LEU 92 -5.479 0.817 -6.206 774 H LEU 93 HN LEU 93 -4.216 -3.638 -3.563 775 HA LEU 93 HA LEU 93 -1.970 -2.528 -2.244 776 HB2 LEU 93 HB2 LEU 93 -3.979 -4.550 -1.245 777 HB3 LEU 93 HB1 LEU 93 -2.825 -3.696 -0.242 778 HG LEU 93 HG LEU 93 -5.069 -2.415 -1.806 779 HD11 LEU 93 HD11 LEU 93 -6.047 -1.985 0.394 780 HD12 LEU 93 HD12 LEU 93 -4.742 -2.897 1.152 781 HD13 LEU 93 HD13 LEU 93 -5.881 -3.712 0.081 782 HD21 LEU 93 HD21 LEU 93 -3.114 -0.956 -1.593 783 HD22 LEU 93 HD22 LEU 93 -3.119 -1.206 0.152 784 HD23 LEU 93 HD23 LEU 93 -4.467 -0.377 -0.623 785 H ASP 94 HN ASP 94 -2.650 -5.694 -3.552 786 HA ASP 94 HA ASP 94 -0.762 -7.153 -2.040 787 HB2 ASP 94 HB2 ASP 94 -2.550 -8.270 -3.290 788 HB3 ASP 94 HB1 ASP 94 -1.850 -7.719 -4.810 789 H LYS 95 HN LYS 95 -0.505 -5.673 -5.292 790 HA LYS 95 HA LYS 95 2.169 -6.520 -5.643 791 HB2 LYS 95 HB2 LYS 95 0.676 -6.033 -7.517 792 HB3 LYS 95 HB1 LYS 95 0.584 -4.352 -7.026 793 HG2 LYS 95 HG2 LYS 95 2.864 -3.974 -7.607 794 HG3 LYS 95 HG1 LYS 95 3.148 -5.698 -7.843 795 HD2 LYS 95 HD2 LYS 95 2.944 -4.675 -9.995 796 HD3 LYS 95 HD1 LYS 95 1.506 -5.651 -9.714 797 HE2 LYS 95 HE2 LYS 95 1.548 -2.707 -9.124 798 HE3 LYS 95 HE1 LYS 95 1.220 -3.315 -10.743 799 HZ1 LYS 95 HZ1 LYS 95 -0.363 -3.781 -8.282 800 HZ2 LYS 95 HZ2 LYS 95 -0.602 -4.664 -9.702 801 HZ3 LYS 95 HZ3 LYS 95 -0.854 -2.995 -9.692 802 H LEU 96 HN LEU 96 0.702 -3.526 -4.472 803 HA LEU 96 HA LEU 96 3.025 -2.031 -4.129 804 HB2 LEU 96 HB2 LEU 96 0.605 -2.117 -2.323 805 HB3 LEU 96 HB1 LEU 96 1.848 -0.885 -2.280 806 HG LEU 96 HG LEU 96 -0.001 -1.409 -4.605 807 HD11 LEU 96 HD11 LEU 96 -1.180 -0.439 -2.717 808 HD12 LEU 96 HD12 LEU 96 -0.989 0.752 -4.002 809 HD13 LEU 96 HD13 LEU 96 0.047 0.819 -2.576 810 HD21 LEU 96 HD21 LEU 96 0.921 0.689 -5.488 811 HD22 LEU 96 HD22 LEU 96 2.144 -0.574 -5.353 812 HD23 LEU 96 HD23 LEU 96 2.080 0.722 -4.159 813 H THR 97 HN THR 97 1.535 -4.360 -1.890 814 HA THR 97 HA THR 97 3.463 -4.256 0.120 815 HB THR 97 HB THR 97 1.942 -6.732 -0.728 816 HG1 THR 97 HG1 THR 97 0.508 -4.968 -0.390 817 HG21 THR 97 HG21 THR 97 3.715 -7.128 0.916 818 HG22 THR 97 HG22 THR 97 2.117 -7.337 1.636 819 HG23 THR 97 HG23 THR 97 3.039 -5.867 1.949 820 H GLN 98 HN GLN 98 3.306 -6.321 -2.771 821 HA GLN 98 HA GLN 98 5.609 -7.834 -2.291 822 HB2 GLN 98 HB2 GLN 98 4.092 -8.570 -3.966 823 HB3 GLN 98 HB1 GLN 98 4.185 -7.043 -4.827 824 HG2 GLN 98 HG2 GLN 98 6.548 -7.548 -5.368 825 HG3 GLN 98 HG1 GLN 98 6.341 -9.130 -4.617 826 HE21 GLN 98 HE21 GLN 98 6.845 -10.110 -6.613 827 HE22 GLN 98 HE22 GLN 98 5.685 -10.176 -7.899 828 H GLN 99 HN GLN 99 5.168 -4.786 -4.031 829 HA GLN 99 HA GLN 99 7.756 -4.510 -5.036 830 HB2 GLN 99 HB2 GLN 99 5.905 -3.136 -5.818 831 HB3 GLN 99 HB1 GLN 99 5.756 -2.390 -4.234 832 HG2 GLN 99 HG2 GLN 99 6.889 -0.780 -5.408 833 HG3 GLN 99 HG1 GLN 99 8.207 -1.649 -4.630 834 HE21 GLN 99 HE21 GLN 99 7.880 -3.922 -6.553 835 HE22 GLN 99 HE22 GLN 99 8.619 -3.367 -8.007 836 H LEU 100 HN LEU 100 6.366 -3.335 -1.990 837 HA LEU 100 HA LEU 100 8.774 -2.017 -1.207 838 HB2 LEU 100 HB2 LEU 100 6.305 -2.749 0.358 839 HB3 LEU 100 HB1 LEU 100 7.628 -1.798 1.005 840 HG LEU 100 HG LEU 100 5.819 -1.020 -1.284 841 HD11 LEU 100 HD11 LEU 100 5.076 0.731 0.236 842 HD12 LEU 100 HD12 LEU 100 6.138 0.098 1.495 843 HD13 LEU 100 HD13 LEU 100 4.783 -0.871 0.914 844 HD21 LEU 100 HD21 LEU 100 7.008 1.140 -1.196 845 HD22 LEU 100 HD22 LEU 100 8.046 -0.188 -1.712 846 HD23 LEU 100 HD23 LEU 100 8.163 0.434 -0.065 847 H GLN 101 HN GLN 101 7.242 -5.087 -0.306 848 HA GLN 101 HA GLN 101 9.025 -5.738 1.766 849 HB2 GLN 101 HB2 GLN 101 6.814 -6.831 1.349 850 HB3 GLN 101 HB1 GLN 101 7.521 -7.660 -0.027 851 HG2 GLN 101 HG2 GLN 101 8.683 -7.952 2.720 852 HG3 GLN 101 HG1 GLN 101 7.298 -8.913 2.207 853 HE21 GLN 101 HE21 GLN 101 10.002 -9.752 2.939 854 HE22 GLN 101 HE22 GLN 101 10.613 -10.628 1.579 855 H GLY 102 HN GLY 102 9.077 -6.520 -1.696 856 HA2 GLY 102 HA2 GLY 102 11.461 -8.041 -1.622 857 HA3 GLY 102 HA1 GLY 102 10.785 -7.260 -3.043 858 H LEU 103 HN LEU 103 10.847 -4.608 -2.209 859 HA LEU 103 HA LEU 103 13.513 -3.934 -2.847 860 HB2 LEU 103 HB2 LEU 103 11.546 -2.533 -3.398 861 HB3 LEU 103 HB1 LEU 103 11.337 -2.176 -1.694 862 HG LEU 103 HG LEU 103 13.548 -1.049 -1.686 863 HD11 LEU 103 HD11 LEU 103 14.614 -2.241 -3.506 864 HD12 LEU 103 HD12 LEU 103 14.604 -0.509 -3.837 865 HD13 LEU 103 HD13 LEU 103 13.456 -1.570 -4.655 866 HD21 LEU 103 HD21 LEU 103 11.600 -0.030 -3.749 867 HD22 LEU 103 HD22 LEU 103 12.837 0.926 -2.933 868 HD23 LEU 103 HD23 LEU 103 11.503 0.237 -2.008 869 H ALA 104 HN ALA 104 11.695 -3.857 0.191 870 HA ALA 104 HA ALA 104 13.544 -2.544 1.789 871 HB1 ALA 104 HB1 ALA 104 12.441 -3.662 3.691 872 HB2 ALA 104 HB2 ALA 104 11.593 -4.710 2.553 873 HB3 ALA 104 HB3 ALA 104 11.295 -2.971 2.544 874 H VAL 105 HN VAL 105 13.244 -6.015 1.118 875 HA VAL 105 HA VAL 105 15.422 -6.794 2.751 876 HB VAL 105 HB VAL 105 14.156 -8.199 0.398 877 HG11 VAL 105 HG11 VAL 105 16.070 -9.260 2.467 878 HG12 VAL 105 HG12 VAL 105 16.397 -9.052 0.745 879 HG13 VAL 105 HG13 VAL 105 15.203 -10.236 1.281 880 HG21 VAL 105 HG21 VAL 105 12.607 -7.846 2.217 881 HG22 VAL 105 HG22 VAL 105 13.774 -8.496 3.368 882 HG23 VAL 105 HG23 VAL 105 13.064 -9.547 2.146 883 H THR 106 HN THR 106 15.120 -5.911 -0.636 884 HA THR 106 HA THR 106 17.739 -6.551 -1.436 885 HB THR 106 HB THR 106 15.872 -4.448 -2.551 886 HG1 THR 106 HG1 THR 106 14.940 -6.525 -2.615 887 HG21 THR 106 HG21 THR 106 18.261 -5.809 -3.795 888 HG22 THR 106 HG22 THR 106 18.148 -4.110 -3.335 889 HG23 THR 106 HG23 THR 106 17.139 -4.740 -4.638 890 H ILE 107 HN ILE 107 16.345 -3.677 0.049 891 HA ILE 107 HA ILE 107 18.686 -2.061 -0.252 892 HB ILE 107 HB ILE 107 16.315 -1.714 1.588 893 HG12 ILE 107 HG12 ILE 107 16.955 -0.353 -1.040 894 HG13 ILE 107 HG11 ILE 107 15.784 -1.654 -0.846 895 HG21 ILE 107 HG21 ILE 107 18.512 0.215 0.867 896 HG22 ILE 107 HG22 ILE 107 18.227 -0.515 2.447 897 HG23 ILE 107 HG23 ILE 107 17.057 0.623 1.775 898 HD11 ILE 107 HD11 ILE 107 15.634 1.045 0.480 899 HD12 ILE 107 HD12 ILE 107 14.445 -0.252 0.614 900 HD13 ILE 107 HD13 ILE 107 14.719 0.539 -0.940 901 H SER 108 HN SER 108 17.355 -4.071 2.347 902 HA SER 108 HA SER 108 19.291 -3.113 4.252 903 HB2 SER 108 HB2 SER 108 18.272 -4.951 5.704 904 HB3 SER 108 HB1 SER 108 17.186 -3.664 5.182 905 HG SER 108 HG SER 108 16.243 -5.014 3.743 906 H ARG 109 HN ARG 109 19.279 -5.464 1.834 907 HA ARG 109 HA ARG 109 21.735 -6.626 2.930 908 HB2 ARG 109 HB2 ARG 109 19.525 -8.165 1.547 909 HB3 ARG 109 HB1 ARG 109 21.073 -8.835 2.049 910 HG2 ARG 109 HG2 ARG 109 20.542 -8.436 4.366 911 HG3 ARG 109 HG1 ARG 109 19.039 -7.633 3.915 912 HD2 ARG 109 HD2 ARG 109 18.287 -9.767 2.880 913 HD3 ARG 109 HD1 ARG 109 19.745 -10.532 3.508 914 HE ARG 109 HE ARG 109 18.740 -9.523 5.739 915 HH11 ARG 109 HH11 ARG 109 17.162 -11.292 3.165 916 HH12 ARG 109 HH12 ARG 109 15.916 -11.924 4.192 917 HH21 ARG 109 HH21 ARG 109 17.091 -10.335 7.090 918 HH22 ARG 109 HH22 ARG 109 15.871 -11.375 6.421 919 H GLU 110 HN GLU 110 23.079 -5.497 1.639 920 HA GLU 110 HA GLU 110 22.553 -4.843 -1.054 921 HB2 GLU 110 HB2 GLU 110 24.063 -3.568 0.458 922 HB3 GLU 110 HB1 GLU 110 25.217 -4.891 0.365 923 HG2 GLU 110 HG2 GLU 110 25.973 -3.258 -1.140 924 HG3 GLU 110 HG1 GLU 110 25.256 -4.532 -2.124 925 H ASN 111 HN ASN 111 24.151 -7.574 0.443 926 HA ASN 111 HA ASN 111 24.851 -8.554 -2.240 927 HB2 ASN 111 HB2 ASN 111 26.431 -8.772 0.322 928 HB3 ASN 111 HB1 ASN 111 26.766 -9.767 -1.090 929 HD21 ASN 111 HD21 ASN 111 27.647 -8.817 -2.925 930 HD22 ASN 111 HD22 ASN 111 28.358 -7.241 -2.892 931 H ILE 112 HN ILE 112 22.503 -9.304 -1.706 932 HA ILE 112 HA ILE 112 22.113 -11.523 -0.015 933 HB ILE 112 HB ILE 112 20.635 -10.804 -2.549 934 HG12 ILE 112 HG12 ILE 112 19.875 -10.270 0.325 935 HG13 ILE 112 HG11 ILE 112 20.630 -9.079 -0.717 936 HG21 ILE 112 HG21 ILE 112 20.289 -13.128 -1.962 937 HG22 ILE 112 HG22 ILE 112 18.827 -12.194 -1.646 938 HG23 ILE 112 HG23 ILE 112 19.877 -12.669 -0.311 939 HD11 ILE 112 HD11 ILE 112 17.954 -10.374 -1.154 940 HD12 ILE 112 HD12 ILE 112 18.708 -9.198 -2.227 941 HD13 ILE 112 HD13 ILE 112 18.242 -8.729 -0.594 942 H THR 113 HN THR 113 23.385 -13.261 -0.158 943 HA THR 113 HA THR 113 24.238 -14.221 -2.775 944 HB THR 113 HB THR 113 25.065 -15.230 -0.047 945 HG1 THR 113 HG1 THR 113 25.642 -12.904 -1.317 946 HG21 THR 113 HG21 THR 113 25.551 -16.771 -1.888 947 HG22 THR 113 HG22 THR 113 27.036 -16.074 -1.240 948 HG23 THR 113 HG23 THR 113 26.373 -15.477 -2.761 949 H GLU 114 HN GLU 114 22.074 -14.968 -0.205 950 HA GLU 114 HA GLU 114 20.437 -16.504 0.063 951 HB2 GLU 114 HB2 GLU 114 19.943 -16.090 -2.321 952 HB3 GLU 114 HB1 GLU 114 21.080 -17.345 -2.770 953 HG2 GLU 114 HG2 GLU 114 18.838 -18.193 -2.905 954 HG3 GLU 114 HG1 GLU 114 19.692 -18.992 -1.586 955 H VAL 115 HN VAL 115 22.598 -18.385 -2.050 956 HA VAL 115 HA VAL 115 22.623 -20.501 -0.046 957 HB VAL 115 HB VAL 115 23.860 -20.555 -2.794 958 HG11 VAL 115 HG11 VAL 115 24.725 -22.263 -1.321 959 HG12 VAL 115 HG12 VAL 115 23.664 -23.001 -2.520 960 HG13 VAL 115 HG13 VAL 115 23.089 -22.746 -0.873 961 HG21 VAL 115 HG21 VAL 115 21.116 -21.478 -1.956 962 HG22 VAL 115 HG22 VAL 115 21.846 -21.714 -3.544 963 HG23 VAL 115 HG23 VAL 115 21.473 -20.086 -2.977 964 H GLY 116 HN GLY 116 24.070 -20.047 1.523 965 HA2 GLY 116 HA2 GLY 116 26.731 -20.545 1.312 966 HA3 GLY 116 HA1 GLY 116 26.618 -18.826 0.961 967 H ALA 117 HN ALA 117 26.529 -17.430 2.624 968 HA ALA 117 HA ALA 117 25.967 -18.531 5.299 969 HB1 ALA 117 HB1 ALA 117 27.921 -16.343 4.597 970 HB2 ALA 117 HB2 ALA 117 28.342 -17.999 5.038 971 HB3 ALA 117 HB3 ALA 117 27.570 -16.939 6.218 972 HA PRO 118 HA PRO 118 23.033 -15.057 4.703 973 HB2 PRO 118 HB2 PRO 118 20.749 -16.363 5.090 974 HB3 PRO 118 HB1 PRO 118 21.615 -16.507 3.554 975 HG2 PRO 118 HG2 PRO 118 21.489 -18.418 5.848 976 HG3 PRO 118 HG1 PRO 118 21.480 -18.754 4.108 977 HD2 PRO 118 HD2 PRO 118 23.706 -18.902 5.784 978 HD3 PRO 118 HD1 PRO 118 23.752 -18.808 4.014 979 H THR 119 HN THR 119 24.191 -16.836 7.177 980 HA THR 119 HA THR 119 24.074 -16.885 9.428 981 HB THR 119 HB THR 119 23.609 -14.695 10.568 982 HG1 THR 119 HG1 THR 119 22.390 -14.097 8.339 983 HG21 THR 119 HG21 THR 119 25.578 -14.682 8.284 984 HG22 THR 119 HG22 THR 119 25.860 -15.313 9.906 985 HG23 THR 119 HG23 THR 119 25.611 -13.585 9.663 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 -37.531 1.634 17.785 2 H2 GLY 1 HT2 GLY 1 -37.456 2.863 16.631 3 H3 GLY 1 HT3 GLY 1 -37.650 3.251 18.265 4 HA2 GLY 1 HA1 GLY 1 -35.458 2.387 18.768 5 HA3 GLY 1 HA2 GLY 1 -35.260 1.959 17.073 6 HA PRO 2 HA PRO 2 -33.581 6.274 17.826 7 HB2 PRO 2 HB2 PRO 2 -31.147 5.801 16.691 8 HB3 PRO 2 HB1 PRO 2 -31.478 5.576 18.411 9 HG2 PRO 2 HG2 PRO 2 -31.368 3.546 16.219 10 HG3 PRO 2 HG1 PRO 2 -30.744 3.442 17.877 11 HD2 PRO 2 HD2 PRO 2 -33.066 2.277 17.117 12 HD3 PRO 2 HD1 PRO 2 -32.810 2.915 18.753 13 H MET 3 HN MET 3 -34.345 7.622 16.336 14 HA MET 3 HA MET 3 -34.399 6.774 13.537 15 HB2 MET 3 HB2 MET 3 -35.820 9.038 14.945 16 HB3 MET 3 HB1 MET 3 -35.957 8.691 13.229 17 HG2 MET 3 HG2 MET 3 -36.915 6.510 13.738 18 HG3 MET 3 HG1 MET 3 -36.762 6.842 15.463 19 HE1 MET 3 HE1 MET 3 -39.491 5.950 14.038 20 HE2 MET 3 HE2 MET 3 -40.624 7.012 14.872 21 HE3 MET 3 HE3 MET 3 -39.314 6.242 15.767 22 H ALA 4 HN ALA 4 -32.231 8.222 15.361 23 HA ALA 4 HA ALA 4 -31.545 10.286 13.380 24 HB1 ALA 4 HB1 ALA 4 -31.777 11.075 15.700 25 HB2 ALA 4 HB2 ALA 4 -30.140 11.289 15.083 26 HB3 ALA 4 HB3 ALA 4 -30.498 9.965 16.192 27 H MET 5 HN MET 5 -31.111 7.598 12.735 28 HA MET 5 HA MET 5 -28.253 7.145 13.201 29 HB2 MET 5 HB2 MET 5 -30.400 5.352 12.058 30 HB3 MET 5 HB1 MET 5 -28.703 4.908 12.159 31 HG2 MET 5 HG2 MET 5 -30.508 5.557 14.477 32 HG3 MET 5 HG1 MET 5 -29.972 3.950 13.990 33 HE1 MET 5 HE1 MET 5 -27.490 3.095 14.169 34 HE2 MET 5 HE2 MET 5 -26.144 4.072 14.752 35 HE3 MET 5 HE3 MET 5 -26.912 4.461 13.213 36 H LEU 6 HN LEU 6 -28.921 9.275 11.533 37 HA LEU 6 HA LEU 6 -28.590 8.407 8.791 38 HB2 LEU 6 HB2 LEU 6 -28.849 10.676 8.158 39 HB3 LEU 6 HB1 LEU 6 -30.008 10.384 9.436 40 HG LEU 6 HG LEU 6 -27.347 11.753 9.867 41 HD11 LEU 6 HD11 LEU 6 -28.605 13.834 9.923 42 HD12 LEU 6 HD12 LEU 6 -30.080 12.964 9.506 43 HD13 LEU 6 HD13 LEU 6 -28.751 13.050 8.350 44 HD21 LEU 6 HD21 LEU 6 -29.801 11.484 11.597 45 HD22 LEU 6 HD22 LEU 6 -28.435 12.542 11.947 46 HD23 LEU 6 HD23 LEU 6 -28.206 10.794 11.900 47 H ALA 7 HN ALA 7 -26.523 8.120 11.024 48 HA ALA 7 HA ALA 7 -24.314 9.734 10.130 49 HB1 ALA 7 HB1 ALA 7 -23.043 8.606 11.862 50 HB2 ALA 7 HB2 ALA 7 -24.368 7.469 12.114 51 HB3 ALA 7 HB3 ALA 7 -24.586 9.176 12.496 52 H ARG 8 HN ARG 8 -25.731 6.910 9.053 53 HA ARG 8 HA ARG 8 -23.329 5.505 8.332 54 HB2 ARG 8 HB2 ARG 8 -25.478 4.340 8.828 55 HB3 ARG 8 HB1 ARG 8 -26.156 5.039 7.364 56 HG2 ARG 8 HG2 ARG 8 -24.512 3.854 6.018 57 HG3 ARG 8 HG1 ARG 8 -23.789 3.181 7.479 58 HD2 ARG 8 HD2 ARG 8 -25.879 2.030 7.991 59 HD3 ARG 8 HD1 ARG 8 -26.621 2.720 6.547 60 HE ARG 8 HE ARG 8 -24.249 1.296 5.902 61 HH11 ARG 8 HH11 ARG 8 -27.615 0.831 6.751 62 HH12 ARG 8 HH12 ARG 8 -27.748 -0.681 5.909 63 HH21 ARG 8 HH21 ARG 8 -24.420 -0.698 4.807 64 HH22 ARG 8 HH22 ARG 8 -25.935 -1.549 4.804 65 H ARG 9 HN ARG 9 -22.254 7.184 7.211 66 HA ARG 9 HA ARG 9 -23.408 7.955 4.627 67 HB2 ARG 9 HB2 ARG 9 -21.090 9.108 6.182 68 HB3 ARG 9 HB1 ARG 9 -21.580 9.658 4.587 69 HG2 ARG 9 HG2 ARG 9 -23.273 9.763 7.074 70 HG3 ARG 9 HG1 ARG 9 -22.414 11.119 6.347 71 HD2 ARG 9 HD2 ARG 9 -23.746 10.803 4.285 72 HD3 ARG 9 HD1 ARG 9 -24.650 9.529 5.099 73 HE ARG 9 HE ARG 9 -24.623 12.106 6.425 74 HH11 ARG 9 HH11 ARG 9 -26.314 9.931 4.265 75 HH12 ARG 9 HH12 ARG 9 -27.851 10.712 4.479 76 HH21 ARG 9 HH21 ARG 9 -26.650 13.134 6.713 77 HH22 ARG 9 HH22 ARG 9 -28.043 12.527 5.869 78 H GLN 10 HN GLN 10 -21.263 5.773 5.958 79 HA GLN 10 HA GLN 10 -19.405 5.667 3.785 80 HB2 GLN 10 HB2 GLN 10 -19.941 3.898 6.149 81 HB3 GLN 10 HB1 GLN 10 -18.856 3.383 4.864 82 HG2 GLN 10 HG2 GLN 10 -18.565 5.865 6.543 83 HG3 GLN 10 HG1 GLN 10 -17.629 4.379 6.706 84 HE21 GLN 10 HE21 GLN 10 -16.736 7.099 6.147 85 HE22 GLN 10 HE22 GLN 10 -15.883 7.026 4.646 86 H ARG 11 HN ARG 11 -21.472 5.702 2.357 87 HA ARG 11 HA ARG 11 -22.516 3.076 1.774 88 HB2 ARG 11 HB2 ARG 11 -22.758 5.712 0.308 89 HB3 ARG 11 HB1 ARG 11 -23.518 4.222 -0.232 90 HG2 ARG 11 HG2 ARG 11 -24.780 4.130 1.880 91 HG3 ARG 11 HG1 ARG 11 -24.064 5.670 2.352 92 HD2 ARG 11 HD2 ARG 11 -25.793 5.189 -0.072 93 HD3 ARG 11 HD1 ARG 11 -26.304 5.972 1.423 94 HE ARG 11 HE ARG 11 -24.093 7.122 -0.130 95 HH11 ARG 11 HH11 ARG 11 -27.372 7.362 1.092 96 HH12 ARG 11 HH12 ARG 11 -27.516 9.048 0.715 97 HH21 ARG 11 HH21 ARG 11 -24.280 9.333 -0.614 98 HH22 ARG 11 HH22 ARG 11 -25.754 10.174 -0.246 99 H ASP 12 HN ASP 12 -21.523 1.619 0.581 100 HA ASP 12 HA ASP 12 -19.825 0.578 -0.521 101 HB2 ASP 12 HB2 ASP 12 -20.762 1.851 -2.454 102 HB3 ASP 12 HB1 ASP 12 -19.620 3.148 -2.113 103 HA PRO 13 HA PRO 13 -16.859 2.720 2.378 104 HB2 PRO 13 HB2 PRO 13 -16.204 -0.167 2.718 105 HB3 PRO 13 HB1 PRO 13 -16.389 1.093 3.945 106 HG2 PRO 13 HG2 PRO 13 -18.294 -0.732 3.597 107 HG3 PRO 13 HG1 PRO 13 -18.716 0.964 3.910 108 HD2 PRO 13 HD2 PRO 13 -18.761 -0.560 1.338 109 HD3 PRO 13 HD1 PRO 13 -19.897 0.662 1.947 110 H LEU 14 HN LEU 14 -16.543 0.282 -0.104 111 HA LEU 14 HA LEU 14 -13.767 0.138 -0.338 112 HB2 LEU 14 HB2 LEU 14 -15.771 0.019 -2.595 113 HB3 LEU 14 HB1 LEU 14 -14.114 -0.566 -2.649 114 HG LEU 14 HG LEU 14 -16.352 -1.703 -0.968 115 HD11 LEU 14 HD11 LEU 14 -16.071 -3.656 -2.426 116 HD12 LEU 14 HD12 LEU 14 -14.892 -2.759 -3.380 117 HD13 LEU 14 HD13 LEU 14 -16.569 -2.223 -3.317 118 HD21 LEU 14 HD21 LEU 14 -14.296 -1.947 0.250 119 HD22 LEU 14 HD22 LEU 14 -13.456 -2.506 -1.196 120 HD23 LEU 14 HD23 LEU 14 -14.713 -3.505 -0.468 121 H GLN 15 HN GLN 15 -16.030 2.472 -1.803 122 HA GLN 15 HA GLN 15 -14.166 3.772 -3.437 123 HB2 GLN 15 HB2 GLN 15 -16.532 4.165 -3.714 124 HB3 GLN 15 HB1 GLN 15 -16.659 4.829 -2.093 125 HG2 GLN 15 HG2 GLN 15 -16.714 6.629 -3.648 126 HG3 GLN 15 HG1 GLN 15 -15.178 6.690 -2.793 127 HE21 GLN 15 HE21 GLN 15 -15.927 7.830 -5.352 128 HE22 GLN 15 HE22 GLN 15 -14.827 7.182 -6.517 129 H ALA 16 HN ALA 16 -15.150 4.519 -0.097 130 HA ALA 16 HA ALA 16 -13.466 6.785 0.154 131 HB1 ALA 16 HB1 ALA 16 -14.652 5.035 2.304 132 HB2 ALA 16 HB2 ALA 16 -15.416 6.450 1.580 133 HB3 ALA 16 HB3 ALA 16 -13.952 6.636 2.543 134 H LEU 17 HN LEU 17 -13.137 3.416 1.191 135 HA LEU 17 HA LEU 17 -10.591 3.732 2.364 136 HB2 LEU 17 HB2 LEU 17 -12.125 1.835 2.799 137 HB3 LEU 17 HB1 LEU 17 -11.793 1.229 1.189 138 HG LEU 17 HG LEU 17 -9.463 0.837 1.772 139 HD11 LEU 17 HD11 LEU 17 -10.218 1.948 4.472 140 HD12 LEU 17 HD12 LEU 17 -9.092 2.661 3.315 141 HD13 LEU 17 HD13 LEU 17 -8.700 1.131 4.099 142 HD21 LEU 17 HD21 LEU 17 -11.088 -0.924 2.224 143 HD22 LEU 17 HD22 LEU 17 -11.358 -0.269 3.838 144 HD23 LEU 17 HD23 LEU 17 -9.784 -0.940 3.411 145 H ARG 18 HN ARG 18 -11.602 2.896 -0.916 146 HA ARG 18 HA ARG 18 -9.089 2.280 -1.978 147 HB2 ARG 18 HB2 ARG 18 -11.122 1.863 -3.246 148 HB3 ARG 18 HB1 ARG 18 -11.465 3.586 -3.321 149 HG2 ARG 18 HG2 ARG 18 -9.649 3.981 -4.779 150 HG3 ARG 18 HG1 ARG 18 -8.988 2.371 -4.500 151 HD2 ARG 18 HD2 ARG 18 -10.043 2.393 -6.646 152 HD3 ARG 18 HD1 ARG 18 -11.015 1.414 -5.553 153 HE ARG 18 HE ARG 18 -12.126 3.916 -5.440 154 HH11 ARG 18 HH11 ARG 18 -11.463 1.556 -7.933 155 HH12 ARG 18 HH12 ARG 18 -12.777 2.068 -8.947 156 HH21 ARG 18 HH21 ARG 18 -13.882 4.575 -6.758 157 HH22 ARG 18 HH22 ARG 18 -14.144 3.785 -8.286 158 H ARG 19 HN ARG 19 -10.736 5.392 -1.625 159 HA ARG 19 HA ARG 19 -8.831 6.999 -2.892 160 HB2 ARG 19 HB2 ARG 19 -11.114 7.703 -2.115 161 HB3 ARG 19 HB1 ARG 19 -10.490 7.732 -0.473 162 HG2 ARG 19 HG2 ARG 19 -8.874 9.457 -1.130 163 HG3 ARG 19 HG1 ARG 19 -9.548 9.445 -2.762 164 HD2 ARG 19 HD2 ARG 19 -11.739 10.063 -1.829 165 HD3 ARG 19 HD1 ARG 19 -11.014 10.141 -0.227 166 HE ARG 19 HE ARG 19 -9.527 11.829 -1.830 167 HH11 ARG 19 HH11 ARG 19 -12.851 11.558 -0.782 168 HH12 ARG 19 HH12 ARG 19 -13.138 13.270 -0.819 169 HH21 ARG 19 HH21 ARG 19 -9.899 14.082 -1.883 170 HH22 ARG 19 HH22 ARG 19 -11.461 14.706 -1.455 171 H ARG 20 HN ARG 20 -9.071 5.846 0.429 172 HA ARG 20 HA ARG 20 -6.759 7.119 1.422 173 HB2 ARG 20 HB2 ARG 20 -8.019 4.530 2.347 174 HB3 ARG 20 HB1 ARG 20 -6.902 5.527 3.268 175 HG2 ARG 20 HG2 ARG 20 -8.529 7.319 3.367 176 HG3 ARG 20 HG1 ARG 20 -9.640 6.392 2.356 177 HD2 ARG 20 HD2 ARG 20 -9.658 4.625 4.111 178 HD3 ARG 20 HD1 ARG 20 -8.687 5.685 5.129 179 HE ARG 20 HE ARG 20 -10.948 7.122 4.359 180 HH11 ARG 20 HH11 ARG 20 -10.137 4.306 6.271 181 HH12 ARG 20 HH12 ARG 20 -11.523 4.442 7.305 182 HH21 ARG 20 HH21 ARG 20 -12.773 7.319 5.728 183 HH22 ARG 20 HH22 ARG 20 -13.028 6.165 6.999 184 H ASN 21 HN ASN 21 -7.276 3.900 -0.019 185 HA ASN 21 HA ASN 21 -4.635 2.962 0.204 186 HB2 ASN 21 HB2 ASN 21 -6.722 2.342 -1.901 187 HB3 ASN 21 HB1 ASN 21 -5.189 1.495 -1.759 188 HD21 ASN 21 HD21 ASN 21 -7.841 0.419 -1.590 189 HD22 ASN 21 HD22 ASN 21 -7.977 -0.296 -0.017 190 H GLN 22 HN GLN 22 -6.216 4.856 -2.325 191 HA GLN 22 HA GLN 22 -4.059 4.977 -4.114 192 HB2 GLN 22 HB2 GLN 22 -6.299 6.951 -3.637 193 HB3 GLN 22 HB1 GLN 22 -5.203 7.003 -5.010 194 HG2 GLN 22 HG2 GLN 22 -6.002 4.853 -5.773 195 HG3 GLN 22 HG1 GLN 22 -7.039 4.708 -4.357 196 HE21 GLN 22 HE21 GLN 22 -7.781 4.653 -7.166 197 HE22 GLN 22 HE22 GLN 22 -8.899 5.951 -7.395 198 H GLU 23 HN GLU 23 -4.777 6.738 -1.210 199 HA GLU 23 HA GLU 23 -2.909 8.859 -1.621 200 HB2 GLU 23 HB2 GLU 23 -4.829 9.046 -0.073 201 HB3 GLU 23 HB1 GLU 23 -4.118 7.804 0.945 202 HG2 GLU 23 HG2 GLU 23 -2.243 9.238 1.445 203 HG3 GLU 23 HG1 GLU 23 -2.862 10.469 0.345 204 H LEU 24 HN LEU 24 -2.875 5.781 0.140 205 HA LEU 24 HA LEU 24 -0.199 5.956 1.034 206 HB2 LEU 24 HB2 LEU 24 -1.934 3.545 0.496 207 HB3 LEU 24 HB1 LEU 24 -0.351 3.463 1.240 208 HG LEU 24 HG LEU 24 -2.757 4.882 2.400 209 HD11 LEU 24 HD11 LEU 24 -2.700 3.096 4.073 210 HD12 LEU 24 HD12 LEU 24 -1.386 2.313 3.194 211 HD13 LEU 24 HD13 LEU 24 -2.981 2.455 2.455 212 HD21 LEU 24 HD21 LEU 24 -1.355 5.100 4.408 213 HD22 LEU 24 HD22 LEU 24 -0.687 5.985 3.038 214 HD23 LEU 24 HD23 LEU 24 0.013 4.438 3.515 215 H LYS 25 HN LYS 25 -1.673 4.709 -1.925 216 HA LYS 25 HA LYS 25 0.602 3.526 -3.031 217 HB2 LYS 25 HB2 LYS 25 -1.687 3.287 -3.967 218 HB3 LYS 25 HB1 LYS 25 -1.600 4.949 -4.538 219 HG2 LYS 25 HG2 LYS 25 0.374 4.321 -5.908 220 HG3 LYS 25 HG1 LYS 25 0.132 2.648 -5.412 221 HD2 LYS 25 HD2 LYS 25 -2.067 2.637 -6.443 222 HD3 LYS 25 HD1 LYS 25 -1.886 4.335 -6.885 223 HE2 LYS 25 HE2 LYS 25 -0.115 2.089 -7.846 224 HE3 LYS 25 HE1 LYS 25 -1.436 2.801 -8.770 225 HZ1 LYS 25 HZ1 LYS 25 -0.280 4.916 -8.746 226 HZ2 LYS 25 HZ2 LYS 25 0.719 3.719 -9.401 227 HZ3 LYS 25 HZ3 LYS 25 0.979 4.264 -7.817 228 H GLN 26 HN GLN 26 -0.518 6.887 -3.120 229 HA GLN 26 HA GLN 26 1.443 7.913 -4.843 230 HB2 GLN 26 HB2 GLN 26 0.009 9.236 -2.535 231 HB3 GLN 26 HB1 GLN 26 0.985 10.096 -3.716 232 HG2 GLN 26 HG2 GLN 26 -1.424 8.446 -4.427 233 HG3 GLN 26 HG1 GLN 26 -1.484 10.174 -4.095 234 HE21 GLN 26 HE21 GLN 26 -2.220 10.636 -6.148 235 HE22 GLN 26 HE22 GLN 26 -1.200 10.555 -7.542 236 H GLN 27 HN GLN 27 1.493 7.171 -1.425 237 HA GLN 27 HA GLN 27 3.969 8.487 -0.863 238 HB2 GLN 27 HB2 GLN 27 2.582 6.260 0.642 239 HB3 GLN 27 HB1 GLN 27 3.882 7.268 1.263 240 HG2 GLN 27 HG2 GLN 27 2.457 9.223 1.167 241 HG3 GLN 27 HG1 GLN 27 1.165 8.269 0.442 242 HE21 GLN 27 HE21 GLN 27 3.237 7.144 3.038 243 HE22 GLN 27 HE22 GLN 27 2.007 7.090 4.247 244 H VAL 28 HN VAL 28 2.978 5.249 -1.820 245 HA VAL 28 HA VAL 28 5.508 4.003 -1.427 246 HB VAL 28 HB VAL 28 3.166 3.169 -3.154 247 HG11 VAL 28 HG11 VAL 28 4.180 0.943 -3.149 248 HG12 VAL 28 HG12 VAL 28 5.577 1.586 -2.286 249 HG13 VAL 28 HG13 VAL 28 5.225 2.134 -3.924 250 HG21 VAL 28 HG21 VAL 28 2.622 3.281 -0.767 251 HG22 VAL 28 HG22 VAL 28 4.003 2.245 -0.405 252 HG23 VAL 28 HG23 VAL 28 2.649 1.613 -1.341 253 H ASP 29 HN ASP 29 3.791 5.245 -4.283 254 HA ASP 29 HA ASP 29 5.732 4.621 -6.191 255 HB2 ASP 29 HB2 ASP 29 3.638 6.793 -6.117 256 HB3 ASP 29 HB1 ASP 29 4.712 6.576 -7.494 257 H SER 30 HN SER 30 5.414 7.428 -4.079 258 HA SER 30 HA SER 30 7.529 8.912 -5.221 259 HB2 SER 30 HB2 SER 30 5.832 9.882 -3.668 260 HB3 SER 30 HB1 SER 30 6.576 8.987 -2.344 261 HG SER 30 HG SER 30 8.508 10.156 -2.725 262 H LEU 31 HN LEU 31 7.424 6.467 -2.653 263 HA LEU 31 HA LEU 31 10.101 6.861 -1.802 264 HB2 LEU 31 HB2 LEU 31 8.389 5.760 -0.409 265 HB3 LEU 31 HB1 LEU 31 8.353 4.415 -1.533 266 HG LEU 31 HG LEU 31 10.721 3.929 -0.998 267 HD11 LEU 31 HD11 LEU 31 11.696 4.983 1.018 268 HD12 LEU 31 HD12 LEU 31 10.358 6.134 1.023 269 HD13 LEU 31 HD13 LEU 31 11.493 6.104 -0.328 270 HD21 LEU 31 HD21 LEU 31 10.311 3.026 1.235 271 HD22 LEU 31 HD22 LEU 31 8.943 2.746 0.159 272 HD23 LEU 31 HD23 LEU 31 8.865 4.024 1.372 273 H LEU 32 HN LEU 32 8.579 4.730 -4.172 274 HA LEU 32 HA LEU 32 10.865 3.119 -4.631 275 HB2 LEU 32 HB2 LEU 32 8.449 3.660 -6.362 276 HB3 LEU 32 HB1 LEU 32 9.625 2.392 -6.655 277 HG LEU 32 HG LEU 32 7.886 2.579 -4.197 278 HD11 LEU 32 HD11 LEU 32 6.622 0.743 -5.181 279 HD12 LEU 32 HD12 LEU 32 7.610 0.838 -6.640 280 HD13 LEU 32 HD13 LEU 32 6.556 2.181 -6.198 281 HD21 LEU 32 HD21 LEU 32 9.691 0.391 -5.215 282 HD22 LEU 32 HD22 LEU 32 8.614 0.266 -3.826 283 HD23 LEU 32 HD23 LEU 32 9.965 1.397 -3.793 284 H SER 33 HN SER 33 9.497 5.949 -6.262 285 HA SER 33 HA SER 33 11.372 5.993 -8.376 286 HB2 SER 33 HB2 SER 33 10.554 8.399 -8.619 287 HB3 SER 33 HB1 SER 33 9.333 7.133 -8.744 288 HG SER 33 HG SER 33 8.501 7.707 -6.849 289 H GLU 34 HN GLU 34 11.427 7.250 -5.112 290 HA GLU 34 HA GLU 34 13.678 8.989 -5.570 291 HB2 GLU 34 HB2 GLU 34 12.350 8.021 -3.038 292 HB3 GLU 34 HB1 GLU 34 13.738 9.099 -3.055 293 HG2 GLU 34 HG2 GLU 34 12.452 10.763 -4.275 294 HG3 GLU 34 HG1 GLU 34 11.060 9.682 -4.301 295 H SER 35 HN SER 35 13.076 5.717 -4.611 296 HA SER 35 HA SER 35 15.707 5.121 -3.695 297 HB2 SER 35 HB2 SER 35 13.494 3.281 -4.637 298 HB3 SER 35 HB1 SER 35 14.957 2.766 -3.799 299 HG SER 35 HG SER 35 12.875 4.425 -2.805 300 H GLN 36 HN GLN 36 14.579 5.800 -6.765 301 HA GLN 36 HA GLN 36 16.387 3.877 -8.058 302 HB2 GLN 36 HB2 GLN 36 14.002 5.380 -9.152 303 HB3 GLN 36 HB1 GLN 36 15.105 4.436 -10.147 304 HG2 GLN 36 HG2 GLN 36 14.501 2.418 -8.978 305 HG3 GLN 36 HG1 GLN 36 13.488 3.330 -7.861 306 HE21 GLN 36 HE21 GLN 36 12.818 1.139 -9.653 307 HE22 GLN 36 HE22 GLN 36 11.552 1.731 -10.674 308 H LEU 37 HN LEU 37 16.505 6.790 -6.838 309 HA LEU 37 HA LEU 37 17.620 8.323 -8.995 310 HB2 LEU 37 HB2 LEU 37 17.731 8.751 -6.005 311 HB3 LEU 37 HB1 LEU 37 18.238 9.918 -7.208 312 HG LEU 37 HG LEU 37 15.410 8.905 -6.939 313 HD11 LEU 37 HD11 LEU 37 16.655 11.450 -5.912 314 HD12 LEU 37 HD12 LEU 37 16.030 10.121 -4.936 315 HD13 LEU 37 HD13 LEU 37 14.930 11.085 -5.921 316 HD21 LEU 37 HD21 LEU 37 16.616 11.190 -8.489 317 HD22 LEU 37 HD22 LEU 37 14.889 10.877 -8.316 318 HD23 LEU 37 HD23 LEU 37 15.913 9.718 -9.157 319 H LYS 38 HN LYS 38 19.793 8.818 -9.318 320 HA LYS 38 HA LYS 38 21.661 6.773 -8.710 321 HB2 LYS 38 HB2 LYS 38 21.833 8.145 -10.747 322 HB3 LYS 38 HB1 LYS 38 22.136 9.570 -9.765 323 HG2 LYS 38 HG2 LYS 38 24.211 8.552 -8.938 324 HG3 LYS 38 HG1 LYS 38 23.916 7.146 -9.961 325 HD2 LYS 38 HD2 LYS 38 24.028 8.552 -11.947 326 HD3 LYS 38 HD1 LYS 38 24.269 9.979 -10.937 327 HE2 LYS 38 HE2 LYS 38 26.116 7.600 -11.054 328 HE3 LYS 38 HE1 LYS 38 26.370 9.121 -11.904 329 HZ1 LYS 38 HZ1 LYS 38 26.453 10.253 -9.765 330 HZ2 LYS 38 HZ2 LYS 38 27.634 9.051 -9.864 331 HZ3 LYS 38 HZ3 LYS 38 26.235 8.781 -8.957 332 H GLU 39 HN GLU 39 20.868 9.851 -7.253 333 HA GLU 39 HA GLU 39 23.116 9.955 -5.508 334 HB2 GLU 39 HB2 GLU 39 20.402 11.262 -5.261 335 HB3 GLU 39 HB1 GLU 39 21.787 11.623 -4.244 336 HG2 GLU 39 HG2 GLU 39 21.566 12.088 -7.203 337 HG3 GLU 39 HG1 GLU 39 21.540 13.310 -5.936 338 H ALA 40 HN ALA 40 20.266 8.103 -5.553 339 HA ALA 40 HA ALA 40 20.090 7.705 -2.706 340 HB1 ALA 40 HB1 ALA 40 18.284 6.159 -3.234 341 HB2 ALA 40 HB2 ALA 40 18.664 6.299 -4.951 342 HB3 ALA 40 HB3 ALA 40 18.068 7.700 -4.062 343 H LEU 41 HN LEU 41 22.156 6.623 -5.004 344 HA LEU 41 HA LEU 41 22.495 3.906 -4.236 345 HB2 LEU 41 HB2 LEU 41 23.365 4.849 -6.347 346 HB3 LEU 41 HB1 LEU 41 24.490 5.837 -5.438 347 HG LEU 41 HG LEU 41 25.587 3.774 -4.609 348 HD11 LEU 41 HD11 LEU 41 23.722 2.239 -4.767 349 HD12 LEU 41 HD12 LEU 41 25.078 1.646 -5.724 350 HD13 LEU 41 HD13 LEU 41 23.703 2.407 -6.521 351 HD21 LEU 41 HD21 LEU 41 25.394 4.035 -7.606 352 HD22 LEU 41 HD22 LEU 41 26.671 3.192 -6.729 353 HD23 LEU 41 HD23 LEU 41 26.477 4.935 -6.545 354 H GLU 42 HN GLU 42 23.158 6.851 -2.760 355 HA GLU 42 HA GLU 42 25.353 6.209 -1.114 356 HB2 GLU 42 HB2 GLU 42 24.699 8.505 -1.437 357 HB3 GLU 42 HB1 GLU 42 23.085 8.186 -0.825 358 HG2 GLU 42 HG2 GLU 42 24.479 9.406 0.768 359 HG3 GLU 42 HG1 GLU 42 23.948 7.847 1.396 360 HA PRO 43 HA PRO 43 23.251 3.064 1.353 361 HB2 PRO 43 HB2 PRO 43 25.238 3.047 3.306 362 HB3 PRO 43 HB1 PRO 43 25.203 2.027 1.864 363 HG2 PRO 43 HG2 PRO 43 26.662 4.584 2.347 364 HG3 PRO 43 HG1 PRO 43 27.186 3.139 1.465 365 HD2 PRO 43 HD2 PRO 43 26.394 5.330 0.165 366 HD3 PRO 43 HD1 PRO 43 25.973 3.710 -0.437 367 H ASN 44 HN ASN 44 24.538 6.105 2.604 368 HA ASN 44 HA ASN 44 23.257 5.989 5.119 369 HB2 ASN 44 HB2 ASN 44 24.200 8.358 3.491 370 HB3 ASN 44 HB1 ASN 44 23.531 8.506 5.115 371 HD21 ASN 44 HD21 ASN 44 26.191 9.217 4.213 372 HD22 ASN 44 HD22 ASN 44 27.295 8.262 5.139 373 H LYS 45 HN LYS 45 22.199 7.395 2.001 374 HA LYS 45 HA LYS 45 19.678 8.234 3.003 375 HB2 LYS 45 HB2 LYS 45 20.643 9.242 1.004 376 HB3 LYS 45 HB1 LYS 45 20.644 7.688 0.185 377 HG2 LYS 45 HG2 LYS 45 18.829 9.074 -0.620 378 HG3 LYS 45 HG1 LYS 45 18.194 7.663 0.225 379 HD2 LYS 45 HD2 LYS 45 16.929 9.630 0.846 380 HD3 LYS 45 HD1 LYS 45 17.852 9.055 2.234 381 HE2 LYS 45 HE2 LYS 45 17.969 11.474 2.079 382 HE3 LYS 45 HE1 LYS 45 19.556 10.764 1.794 383 HZ1 LYS 45 HZ1 LYS 45 19.135 12.506 0.211 384 HZ2 LYS 45 HZ2 LYS 45 17.691 11.782 -0.275 385 HZ3 LYS 45 HZ3 LYS 45 19.163 11.023 -0.599 386 H ARG 46 HN ARG 46 20.924 5.310 1.550 387 HA ARG 46 HA ARG 46 18.550 3.976 0.957 388 HB2 ARG 46 HB2 ARG 46 20.742 3.183 0.239 389 HB3 ARG 46 HB1 ARG 46 21.195 2.859 1.905 390 HG2 ARG 46 HG2 ARG 46 19.511 1.126 2.055 391 HG3 ARG 46 HG1 ARG 46 18.980 1.478 0.409 392 HD2 ARG 46 HD2 ARG 46 21.734 0.533 1.194 393 HD3 ARG 46 HD1 ARG 46 20.465 -0.480 0.507 394 HE ARG 46 HE ARG 46 20.610 1.232 -1.423 395 HH11 ARG 46 HH11 ARG 46 23.322 0.048 0.473 396 HH12 ARG 46 HH12 ARG 46 24.466 0.310 -0.814 397 HH21 ARG 46 HH21 ARG 46 22.127 1.546 -3.089 398 HH22 ARG 46 HH22 ARG 46 23.797 1.160 -2.817 399 H GLN 47 HN GLN 47 20.289 4.306 3.994 400 HA GLN 47 HA GLN 47 18.815 2.506 5.556 401 HB2 GLN 47 HB2 GLN 47 20.175 5.090 6.334 402 HB3 GLN 47 HB1 GLN 47 19.601 3.877 7.472 403 HG2 GLN 47 HG2 GLN 47 21.179 2.292 6.717 404 HG3 GLN 47 HG1 GLN 47 21.611 3.283 5.326 405 HE21 GLN 47 HE21 GLN 47 23.769 3.346 5.863 406 HE22 GLN 47 HE22 GLN 47 24.370 4.258 7.204 407 H HIS 48 HN HIS 48 18.279 5.880 4.737 408 HA HIS 48 HA HIS 48 16.063 6.332 6.433 409 HB2 HIS 48 HB2 HIS 48 17.444 8.121 5.298 410 HB3 HIS 48 HB1 HIS 48 16.665 7.688 3.781 411 HD1 HIS 48 HD1 HIS 48 16.206 9.676 6.846 412 HD2 HIS 48 HD2 HIS 48 13.883 8.387 3.651 413 HE1 HIS 48 HE1 HIS 48 14.123 11.080 6.915 414 HE2 HIS 48 HE2 HIS 48 12.840 10.427 4.849 415 H ILE 49 HN ILE 49 16.416 5.013 3.212 416 HA ILE 49 HA ILE 49 13.677 5.051 2.480 417 HB ILE 49 HB ILE 49 15.948 3.314 1.491 418 HG12 ILE 49 HG12 ILE 49 14.701 5.806 0.307 419 HG13 ILE 49 HG11 ILE 49 16.234 5.762 1.172 420 HG21 ILE 49 HG21 ILE 49 13.779 2.285 1.032 421 HG22 ILE 49 HG22 ILE 49 14.554 2.849 -0.450 422 HG23 ILE 49 HG23 ILE 49 13.233 3.775 0.263 423 HD11 ILE 49 HD11 ILE 49 16.557 5.818 -1.239 424 HD12 ILE 49 HD12 ILE 49 15.629 4.329 -1.404 425 HD13 ILE 49 HD13 ILE 49 17.169 4.318 -0.548 426 H TYR 50 HN TYR 50 15.763 2.466 3.792 427 HA TYR 50 HA TYR 50 13.927 0.425 3.946 428 HB2 TYR 50 HB2 TYR 50 16.322 0.168 4.446 429 HB3 TYR 50 HB1 TYR 50 16.112 1.075 5.938 430 HD1 TYR 50 HD1 TYR 50 16.128 -0.197 7.845 431 HD2 TYR 50 HD2 TYR 50 14.480 -1.889 4.300 432 HE1 TYR 50 HE1 TYR 50 15.666 -2.283 9.059 433 HE2 TYR 50 HE2 TYR 50 14.018 -3.983 5.512 434 HH TYR 50 HH TYR 50 14.790 -5.176 7.482 435 H GLN 51 HN GLN 51 14.418 3.067 6.246 436 HA GLN 51 HA GLN 51 12.664 2.126 8.244 437 HB2 GLN 51 HB2 GLN 51 14.267 3.922 8.691 438 HB3 GLN 51 HB1 GLN 51 13.461 4.958 7.522 439 HG2 GLN 51 HG2 GLN 51 12.889 5.584 9.797 440 HG3 GLN 51 HG1 GLN 51 11.473 5.028 8.911 441 HE21 GLN 51 HE21 GLN 51 10.351 4.555 10.776 442 HE22 GLN 51 HE22 GLN 51 10.733 3.195 11.775 443 H ARG 52 HN ARG 52 12.128 4.278 5.477 444 HA ARG 52 HA ARG 52 9.408 4.804 6.078 445 HB2 ARG 52 HB2 ARG 52 10.898 4.997 3.455 446 HB3 ARG 52 HB1 ARG 52 9.282 5.632 3.737 447 HG2 ARG 52 HG2 ARG 52 11.818 6.526 5.098 448 HG3 ARG 52 HG1 ARG 52 10.923 7.401 3.855 449 HD2 ARG 52 HD2 ARG 52 8.966 7.449 5.409 450 HD3 ARG 52 HD1 ARG 52 9.997 6.744 6.652 451 HE ARG 52 HE ARG 52 10.644 9.340 5.398 452 HH11 ARG 52 HH11 ARG 52 10.094 7.384 8.270 453 HH12 ARG 52 HH12 ARG 52 10.502 8.672 9.362 454 HH21 ARG 52 HH21 ARG 52 11.171 11.021 6.859 455 HH22 ARG 52 HH22 ARG 52 11.099 10.724 8.568 456 H CYS 53 HN CYS 53 11.040 2.295 4.318 457 HA CYS 53 HA CYS 53 8.810 1.219 2.944 458 HB2 CYS 53 HB2 CYS 53 11.088 0.556 2.340 459 HB3 CYS 53 HB1 CYS 53 11.317 -0.180 3.929 460 HG CYS 53 HG CYS 53 10.501 -1.711 1.300 461 H ILE 54 HN ILE 54 10.242 0.466 6.094 462 HA ILE 54 HA ILE 54 8.484 -1.522 6.912 463 HB ILE 54 HB ILE 54 9.903 0.569 8.559 464 HG12 ILE 54 HG12 ILE 54 10.533 -2.341 8.000 465 HG13 ILE 54 HG11 ILE 54 11.374 -0.957 7.301 466 HG21 ILE 54 HG21 ILE 54 9.500 -0.861 10.496 467 HG22 ILE 54 HG22 ILE 54 8.530 -1.944 9.499 468 HG23 ILE 54 HG23 ILE 54 7.984 -0.294 9.793 469 HD11 ILE 54 HD11 ILE 54 12.150 -0.315 9.526 470 HD12 ILE 54 HD12 ILE 54 12.651 -1.953 9.106 471 HD13 ILE 54 HD13 ILE 54 11.307 -1.701 10.218 472 H GLN 55 HN GLN 55 8.215 1.988 7.272 473 HA GLN 55 HA GLN 55 5.885 2.013 8.839 474 HB2 GLN 55 HB2 GLN 55 6.781 4.110 6.856 475 HB3 GLN 55 HB1 GLN 55 5.704 4.354 8.224 476 HG2 GLN 55 HG2 GLN 55 7.486 3.916 9.771 477 HG3 GLN 55 HG1 GLN 55 8.574 3.490 8.452 478 HE21 GLN 55 HE21 GLN 55 6.302 6.151 8.359 479 HE22 GLN 55 HE22 GLN 55 7.490 7.407 8.357 480 H LEU 56 HN LEU 56 6.246 2.505 5.325 481 HA LEU 56 HA LEU 56 3.549 2.577 4.704 482 HB2 LEU 56 HB2 LEU 56 5.767 1.487 2.969 483 HB3 LEU 56 HB1 LEU 56 4.202 2.036 2.410 484 HG LEU 56 HG LEU 56 6.363 3.749 3.639 485 HD11 LEU 56 HD11 LEU 56 5.257 3.636 0.842 486 HD12 LEU 56 HD12 LEU 56 6.839 3.050 1.358 487 HD13 LEU 56 HD13 LEU 56 6.469 4.774 1.431 488 HD21 LEU 56 HD21 LEU 56 4.210 4.602 4.311 489 HD22 LEU 56 HD22 LEU 56 3.612 4.494 2.656 490 HD23 LEU 56 HD23 LEU 56 4.888 5.642 3.058 491 H LYS 57 HN LYS 57 5.676 -0.235 5.048 492 HA LYS 57 HA LYS 57 3.912 -2.200 4.129 493 HB2 LYS 57 HB2 LYS 57 6.209 -2.765 4.656 494 HB3 LYS 57 HB1 LYS 57 5.969 -2.336 6.344 495 HG2 LYS 57 HG2 LYS 57 4.250 -4.179 6.453 496 HG3 LYS 57 HG1 LYS 57 4.811 -4.681 4.857 497 HD2 LYS 57 HD2 LYS 57 6.655 -4.381 7.218 498 HD3 LYS 57 HD1 LYS 57 5.827 -5.888 6.837 499 HE2 LYS 57 HE2 LYS 57 7.590 -4.432 4.881 500 HE3 LYS 57 HE1 LYS 57 8.184 -5.682 5.973 501 HZ1 LYS 57 HZ1 LYS 57 7.641 -6.572 3.788 502 HZ2 LYS 57 HZ2 LYS 57 6.038 -6.058 3.955 503 HZ3 LYS 57 HZ3 LYS 57 6.653 -7.247 4.981 504 H GLN 58 HN GLN 58 4.313 -0.805 7.354 505 HA GLN 58 HA GLN 58 2.310 -2.250 8.672 506 HB2 GLN 58 HB2 GLN 58 3.328 0.549 9.166 507 HB3 GLN 58 HB1 GLN 58 2.258 -0.312 10.261 508 HG2 GLN 58 HG2 GLN 58 3.935 -1.990 10.659 509 HG3 GLN 58 HG1 GLN 58 4.998 -1.258 9.455 510 HE21 GLN 58 HE21 GLN 58 4.327 1.459 10.266 511 HE22 GLN 58 HE22 GLN 58 5.143 1.729 11.766 512 H ALA 59 HN ALA 59 2.148 0.780 6.856 513 HA ALA 59 HA ALA 59 -0.541 1.384 7.449 514 HB1 ALA 59 HB1 ALA 59 1.099 2.206 5.055 515 HB2 ALA 59 HB2 ALA 59 1.050 3.038 6.609 516 HB3 ALA 59 HB3 ALA 59 -0.397 2.963 5.604 517 H ILE 60 HN ILE 60 0.954 -0.349 4.731 518 HA ILE 60 HA ILE 60 -1.457 -0.734 3.292 519 HB ILE 60 HB ILE 60 1.096 -2.353 3.212 520 HG12 ILE 60 HG12 ILE 60 0.099 -0.143 1.399 521 HG13 ILE 60 HG11 ILE 60 1.331 0.055 2.641 522 HG21 ILE 60 HG21 ILE 60 -1.202 -2.274 1.256 523 HG22 ILE 60 HG22 ILE 60 -0.806 -3.615 2.328 524 HG23 ILE 60 HG23 ILE 60 0.308 -3.159 1.041 525 HD11 ILE 60 HD11 ILE 60 1.530 -1.700 0.205 526 HD12 ILE 60 HD12 ILE 60 2.760 -1.548 1.459 527 HD13 ILE 60 HD13 ILE 60 2.345 -0.157 0.456 528 H ASP 61 HN ASP 61 0.304 -2.742 5.618 529 HA ASP 61 HA ASP 61 -1.378 -4.990 5.577 530 HB2 ASP 61 HB2 ASP 61 0.802 -5.031 6.700 531 HB3 ASP 61 HB1 ASP 61 0.247 -3.834 7.868 532 H GLU 62 HN GLU 62 -1.507 -2.018 7.425 533 HA GLU 62 HA GLU 62 -3.680 -2.651 9.077 534 HB2 GLU 62 HB2 GLU 62 -2.145 -0.736 9.426 535 HB3 GLU 62 HB1 GLU 62 -2.870 0.071 8.043 536 HG2 GLU 62 HG2 GLU 62 -5.015 0.126 9.192 537 HG3 GLU 62 HG1 GLU 62 -4.298 -0.701 10.574 538 H ASN 63 HN ASN 63 -3.578 -0.958 5.946 539 HA ASN 63 HA ASN 63 -6.384 -0.629 5.748 540 HB2 ASN 63 HB2 ASN 63 -4.150 -0.511 3.743 541 HB3 ASN 63 HB1 ASN 63 -5.830 -0.409 3.227 542 HD21 ASN 63 HD21 ASN 63 -5.593 1.697 2.497 543 HD22 ASN 63 HD22 ASN 63 -5.420 3.034 3.583 544 H LYS 64 HN LYS 64 -4.176 -3.135 4.552 545 HA LYS 64 HA LYS 64 -5.990 -4.702 3.145 546 HB2 LYS 64 HB2 LYS 64 -3.608 -5.140 3.111 547 HB3 LYS 64 HB1 LYS 64 -3.608 -5.501 4.829 548 HG2 LYS 64 HG2 LYS 64 -5.020 -7.470 4.387 549 HG3 LYS 64 HG1 LYS 64 -4.920 -7.117 2.658 550 HD2 LYS 64 HD2 LYS 64 -2.524 -7.400 2.695 551 HD3 LYS 64 HD1 LYS 64 -2.540 -7.617 4.444 552 HE2 LYS 64 HE2 LYS 64 -2.326 -9.760 3.307 553 HE3 LYS 64 HE1 LYS 64 -3.855 -9.665 4.178 554 HZ1 LYS 64 HZ1 LYS 64 -4.061 -10.618 1.938 555 HZ2 LYS 64 HZ2 LYS 64 -3.546 -9.153 1.272 556 HZ3 LYS 64 HZ3 LYS 64 -4.996 -9.228 2.138 557 H ASN 65 HN ASN 65 -5.189 -4.743 6.599 558 HA ASN 65 HA ASN 65 -6.966 -6.836 7.290 559 HB2 ASN 65 HB2 ASN 65 -5.608 -4.674 8.885 560 HB3 ASN 65 HB1 ASN 65 -6.717 -5.811 9.638 561 HD21 ASN 65 HD21 ASN 65 -3.857 -5.417 10.059 562 HD22 ASN 65 HD22 ASN 65 -3.115 -6.945 9.748 563 H ALA 66 HN ALA 66 -7.293 -3.330 7.219 564 HA ALA 66 HA ALA 66 -9.869 -3.191 8.367 565 HB1 ALA 66 HB1 ALA 66 -9.975 -0.945 7.400 566 HB2 ALA 66 HB2 ALA 66 -8.561 -1.301 6.408 567 HB3 ALA 66 HB3 ALA 66 -8.413 -1.234 8.163 568 H LEU 67 HN LEU 67 -8.724 -3.536 5.060 569 HA LEU 67 HA LEU 67 -11.233 -3.350 3.792 570 HB2 LEU 67 HB2 LEU 67 -9.125 -3.031 2.614 571 HB3 LEU 67 HB1 LEU 67 -8.678 -4.698 2.913 572 HG LEU 67 HG LEU 67 -10.541 -5.445 1.488 573 HD11 LEU 67 HD11 LEU 67 -12.071 -3.591 1.779 574 HD12 LEU 67 HD12 LEU 67 -11.704 -3.815 0.070 575 HD13 LEU 67 HD13 LEU 67 -10.942 -2.505 0.970 576 HD21 LEU 67 HD21 LEU 67 -8.675 -3.466 0.196 577 HD22 LEU 67 HD22 LEU 67 -9.568 -4.735 -0.642 578 HD23 LEU 67 HD23 LEU 67 -8.326 -5.160 0.535 579 H GLN 68 HN GLN 68 -9.315 -6.160 4.853 580 HA GLN 68 HA GLN 68 -11.067 -8.153 3.987 581 HB2 GLN 68 HB2 GLN 68 -8.765 -8.545 4.847 582 HB3 GLN 68 HB1 GLN 68 -9.347 -8.215 6.474 583 HG2 GLN 68 HG2 GLN 68 -10.921 -10.116 6.240 584 HG3 GLN 68 HG1 GLN 68 -10.191 -10.478 4.678 585 HE21 GLN 68 HE21 GLN 68 -8.417 -9.349 7.483 586 HE22 GLN 68 HE22 GLN 68 -7.534 -10.811 7.743 587 H LYS 69 HN LYS 69 -11.233 -6.037 6.725 588 HA LYS 69 HA LYS 69 -13.179 -7.548 8.184 589 HB2 LYS 69 HB2 LYS 69 -11.555 -5.947 9.215 590 HB3 LYS 69 HB1 LYS 69 -12.415 -4.627 8.440 591 HG2 LYS 69 HG2 LYS 69 -14.390 -5.106 9.748 592 HG3 LYS 69 HG1 LYS 69 -13.600 -6.504 10.477 593 HD2 LYS 69 HD2 LYS 69 -11.915 -5.047 11.470 594 HD3 LYS 69 HD1 LYS 69 -12.680 -3.642 10.725 595 HE2 LYS 69 HE2 LYS 69 -14.039 -5.484 12.685 596 HE3 LYS 69 HE1 LYS 69 -13.256 -3.970 13.128 597 HZ1 LYS 69 HZ1 LYS 69 -14.801 -2.792 11.692 598 HZ2 LYS 69 HZ2 LYS 69 -15.633 -3.691 12.856 599 HZ3 LYS 69 HZ3 LYS 69 -15.551 -4.248 11.263 600 H LEU 70 HN LEU 70 -13.289 -5.524 5.476 601 HA LEU 70 HA LEU 70 -16.141 -4.912 5.832 602 HB2 LEU 70 HB2 LEU 70 -14.186 -3.892 3.765 603 HB3 LEU 70 HB1 LEU 70 -15.842 -3.358 3.961 604 HG LEU 70 HG LEU 70 -13.674 -2.989 6.027 605 HD11 LEU 70 HD11 LEU 70 -14.841 -1.009 4.076 606 HD12 LEU 70 HD12 LEU 70 -13.216 -1.692 4.008 607 HD13 LEU 70 HD13 LEU 70 -13.680 -0.648 5.352 608 HD21 LEU 70 HD21 LEU 70 -15.288 -1.424 7.030 609 HD22 LEU 70 HD22 LEU 70 -15.883 -3.083 7.006 610 HD23 LEU 70 HD23 LEU 70 -16.484 -1.914 5.831 611 H SER 71 HN SER 71 -15.888 -7.526 5.411 612 HA SER 71 HA SER 71 -16.020 -7.973 2.511 613 HB2 SER 71 HB2 SER 71 -14.348 -9.272 3.894 614 HB3 SER 71 HB1 SER 71 -15.719 -10.064 4.673 615 HG SER 71 HG SER 71 -14.910 -11.279 2.918 616 H LYS 72 HN LYS 72 -17.636 -9.405 1.668 617 HA LYS 72 HA LYS 72 -19.788 -9.985 1.273 618 HB2 LYS 72 HB2 LYS 72 -19.813 -10.554 4.250 619 HB3 LYS 72 HB1 LYS 72 -20.969 -11.177 3.078 620 HG2 LYS 72 HG2 LYS 72 -19.092 -12.366 1.937 621 HG3 LYS 72 HG1 LYS 72 -18.016 -11.826 3.231 622 HD2 LYS 72 HD2 LYS 72 -19.523 -12.968 4.866 623 HD3 LYS 72 HD1 LYS 72 -20.442 -13.612 3.502 624 HE2 LYS 72 HE2 LYS 72 -17.522 -14.104 4.077 625 HE3 LYS 72 HE1 LYS 72 -18.837 -15.248 4.327 626 HZ1 LYS 72 HZ1 LYS 72 -17.632 -15.675 2.275 627 HZ2 LYS 72 HZ2 LYS 72 -18.010 -14.133 1.703 628 HZ3 LYS 72 HZ3 LYS 72 -19.240 -15.266 1.957 629 H ALA 73 HN ALA 73 -19.267 -7.222 1.865 630 HA ALA 73 HA ALA 73 -21.341 -6.250 3.599 631 HB1 ALA 73 HB1 ALA 73 -19.503 -4.734 1.760 632 HB2 ALA 73 HB2 ALA 73 -19.177 -5.125 3.449 633 HB3 ALA 73 HB3 ALA 73 -20.507 -4.043 3.035 634 H ASP 74 HN ASP 74 -21.036 -6.904 0.214 635 HA ASP 74 HA ASP 74 -23.208 -5.131 -0.535 636 HB2 ASP 74 HB2 ASP 74 -21.278 -5.613 -2.071 637 HB3 ASP 74 HB1 ASP 74 -21.872 -7.263 -2.221 638 H GLU 75 HN GLU 75 -22.753 -8.409 0.385 639 HA GLU 75 HA GLU 75 -24.187 -10.064 0.955 640 HB2 GLU 75 HB2 GLU 75 -26.316 -7.958 0.552 641 HB3 GLU 75 HB1 GLU 75 -26.564 -9.519 1.319 642 HG2 GLU 75 HG2 GLU 75 -25.154 -8.932 3.142 643 HG3 GLU 75 HG1 GLU 75 -24.628 -7.456 2.330 644 H SER 76 HN SER 76 -26.218 -11.276 0.119 645 HA SER 76 HA SER 76 -27.318 -12.391 -1.507 646 HB2 SER 76 HB2 SER 76 -28.045 -10.076 -2.166 647 HB3 SER 76 HB1 SER 76 -26.712 -10.039 -3.314 648 HG SER 76 HG SER 76 -29.005 -11.698 -3.314 649 H ALA 77 HN ALA 77 -26.946 -12.913 -4.119 650 HA ALA 77 HA ALA 77 -24.338 -14.187 -4.102 651 HB1 ALA 77 HB1 ALA 77 -25.138 -15.507 -5.962 652 HB2 ALA 77 HB2 ALA 77 -26.592 -14.517 -6.067 653 HB3 ALA 77 HB3 ALA 77 -26.310 -15.520 -4.646 654 HA PRO 78 HA PRO 78 -23.960 -11.720 -8.269 655 HB2 PRO 78 HB2 PRO 78 -25.558 -9.544 -8.589 656 HB3 PRO 78 HB1 PRO 78 -26.004 -11.154 -9.168 657 HG2 PRO 78 HG2 PRO 78 -26.834 -9.748 -6.657 658 HG3 PRO 78 HG1 PRO 78 -27.827 -10.675 -7.797 659 HD2 PRO 78 HD2 PRO 78 -26.966 -11.735 -5.476 660 HD3 PRO 78 HD1 PRO 78 -27.124 -12.708 -6.951 661 H VAL 79 HN VAL 79 -22.205 -11.332 -6.717 662 HA VAL 79 HA VAL 79 -22.086 -8.551 -5.769 663 HB VAL 79 HB VAL 79 -20.179 -9.358 -4.348 664 HG11 VAL 79 HG11 VAL 79 -22.838 -10.712 -3.925 665 HG12 VAL 79 HG12 VAL 79 -22.420 -9.070 -3.434 666 HG13 VAL 79 HG13 VAL 79 -21.608 -10.447 -2.690 667 HG21 VAL 79 HG21 VAL 79 -21.146 -12.087 -5.187 668 HG22 VAL 79 HG22 VAL 79 -19.907 -11.739 -3.983 669 HG23 VAL 79 HG23 VAL 79 -19.622 -11.348 -5.678 670 H ALA 80 HN ALA 80 -21.577 -9.533 -8.513 671 HA ALA 80 HA ALA 80 -18.906 -9.900 -9.131 672 HB1 ALA 80 HB1 ALA 80 -19.501 -9.263 -11.403 673 HB2 ALA 80 HB2 ALA 80 -21.020 -8.584 -10.820 674 HB3 ALA 80 HB3 ALA 80 -20.722 -10.318 -10.693 675 H ASN 81 HN ASN 81 -20.746 -6.882 -9.068 676 HA ASN 81 HA ASN 81 -18.587 -5.256 -9.940 677 HB2 ASN 81 HB2 ASN 81 -21.247 -4.639 -8.670 678 HB3 ASN 81 HB1 ASN 81 -20.068 -3.369 -8.972 679 HD21 ASN 81 HD21 ASN 81 -22.207 -5.699 -10.430 680 HD22 ASN 81 HD22 ASN 81 -22.173 -5.023 -12.021 681 H TYR 82 HN TYR 82 -20.000 -5.809 -6.723 682 HA TYR 82 HA TYR 82 -18.294 -3.945 -5.435 683 HB2 TYR 82 HB2 TYR 82 -20.534 -4.818 -4.585 684 HB3 TYR 82 HB1 TYR 82 -19.685 -6.279 -4.107 685 HD1 TYR 82 HD1 TYR 82 -18.055 -6.216 -2.231 686 HD2 TYR 82 HD2 TYR 82 -20.303 -2.770 -3.345 687 HE1 TYR 82 HE1 TYR 82 -17.515 -5.169 -0.077 688 HE2 TYR 82 HE2 TYR 82 -19.751 -1.717 -1.198 689 HH TYR 82 HH TYR 82 -19.104 -2.424 1.079 690 H ASN 83 HN ASN 83 -18.138 -7.470 -5.863 691 HA ASN 83 HA ASN 83 -15.824 -7.739 -4.225 692 HB2 ASN 83 HB2 ASN 83 -17.217 -9.583 -6.138 693 HB3 ASN 83 HB1 ASN 83 -15.653 -10.015 -5.455 694 HD21 ASN 83 HD21 ASN 83 -16.489 -11.754 -4.309 695 HD22 ASN 83 HD22 ASN 83 -17.480 -11.544 -2.908 696 H GLN 84 HN GLN 84 -16.330 -7.008 -7.596 697 HA GLN 84 HA GLN 84 -13.725 -7.615 -8.497 698 HB2 GLN 84 HB2 GLN 84 -15.527 -7.237 -10.083 699 HB3 GLN 84 HB1 GLN 84 -15.704 -5.578 -9.528 700 HG2 GLN 84 HG2 GLN 84 -13.565 -4.983 -10.409 701 HG3 GLN 84 HG1 GLN 84 -13.203 -6.664 -10.792 702 HE21 GLN 84 HE21 GLN 84 -13.320 -4.273 -12.487 703 HE22 GLN 84 HE22 GLN 84 -14.438 -4.658 -13.749 704 H ARG 85 HN ARG 85 -15.169 -4.595 -7.327 705 HA ARG 85 HA ARG 85 -12.817 -3.042 -7.513 706 HB2 ARG 85 HB2 ARG 85 -15.027 -2.019 -7.286 707 HB3 ARG 85 HB1 ARG 85 -15.213 -2.731 -5.690 708 HG2 ARG 85 HG2 ARG 85 -13.487 -1.347 -4.794 709 HG3 ARG 85 HG1 ARG 85 -13.062 -0.754 -6.399 710 HD2 ARG 85 HD2 ARG 85 -15.721 -0.326 -5.049 711 HD3 ARG 85 HD1 ARG 85 -14.412 0.853 -5.088 712 HE ARG 85 HE ARG 85 -14.916 0.151 -7.717 713 HH11 ARG 85 HH11 ARG 85 -16.732 1.611 -5.090 714 HH12 ARG 85 HH12 ARG 85 -17.691 2.596 -6.145 715 HH21 ARG 85 HH21 ARG 85 -16.172 1.434 -9.096 716 HH22 ARG 85 HH22 ARG 85 -17.381 2.489 -8.433 717 H LYS 86 HN LYS 86 -14.199 -5.006 -4.943 718 HA LYS 86 HA LYS 86 -12.320 -4.431 -2.938 719 HB2 LYS 86 HB2 LYS 86 -14.358 -5.511 -2.342 720 HB3 LYS 86 HB1 LYS 86 -14.079 -6.824 -3.481 721 HG2 LYS 86 HG2 LYS 86 -12.133 -7.538 -2.088 722 HG3 LYS 86 HG1 LYS 86 -12.588 -6.300 -0.909 723 HD2 LYS 86 HD2 LYS 86 -14.356 -8.583 -1.806 724 HD3 LYS 86 HD1 LYS 86 -13.422 -8.548 -0.312 725 HE2 LYS 86 HE2 LYS 86 -15.712 -6.739 -1.082 726 HE3 LYS 86 HE1 LYS 86 -15.681 -7.944 0.201 727 HZ1 LYS 86 HZ1 LYS 86 -14.194 -5.389 0.104 728 HZ2 LYS 86 HZ2 LYS 86 -13.858 -6.604 1.223 729 HZ3 LYS 86 HZ3 LYS 86 -15.376 -5.856 1.222 730 H GLU 87 HN GLU 87 -12.407 -6.888 -5.461 731 HA GLU 87 HA GLU 87 -10.048 -8.259 -4.740 732 HB2 GLU 87 HB2 GLU 87 -11.774 -9.227 -6.171 733 HB3 GLU 87 HB1 GLU 87 -11.473 -8.005 -7.394 734 HG2 GLU 87 HG2 GLU 87 -9.182 -8.909 -7.652 735 HG3 GLU 87 HG1 GLU 87 -9.616 -10.202 -6.533 736 H GLU 88 HN GLU 88 -10.696 -5.522 -6.866 737 HA GLU 88 HA GLU 88 -8.141 -5.390 -8.051 738 HB2 GLU 88 HB2 GLU 88 -10.171 -4.265 -8.931 739 HB3 GLU 88 HB1 GLU 88 -10.096 -3.136 -7.590 740 HG2 GLU 88 HG2 GLU 88 -8.027 -2.237 -8.368 741 HG3 GLU 88 HG1 GLU 88 -7.894 -3.486 -9.603 742 H GLU 89 HN GLU 89 -9.503 -3.873 -5.150 743 HA GLU 89 HA GLU 89 -7.240 -2.365 -4.447 744 HB2 GLU 89 HB2 GLU 89 -9.259 -3.673 -2.611 745 HB3 GLU 89 HB1 GLU 89 -8.106 -2.437 -2.133 746 HG2 GLU 89 HG2 GLU 89 -10.408 -2.144 -4.041 747 HG3 GLU 89 HG1 GLU 89 -10.219 -1.395 -2.454 748 H HIS 90 HN HIS 90 -8.149 -5.702 -3.630 749 HA HIS 90 HA HIS 90 -5.897 -6.333 -2.084 750 HB2 HIS 90 HB2 HIS 90 -7.817 -7.962 -3.698 751 HB3 HIS 90 HB1 HIS 90 -6.338 -8.729 -3.138 752 HD1 HIS 90 HD1 HIS 90 -6.425 -9.699 -0.863 753 HD2 HIS 90 HD2 HIS 90 -9.366 -6.829 -1.448 754 HE1 HIS 90 HE1 HIS 90 -7.836 -9.747 1.215 755 HE2 HIS 90 HE2 HIS 90 -9.745 -8.183 0.720 756 H THR 91 HN THR 91 -6.414 -6.469 -5.569 757 HA THR 91 HA THR 91 -3.976 -7.672 -6.271 758 HB THR 91 HB THR 91 -5.612 -5.729 -7.916 759 HG1 THR 91 HG1 THR 91 -6.902 -7.472 -7.219 760 HG21 THR 91 HG21 THR 91 -3.386 -6.184 -8.846 761 HG22 THR 91 HG22 THR 91 -4.656 -6.900 -9.839 762 HG23 THR 91 HG23 THR 91 -3.704 -7.917 -8.757 763 H LEU 92 HN LEU 92 -4.891 -4.268 -5.850 764 HA LEU 92 HA LEU 92 -2.415 -3.230 -6.820 765 HB2 LEU 92 HB2 LEU 92 -4.408 -1.854 -6.869 766 HB3 LEU 92 HB1 LEU 92 -4.563 -1.957 -5.124 767 HG LEU 92 HG LEU 92 -2.277 -0.827 -5.010 768 HD11 LEU 92 HD11 LEU 92 -2.962 -0.184 -7.873 769 HD12 LEU 92 HD12 LEU 92 -1.622 -1.194 -7.327 770 HD13 LEU 92 HD13 LEU 92 -1.648 0.526 -6.936 771 HD21 LEU 92 HD21 LEU 92 -4.350 0.292 -4.429 772 HD22 LEU 92 HD22 LEU 92 -4.618 0.695 -6.125 773 HD23 LEU 92 HD23 LEU 92 -3.250 1.393 -5.259 774 H LEU 93 HN LEU 93 -3.786 -3.605 -3.549 775 HA LEU 93 HA LEU 93 -1.553 -2.552 -2.202 776 HB2 LEU 93 HB2 LEU 93 -3.854 -4.268 -1.348 777 HB3 LEU 93 HB1 LEU 93 -2.511 -4.028 -0.251 778 HG LEU 93 HG LEU 93 -2.886 -1.600 -0.306 779 HD11 LEU 93 HD11 LEU 93 -4.901 -0.680 -1.334 780 HD12 LEU 93 HD12 LEU 93 -5.260 -2.255 -2.041 781 HD13 LEU 93 HD13 LEU 93 -3.816 -1.374 -2.538 782 HD21 LEU 93 HD21 LEU 93 -5.341 -3.220 0.352 783 HD22 LEU 93 HD22 LEU 93 -5.006 -1.586 0.924 784 HD23 LEU 93 HD23 LEU 93 -3.965 -2.922 1.416 785 H ASP 94 HN ASP 94 -2.286 -5.786 -3.334 786 HA ASP 94 HA ASP 94 -0.195 -7.131 -1.992 787 HB2 ASP 94 HB2 ASP 94 -2.010 -8.355 -3.107 788 HB3 ASP 94 HB1 ASP 94 -1.476 -7.748 -4.673 789 H LYS 95 HN LYS 95 -0.324 -5.683 -5.273 790 HA LYS 95 HA LYS 95 2.337 -6.059 -5.954 791 HB2 LYS 95 HB2 LYS 95 0.574 -5.316 -7.510 792 HB3 LYS 95 HB1 LYS 95 0.495 -3.769 -6.679 793 HG2 LYS 95 HG2 LYS 95 2.862 -3.363 -7.330 794 HG3 LYS 95 HG1 LYS 95 2.807 -4.850 -8.284 795 HD2 LYS 95 HD2 LYS 95 0.867 -3.894 -9.526 796 HD3 LYS 95 HD1 LYS 95 1.117 -2.380 -8.659 797 HE2 LYS 95 HE2 LYS 95 2.158 -2.252 -10.834 798 HE3 LYS 95 HE1 LYS 95 3.399 -2.259 -9.583 799 HZ1 LYS 95 HZ1 LYS 95 3.923 -3.708 -11.478 800 HZ2 LYS 95 HZ2 LYS 95 2.563 -4.649 -11.131 801 HZ3 LYS 95 HZ3 LYS 95 3.834 -4.561 -10.022 802 H LEU 96 HN LEU 96 0.808 -3.330 -4.294 803 HA LEU 96 HA LEU 96 3.066 -1.716 -4.032 804 HB2 LEU 96 HB2 LEU 96 0.803 -1.997 -2.050 805 HB3 LEU 96 HB1 LEU 96 1.940 -0.666 -2.125 806 HG LEU 96 HG LEU 96 -0.098 -1.368 -4.241 807 HD11 LEU 96 HD11 LEU 96 0.039 0.923 -2.288 808 HD12 LEU 96 HD12 LEU 96 -1.115 -0.410 -2.256 809 HD13 LEU 96 HD13 LEU 96 -1.142 0.749 -3.584 810 HD21 LEU 96 HD21 LEU 96 1.820 0.954 -4.099 811 HD22 LEU 96 HD22 LEU 96 0.587 0.688 -5.332 812 HD23 LEU 96 HD23 LEU 96 1.952 -0.420 -5.198 813 H THR 97 HN THR 97 1.829 -4.196 -1.815 814 HA THR 97 HA THR 97 3.864 -4.133 0.068 815 HB THR 97 HB THR 97 2.436 -6.622 -0.899 816 HG1 THR 97 HG1 THR 97 0.963 -4.933 -0.297 817 HG21 THR 97 HG21 THR 97 3.672 -5.934 1.771 818 HG22 THR 97 HG22 THR 97 4.345 -7.049 0.581 819 HG23 THR 97 HG23 THR 97 2.818 -7.430 1.379 820 H GLN 98 HN GLN 98 3.697 -5.887 -3.018 821 HA GLN 98 HA GLN 98 6.078 -7.346 -2.740 822 HB2 GLN 98 HB2 GLN 98 4.432 -7.913 -4.431 823 HB3 GLN 98 HB1 GLN 98 4.675 -6.371 -5.235 824 HG2 GLN 98 HG2 GLN 98 6.986 -7.022 -5.746 825 HG3 GLN 98 HG1 GLN 98 6.703 -8.580 -4.976 826 HE21 GLN 98 HE21 GLN 98 3.971 -8.763 -5.996 827 HE22 GLN 98 HE22 GLN 98 4.115 -9.160 -7.671 828 H GLN 99 HN GLN 99 5.446 -4.203 -4.248 829 HA GLN 99 HA GLN 99 8.014 -3.772 -5.279 830 HB2 GLN 99 HB2 GLN 99 5.934 -1.769 -4.391 831 HB3 GLN 99 HB1 GLN 99 7.356 -1.377 -5.348 832 HG2 GLN 99 HG2 GLN 99 6.575 -2.744 -7.165 833 HG3 GLN 99 HG1 GLN 99 5.214 -3.311 -6.199 834 HE21 GLN 99 HE21 GLN 99 3.492 -1.919 -5.802 835 HE22 GLN 99 HE22 GLN 99 3.232 -0.486 -6.735 836 H LEU 100 HN LEU 100 6.619 -2.979 -2.137 837 HA LEU 100 HA LEU 100 8.954 -1.628 -1.185 838 HB2 LEU 100 HB2 LEU 100 6.599 -2.809 0.287 839 HB3 LEU 100 HB1 LEU 100 7.849 -1.837 1.039 840 HG LEU 100 HG LEU 100 5.972 -0.882 -1.125 841 HD11 LEU 100 HD11 LEU 100 4.809 -1.287 0.965 842 HD12 LEU 100 HD12 LEU 100 4.956 0.443 0.663 843 HD13 LEU 100 HD13 LEU 100 6.013 -0.339 1.838 844 HD21 LEU 100 HD21 LEU 100 8.035 0.579 0.519 845 HD22 LEU 100 HD22 LEU 100 6.865 1.341 -0.558 846 HD23 LEU 100 HD23 LEU 100 8.101 0.269 -1.216 847 H GLN 101 HN GLN 101 7.648 -4.880 -0.871 848 HA GLN 101 HA GLN 101 9.481 -5.849 1.027 849 HB2 GLN 101 HB2 GLN 101 7.334 -6.927 0.516 850 HB3 GLN 101 HB1 GLN 101 7.905 -7.334 -1.090 851 HG2 GLN 101 HG2 GLN 101 9.376 -8.328 1.310 852 HG3 GLN 101 HG1 GLN 101 7.889 -9.119 0.794 853 HE21 GLN 101 HE21 GLN 101 10.548 -10.221 0.870 854 HE22 GLN 101 HE22 GLN 101 10.941 -10.685 -0.750 855 H GLY 102 HN GLY 102 9.490 -5.966 -2.531 856 HA2 GLY 102 HA2 GLY 102 11.930 -7.337 -2.830 857 HA3 GLY 102 HA1 GLY 102 11.225 -6.244 -4.013 858 H LEU 103 HN LEU 103 11.198 -3.901 -2.517 859 HA LEU 103 HA LEU 103 13.804 -2.921 -2.900 860 HB2 LEU 103 HB2 LEU 103 11.820 -1.502 -3.012 861 HB3 LEU 103 HB1 LEU 103 11.490 -1.788 -1.315 862 HG LEU 103 HG LEU 103 13.585 -0.592 -0.731 863 HD11 LEU 103 HD11 LEU 103 13.689 -0.019 -3.690 864 HD12 LEU 103 HD12 LEU 103 14.836 -0.995 -2.773 865 HD13 LEU 103 HD13 LEU 103 14.704 0.736 -2.462 866 HD21 LEU 103 HD21 LEU 103 12.755 1.640 -1.257 867 HD22 LEU 103 HD22 LEU 103 11.442 0.574 -0.757 868 HD23 LEU 103 HD23 LEU 103 11.665 0.958 -2.464 869 H ALA 104 HN ALA 104 12.049 -3.835 0.041 870 HA ALA 104 HA ALA 104 13.968 -2.983 1.893 871 HB1 ALA 104 HB1 ALA 104 11.694 -3.493 2.546 872 HB2 ALA 104 HB2 ALA 104 12.829 -4.464 3.485 873 HB3 ALA 104 HB3 ALA 104 11.937 -5.197 2.150 874 H VAL 105 HN VAL 105 13.473 -6.179 0.416 875 HA VAL 105 HA VAL 105 15.569 -7.487 1.753 876 HB VAL 105 HB VAL 105 14.344 -8.064 -0.943 877 HG11 VAL 105 HG11 VAL 105 16.572 -9.051 -0.822 878 HG12 VAL 105 HG12 VAL 105 15.320 -10.293 -0.760 879 HG13 VAL 105 HG13 VAL 105 16.155 -9.808 0.716 880 HG21 VAL 105 HG21 VAL 105 12.777 -8.235 0.885 881 HG22 VAL 105 HG22 VAL 105 13.903 -9.252 1.784 882 HG23 VAL 105 HG23 VAL 105 13.182 -9.845 0.291 883 H THR 106 HN THR 106 15.484 -5.636 -1.232 884 HA THR 106 HA THR 106 18.094 -6.131 -2.118 885 HB THR 106 HB THR 106 16.379 -3.669 -2.494 886 HG1 THR 106 HG1 THR 106 15.314 -5.367 -3.407 887 HG21 THR 106 HG21 THR 106 17.734 -3.206 -4.458 888 HG22 THR 106 HG22 THR 106 18.743 -4.611 -4.116 889 HG23 THR 106 HG23 THR 106 18.747 -3.234 -3.013 890 H ILE 107 HN ILE 107 16.824 -3.901 0.270 891 HA ILE 107 HA ILE 107 19.298 -2.473 0.589 892 HB ILE 107 HB ILE 107 16.806 -2.504 2.291 893 HG12 ILE 107 HG12 ILE 107 17.821 -0.430 0.332 894 HG13 ILE 107 HG11 ILE 107 16.563 -1.608 -0.028 895 HG21 ILE 107 HG21 ILE 107 18.587 -1.850 3.709 896 HG22 ILE 107 HG22 ILE 107 17.766 -0.368 3.217 897 HG23 ILE 107 HG23 ILE 107 19.291 -0.821 2.464 898 HD11 ILE 107 HD11 ILE 107 15.612 0.551 0.502 899 HD12 ILE 107 HD12 ILE 107 16.427 0.546 2.066 900 HD13 ILE 107 HD13 ILE 107 15.166 -0.639 1.723 901 H SER 108 HN SER 108 17.598 -5.064 2.294 902 HA SER 108 HA SER 108 19.447 -5.189 4.462 903 HB2 SER 108 HB2 SER 108 17.519 -7.308 3.476 904 HB3 SER 108 HB1 SER 108 18.285 -7.251 5.064 905 HG SER 108 HG SER 108 17.197 -5.203 5.354 906 H ARG 109 HN ARG 109 19.506 -6.285 1.241 907 HA ARG 109 HA ARG 109 21.965 -7.778 1.786 908 HB2 ARG 109 HB2 ARG 109 20.171 -9.387 1.316 909 HB3 ARG 109 HB1 ARG 109 19.804 -8.550 -0.184 910 HG2 ARG 109 HG2 ARG 109 22.019 -9.132 -1.043 911 HG3 ARG 109 HG1 ARG 109 22.366 -9.994 0.459 912 HD2 ARG 109 HD2 ARG 109 21.642 -11.507 -1.338 913 HD3 ARG 109 HD1 ARG 109 20.542 -11.528 0.038 914 HE ARG 109 HE ARG 109 19.800 -9.704 -2.081 915 HH11 ARG 109 HH11 ARG 109 19.482 -12.947 -0.804 916 HH12 ARG 109 HH12 ARG 109 17.983 -13.256 -1.619 917 HH21 ARG 109 HH21 ARG 109 17.839 -10.116 -3.175 918 HH22 ARG 109 HH22 ARG 109 17.054 -11.653 -2.977 919 H GLU 110 HN GLU 110 23.058 -5.844 1.273 920 HA GLU 110 HA GLU 110 22.643 -4.511 -1.226 921 HB2 GLU 110 HB2 GLU 110 24.938 -4.231 0.723 922 HB3 GLU 110 HB1 GLU 110 24.508 -3.096 -0.549 923 HG2 GLU 110 HG2 GLU 110 22.407 -2.605 0.575 924 HG3 GLU 110 HG1 GLU 110 22.788 -3.783 1.829 925 H ASN 111 HN ASN 111 22.960 -6.143 -2.771 926 HA ASN 111 HA ASN 111 25.377 -7.665 -2.897 927 HB2 ASN 111 HB2 ASN 111 23.096 -7.288 -4.839 928 HB3 ASN 111 HB1 ASN 111 24.494 -8.289 -5.205 929 HD21 ASN 111 HD21 ASN 111 21.709 -9.043 -4.974 930 HD22 ASN 111 HD22 ASN 111 21.636 -10.248 -3.736 931 H ILE 112 HN ILE 112 26.924 -5.940 -2.834 932 HA ILE 112 HA ILE 112 27.189 -4.278 -5.194 933 HB ILE 112 HB ILE 112 29.218 -4.642 -2.988 934 HG12 ILE 112 HG12 ILE 112 27.092 -2.504 -3.129 935 HG13 ILE 112 HG11 ILE 112 26.919 -3.956 -2.160 936 HG21 ILE 112 HG21 ILE 112 30.036 -3.565 -5.017 937 HG22 ILE 112 HG22 ILE 112 29.965 -2.419 -3.678 938 HG23 ILE 112 HG23 ILE 112 28.723 -2.392 -4.929 939 HD11 ILE 112 HD11 ILE 112 27.655 -2.048 -0.834 940 HD12 ILE 112 HD12 ILE 112 29.088 -1.897 -1.849 941 HD13 ILE 112 HD13 ILE 112 28.862 -3.332 -0.849 942 H THR 113 HN THR 113 27.146 -6.305 -6.507 943 HA THR 113 HA THR 113 29.467 -8.027 -6.304 944 HB THR 113 HB THR 113 28.317 -9.312 -8.132 945 HG1 THR 113 HG1 THR 113 27.024 -7.827 -9.122 946 HG21 THR 113 HG21 THR 113 28.002 -9.939 -5.801 947 HG22 THR 113 HG22 THR 113 26.495 -10.144 -6.691 948 HG23 THR 113 HG23 THR 113 26.711 -8.750 -5.635 949 H GLU 114 HN GLU 114 31.119 -8.138 -7.709 950 HA GLU 114 HA GLU 114 30.992 -7.002 -10.331 951 HB2 GLU 114 HB2 GLU 114 32.999 -5.507 -9.922 952 HB3 GLU 114 HB1 GLU 114 31.476 -4.947 -9.262 953 HG2 GLU 114 HG2 GLU 114 32.132 -5.818 -7.060 954 HG3 GLU 114 HG1 GLU 114 33.684 -6.299 -7.739 955 H VAL 115 HN VAL 115 32.451 -7.944 -11.674 956 HA VAL 115 HA VAL 115 34.127 -10.022 -10.479 957 HB VAL 115 HB VAL 115 34.358 -10.865 -12.839 958 HG11 VAL 115 HG11 VAL 115 32.766 -11.830 -11.264 959 HG12 VAL 115 HG12 VAL 115 32.119 -11.843 -12.904 960 HG13 VAL 115 HG13 VAL 115 31.555 -10.640 -11.745 961 HG21 VAL 115 HG21 VAL 115 33.838 -8.756 -13.998 962 HG22 VAL 115 HG22 VAL 115 32.177 -8.853 -13.412 963 HG23 VAL 115 HG23 VAL 115 32.792 -10.074 -14.524 964 H GLY 116 HN GLY 116 35.155 -7.633 -9.984 965 HA2 GLY 116 HA2 GLY 116 37.298 -6.710 -10.071 966 HA3 GLY 116 HA1 GLY 116 37.604 -7.619 -11.545 967 H ALA 117 HN ALA 117 38.551 -5.375 -11.985 968 HA ALA 117 HA ALA 117 36.541 -3.895 -13.518 969 HB1 ALA 117 HB1 ALA 117 38.568 -2.597 -11.696 970 HB2 ALA 117 HB2 ALA 117 36.828 -2.672 -11.418 971 HB3 ALA 117 HB3 ALA 117 37.465 -1.753 -12.782 972 HA PRO 118 HA PRO 118 40.370 -4.741 -15.955 973 HB2 PRO 118 HB2 PRO 118 39.208 -5.865 -18.093 974 HB3 PRO 118 HB1 PRO 118 39.482 -6.783 -16.608 975 HG2 PRO 118 HG2 PRO 118 36.969 -5.510 -17.613 976 HG3 PRO 118 HG1 PRO 118 37.191 -7.092 -16.841 977 HD2 PRO 118 HD2 PRO 118 36.308 -4.834 -15.535 978 HD3 PRO 118 HD1 PRO 118 37.103 -6.203 -14.736 979 H THR 119 HN THR 119 39.422 -2.212 -15.717 980 HA THR 119 HA THR 119 38.962 -1.324 -18.480 981 HB THR 119 HB THR 119 37.074 -0.636 -17.268 982 HG1 THR 119 HG1 THR 119 38.456 1.745 -16.849 983 HG21 THR 119 HG21 THR 119 37.146 0.502 -15.099 984 HG22 THR 119 HG22 THR 119 38.901 0.342 -15.074 985 HG23 THR 119 HG23 THR 119 37.885 -1.097 -15.015 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 -31.348 -4.236 8.964 2 H2 GLY 1 HT2 GLY 1 -30.532 -4.799 10.332 3 H3 GLY 1 HT3 GLY 1 -30.498 -3.156 9.946 4 HA2 GLY 1 HA1 GLY 1 -32.906 -4.691 10.745 5 HA3 GLY 1 HA2 GLY 1 -32.019 -3.574 11.774 6 HA PRO 2 HA PRO 2 -35.532 -1.398 9.413 7 HB2 PRO 2 HB2 PRO 2 -36.102 -0.500 12.183 8 HB3 PRO 2 HB1 PRO 2 -37.219 -1.025 10.918 9 HG2 PRO 2 HG2 PRO 2 -36.675 -2.599 12.998 10 HG3 PRO 2 HG1 PRO 2 -36.885 -3.273 11.372 11 HD2 PRO 2 HD2 PRO 2 -34.365 -2.769 12.905 12 HD3 PRO 2 HD1 PRO 2 -34.788 -4.132 11.849 13 H MET 3 HN MET 3 -34.724 0.365 8.494 14 HA MET 3 HA MET 3 -32.760 1.951 9.925 15 HB2 MET 3 HB2 MET 3 -33.661 1.979 7.050 16 HB3 MET 3 HB1 MET 3 -32.481 3.104 7.705 17 HG2 MET 3 HG2 MET 3 -31.054 1.184 8.323 18 HG3 MET 3 HG1 MET 3 -32.216 0.111 7.541 19 HE1 MET 3 HE1 MET 3 -32.000 1.269 3.806 20 HE2 MET 3 HE2 MET 3 -33.104 1.907 5.023 21 HE3 MET 3 HE3 MET 3 -32.771 0.177 4.956 22 H ALA 4 HN ALA 4 -34.655 2.616 11.359 23 HA ALA 4 HA ALA 4 -36.346 4.707 10.344 24 HB1 ALA 4 HB1 ALA 4 -35.681 3.975 13.197 25 HB2 ALA 4 HB2 ALA 4 -37.024 3.325 12.258 26 HB3 ALA 4 HB3 ALA 4 -36.987 5.038 12.674 27 H MET 5 HN MET 5 -33.592 4.605 12.581 28 HA MET 5 HA MET 5 -32.820 7.279 11.616 29 HB2 MET 5 HB2 MET 5 -31.914 7.759 13.857 30 HB3 MET 5 HB1 MET 5 -33.648 7.477 13.901 31 HG2 MET 5 HG2 MET 5 -33.204 5.159 14.643 32 HG3 MET 5 HG1 MET 5 -31.488 5.548 14.709 33 HE1 MET 5 HE1 MET 5 -31.568 8.572 15.807 34 HE2 MET 5 HE2 MET 5 -30.442 7.332 16.356 35 HE3 MET 5 HE3 MET 5 -31.373 8.259 17.532 36 H LEU 6 HN LEU 6 -32.115 4.122 11.638 37 HA LEU 6 HA LEU 6 -29.286 4.149 12.080 38 HB2 LEU 6 HB2 LEU 6 -30.684 2.124 12.369 39 HB3 LEU 6 HB1 LEU 6 -31.023 2.126 10.652 40 HG LEU 6 HG LEU 6 -28.610 1.762 10.206 41 HD11 LEU 6 HD11 LEU 6 -28.457 1.482 13.203 42 HD12 LEU 6 HD12 LEU 6 -27.679 2.727 12.222 43 HD13 LEU 6 HD13 LEU 6 -27.180 1.041 12.069 44 HD21 LEU 6 HD21 LEU 6 -29.928 -0.267 12.007 45 HD22 LEU 6 HD22 LEU 6 -28.595 -0.584 10.898 46 HD23 LEU 6 HD23 LEU 6 -30.172 -0.109 10.268 47 H ALA 7 HN ALA 7 -27.985 5.240 10.760 48 HA ALA 7 HA ALA 7 -28.750 5.722 8.005 49 HB1 ALA 7 HB1 ALA 7 -26.906 7.292 7.967 50 HB2 ALA 7 HB2 ALA 7 -26.380 6.737 9.556 51 HB3 ALA 7 HB3 ALA 7 -27.925 7.567 9.379 52 H ARG 8 HN ARG 8 -28.449 3.763 6.981 53 HA ARG 8 HA ARG 8 -25.635 3.042 6.581 54 HB2 ARG 8 HB2 ARG 8 -27.937 1.131 6.991 55 HB3 ARG 8 HB1 ARG 8 -26.381 0.646 6.328 56 HG2 ARG 8 HG2 ARG 8 -25.299 1.457 8.403 57 HG3 ARG 8 HG1 ARG 8 -26.899 1.792 9.062 58 HD2 ARG 8 HD2 ARG 8 -27.481 -0.581 8.807 59 HD3 ARG 8 HD1 ARG 8 -25.860 -0.901 8.191 60 HE ARG 8 HE ARG 8 -25.813 0.381 10.743 61 HH11 ARG 8 HH11 ARG 8 -26.177 -2.710 9.150 62 HH12 ARG 8 HH12 ARG 8 -25.683 -3.626 10.537 63 HH21 ARG 8 HH21 ARG 8 -25.167 -0.815 12.570 64 HH22 ARG 8 HH22 ARG 8 -25.089 -2.546 12.476 65 H ARG 9 HN ARG 9 -26.933 4.809 5.003 66 HA ARG 9 HA ARG 9 -27.530 3.311 2.556 67 HB2 ARG 9 HB2 ARG 9 -27.904 6.225 3.260 68 HB3 ARG 9 HB1 ARG 9 -28.134 5.587 1.637 69 HG2 ARG 9 HG2 ARG 9 -29.884 4.092 2.488 70 HG3 ARG 9 HG1 ARG 9 -29.673 4.785 4.094 71 HD2 ARG 9 HD2 ARG 9 -30.450 6.342 1.635 72 HD3 ARG 9 HD1 ARG 9 -31.583 5.749 2.847 73 HE ARG 9 HE ARG 9 -29.671 7.263 4.183 74 HH11 ARG 9 HH11 ARG 9 -32.147 7.737 1.764 75 HH12 ARG 9 HH12 ARG 9 -32.458 9.381 2.213 76 HH21 ARG 9 HH21 ARG 9 -30.091 9.432 4.799 77 HH22 ARG 9 HH22 ARG 9 -31.296 10.344 3.949 78 H GLN 10 HN GLN 10 -26.490 4.077 0.562 79 HA GLN 10 HA GLN 10 -24.589 4.275 -0.665 80 HB2 GLN 10 HB2 GLN 10 -24.971 6.666 0.256 81 HB3 GLN 10 HB1 GLN 10 -23.629 6.312 1.334 82 HG2 GLN 10 HG2 GLN 10 -22.820 7.521 -0.569 83 HG3 GLN 10 HG1 GLN 10 -22.207 5.869 -0.633 84 HE21 GLN 10 HE21 GLN 10 -22.876 4.503 -2.269 85 HE22 GLN 10 HE22 GLN 10 -23.799 5.062 -3.627 86 H ARG 11 HN ARG 11 -24.417 2.099 0.698 87 HA ARG 11 HA ARG 11 -22.229 2.048 2.568 88 HB2 ARG 11 HB2 ARG 11 -23.938 -0.138 1.380 89 HB3 ARG 11 HB1 ARG 11 -22.621 -0.449 2.501 90 HG2 ARG 11 HG2 ARG 11 -23.722 0.789 4.234 91 HG3 ARG 11 HG1 ARG 11 -24.985 1.310 3.119 92 HD2 ARG 11 HD2 ARG 11 -24.425 -1.546 3.904 93 HD3 ARG 11 HD1 ARG 11 -25.706 -0.540 4.579 94 HE ARG 11 HE ARG 11 -25.833 -0.697 1.726 95 HH11 ARG 11 HH11 ARG 11 -26.624 -2.440 4.662 96 HH12 ARG 11 HH12 ARG 11 -27.987 -3.251 3.958 97 HH21 ARG 11 HH21 ARG 11 -27.594 -1.803 0.788 98 HH22 ARG 11 HH22 ARG 11 -28.529 -2.898 1.753 99 H ASP 12 HN ASP 12 -20.717 2.984 1.033 100 HA ASP 12 HA ASP 12 -19.487 0.900 -0.647 101 HB2 ASP 12 HB2 ASP 12 -19.759 3.862 -1.224 102 HB3 ASP 12 HB1 ASP 12 -18.700 2.791 -2.132 103 HA PRO 13 HA PRO 13 -16.553 2.675 2.644 104 HB2 PRO 13 HB2 PRO 13 -16.024 -0.210 3.062 105 HB3 PRO 13 HB1 PRO 13 -16.310 1.060 4.256 106 HG2 PRO 13 HG2 PRO 13 -18.162 -0.790 3.753 107 HG3 PRO 13 HG1 PRO 13 -18.615 0.896 4.071 108 HD2 PRO 13 HD2 PRO 13 -18.436 -0.559 1.456 109 HD3 PRO 13 HD1 PRO 13 -19.670 0.586 2.025 110 H LEU 14 HN LEU 14 -16.389 0.163 0.229 111 HA LEU 14 HA LEU 14 -13.628 -0.169 -0.014 112 HB2 LEU 14 HB2 LEU 14 -15.587 -0.188 -2.311 113 HB3 LEU 14 HB1 LEU 14 -14.028 -0.999 -2.240 114 HG LEU 14 HG LEU 14 -16.464 -1.704 -0.594 115 HD11 LEU 14 HD11 LEU 14 -16.648 -2.263 -2.972 116 HD12 LEU 14 HD12 LEU 14 -16.540 -3.699 -1.956 117 HD13 LEU 14 HD13 LEU 14 -15.133 -3.159 -2.867 118 HD21 LEU 14 HD21 LEU 14 -13.746 -3.005 -0.744 119 HD22 LEU 14 HD22 LEU 14 -15.153 -3.676 0.078 120 HD23 LEU 14 HD23 LEU 14 -14.434 -2.170 0.650 121 H GLN 15 HN GLN 15 -15.742 2.299 -1.413 122 HA GLN 15 HA GLN 15 -13.810 3.368 -3.184 123 HB2 GLN 15 HB2 GLN 15 -16.201 4.770 -1.972 124 HB3 GLN 15 HB1 GLN 15 -15.337 5.251 -3.425 125 HG2 GLN 15 HG2 GLN 15 -16.948 2.737 -3.053 126 HG3 GLN 15 HG1 GLN 15 -17.419 4.155 -3.987 127 HE21 GLN 15 HE21 GLN 15 -14.762 4.558 -5.102 128 HE22 GLN 15 HE22 GLN 15 -14.537 3.310 -6.273 129 H ALA 16 HN ALA 16 -14.924 4.399 0.027 130 HA ALA 16 HA ALA 16 -13.175 6.569 0.339 131 HB1 ALA 16 HB1 ALA 16 -15.134 6.209 1.752 132 HB2 ALA 16 HB2 ALA 16 -13.671 6.388 2.720 133 HB3 ALA 16 HB3 ALA 16 -14.367 4.789 2.459 134 H LEU 17 HN LEU 17 -12.870 3.177 1.301 135 HA LEU 17 HA LEU 17 -10.319 3.436 2.484 136 HB2 LEU 17 HB2 LEU 17 -11.860 1.575 2.921 137 HB3 LEU 17 HB1 LEU 17 -11.628 1.002 1.282 138 HG LEU 17 HG LEU 17 -9.342 0.425 1.724 139 HD11 LEU 17 HD11 LEU 17 -8.347 0.743 3.959 140 HD12 LEU 17 HD12 LEU 17 -9.762 1.680 4.434 141 HD13 LEU 17 HD13 LEU 17 -8.703 2.269 3.154 142 HD21 LEU 17 HD21 LEU 17 -11.029 -1.196 2.394 143 HD22 LEU 17 HD22 LEU 17 -11.115 -0.459 3.994 144 HD23 LEU 17 HD23 LEU 17 -9.632 -1.257 3.469 145 H ARG 18 HN ARG 18 -11.327 2.528 -0.800 146 HA ARG 18 HA ARG 18 -8.778 2.051 -1.858 147 HB2 ARG 18 HB2 ARG 18 -10.649 1.444 -3.191 148 HB3 ARG 18 HB1 ARG 18 -11.321 3.066 -3.120 149 HG2 ARG 18 HG2 ARG 18 -9.697 3.912 -4.609 150 HG3 ARG 18 HG1 ARG 18 -8.711 2.456 -4.470 151 HD2 ARG 18 HD2 ARG 18 -11.498 2.478 -5.605 152 HD3 ARG 18 HD1 ARG 18 -10.043 2.651 -6.585 153 HE ARG 18 HE ARG 18 -9.552 0.387 -5.191 154 HH11 ARG 18 HH11 ARG 18 -12.310 1.419 -7.094 155 HH12 ARG 18 HH12 ARG 18 -12.668 -0.181 -7.661 156 HH21 ARG 18 HH21 ARG 18 -10.036 -1.696 -5.904 157 HH22 ARG 18 HH22 ARG 18 -11.383 -1.960 -6.973 158 H ARG 19 HN ARG 19 -10.603 5.048 -1.467 159 HA ARG 19 HA ARG 19 -8.810 6.811 -2.681 160 HB2 ARG 19 HB2 ARG 19 -11.110 7.366 -1.884 161 HB3 ARG 19 HB1 ARG 19 -10.512 7.318 -0.233 162 HG2 ARG 19 HG2 ARG 19 -8.981 9.165 -0.751 163 HG3 ARG 19 HG1 ARG 19 -9.648 9.235 -2.384 164 HD2 ARG 19 HD2 ARG 19 -10.697 10.916 -0.995 165 HD3 ARG 19 HD1 ARG 19 -11.870 9.676 -1.428 166 HE ARG 19 HE ARG 19 -10.493 9.548 1.164 167 HH11 ARG 19 HH11 ARG 19 -13.455 9.850 -0.686 168 HH12 ARG 19 HH12 ARG 19 -14.480 9.680 0.704 169 HH21 ARG 19 HH21 ARG 19 -11.837 9.324 2.978 170 HH22 ARG 19 HH22 ARG 19 -13.560 9.390 2.789 171 H ARG 20 HN ARG 20 -8.977 5.631 0.662 172 HA ARG 20 HA ARG 20 -6.701 6.920 1.661 173 HB2 ARG 20 HB2 ARG 20 -7.882 4.239 2.410 174 HB3 ARG 20 HB1 ARG 20 -6.631 5.060 3.325 175 HG2 ARG 20 HG2 ARG 20 -8.162 6.918 3.753 176 HG3 ARG 20 HG1 ARG 20 -9.420 6.080 2.840 177 HD2 ARG 20 HD2 ARG 20 -9.390 4.244 4.432 178 HD3 ARG 20 HD1 ARG 20 -8.062 4.996 5.313 179 HE ARG 20 HE ARG 20 -10.451 6.624 5.110 180 HH11 ARG 20 HH11 ARG 20 -8.768 4.175 6.971 181 HH12 ARG 20 HH12 ARG 20 -9.559 4.578 8.460 182 HH21 ARG 20 HH21 ARG 20 -11.494 7.151 7.069 183 HH22 ARG 20 HH22 ARG 20 -11.118 6.264 8.514 184 H ASN 21 HN ASN 21 -7.050 3.778 0.036 185 HA ASN 21 HA ASN 21 -4.335 3.034 0.210 186 HB2 ASN 21 HB2 ASN 21 -6.468 2.213 -1.769 187 HB3 ASN 21 HB1 ASN 21 -4.858 1.505 -1.726 188 HD21 ASN 21 HD21 ASN 21 -7.381 0.198 -1.353 189 HD22 ASN 21 HD22 ASN 21 -7.348 -0.491 0.236 190 H GLN 22 HN GLN 22 -6.081 4.981 -2.156 191 HA GLN 22 HA GLN 22 -4.002 5.183 -4.051 192 HB2 GLN 22 HB2 GLN 22 -6.249 7.085 -3.385 193 HB3 GLN 22 HB1 GLN 22 -5.164 7.296 -4.751 194 HG2 GLN 22 HG2 GLN 22 -5.910 5.133 -5.648 195 HG3 GLN 22 HG1 GLN 22 -7.038 4.986 -4.299 196 HE21 GLN 22 HE21 GLN 22 -7.597 5.090 -7.156 197 HE22 GLN 22 HE22 GLN 22 -8.632 6.454 -7.400 198 H GLU 23 HN GLU 23 -4.645 6.800 -1.053 199 HA GLU 23 HA GLU 23 -2.792 8.932 -1.339 200 HB2 GLU 23 HB2 GLU 23 -4.650 8.892 0.313 201 HB3 GLU 23 HB1 GLU 23 -3.827 7.603 1.176 202 HG2 GLU 23 HG2 GLU 23 -1.971 9.104 1.657 203 HG3 GLU 23 HG1 GLU 23 -2.784 10.396 0.772 204 H LEU 24 HN LEU 24 -2.662 5.731 0.188 205 HA LEU 24 HA LEU 24 0.075 5.818 0.881 206 HB2 LEU 24 HB2 LEU 24 -1.756 3.486 0.340 207 HB3 LEU 24 HB1 LEU 24 -0.100 3.299 0.878 208 HG LEU 24 HG LEU 24 -2.295 4.682 2.430 209 HD11 LEU 24 HD11 LEU 24 -0.897 2.069 2.979 210 HD12 LEU 24 HD12 LEU 24 -2.487 2.204 2.231 211 HD13 LEU 24 HD13 LEU 24 -2.238 2.777 3.879 212 HD21 LEU 24 HD21 LEU 24 -0.639 4.665 4.261 213 HD22 LEU 24 HD22 LEU 24 -0.144 5.679 2.907 214 HD23 LEU 24 HD23 LEU 24 0.579 4.085 3.125 215 H LYS 25 HN LYS 25 -1.616 4.822 -2.047 216 HA LYS 25 HA LYS 25 0.510 3.631 -3.397 217 HB2 LYS 25 HB2 LYS 25 -1.892 3.686 -4.149 218 HB3 LYS 25 HB1 LYS 25 -1.633 5.343 -4.671 219 HG2 LYS 25 HG2 LYS 25 0.233 4.453 -6.130 220 HG3 LYS 25 HG1 LYS 25 -0.381 2.842 -5.759 221 HD2 LYS 25 HD2 LYS 25 -1.967 5.072 -7.024 222 HD3 LYS 25 HD1 LYS 25 -1.256 3.711 -7.887 223 HE2 LYS 25 HE2 LYS 25 -2.663 2.168 -6.615 224 HE3 LYS 25 HE1 LYS 25 -3.362 3.526 -5.734 225 HZ1 LYS 25 HZ1 LYS 25 -4.240 4.378 -7.822 226 HZ2 LYS 25 HZ2 LYS 25 -4.804 2.811 -7.535 227 HZ3 LYS 25 HZ3 LYS 25 -3.574 3.071 -8.664 228 H GLN 26 HN GLN 26 -0.421 7.037 -3.146 229 HA GLN 26 HA GLN 26 1.618 8.008 -4.865 230 HB2 GLN 26 HB2 GLN 26 -0.379 9.334 -4.354 231 HB3 GLN 26 HB1 GLN 26 0.106 9.431 -2.668 232 HG2 GLN 26 HG2 GLN 26 0.596 11.486 -3.910 233 HG3 GLN 26 HG1 GLN 26 2.047 10.735 -3.249 234 HE21 GLN 26 HE21 GLN 26 3.391 11.759 -4.719 235 HE22 GLN 26 HE22 GLN 26 3.448 11.319 -6.390 236 H GLN 27 HN GLN 27 1.462 7.263 -1.448 237 HA GLN 27 HA GLN 27 3.906 8.539 -0.725 238 HB2 GLN 27 HB2 GLN 27 2.442 6.247 0.605 239 HB3 GLN 27 HB1 GLN 27 3.768 7.153 1.320 240 HG2 GLN 27 HG2 GLN 27 2.400 9.187 1.262 241 HG3 GLN 27 HG1 GLN 27 1.075 8.266 0.556 242 HE21 GLN 27 HE21 GLN 27 3.218 7.110 3.089 243 HE22 GLN 27 HE22 GLN 27 2.015 7.030 4.324 244 H VAL 28 HN VAL 28 2.998 5.386 -1.957 245 HA VAL 28 HA VAL 28 5.522 4.126 -1.632 246 HB VAL 28 HB VAL 28 3.258 3.529 -3.552 247 HG11 VAL 28 HG11 VAL 28 4.304 1.330 -3.836 248 HG12 VAL 28 HG12 VAL 28 5.671 1.863 -2.861 249 HG13 VAL 28 HG13 VAL 28 5.345 2.633 -4.412 250 HG21 VAL 28 HG21 VAL 28 2.608 3.263 -1.226 251 HG22 VAL 28 HG22 VAL 28 4.027 2.265 -0.925 252 HG23 VAL 28 HG23 VAL 28 2.757 1.684 -2.000 253 H ASP 29 HN ASP 29 3.914 5.693 -4.398 254 HA ASP 29 HA ASP 29 6.026 5.485 -6.220 255 HB2 ASP 29 HB2 ASP 29 3.751 7.441 -5.985 256 HB3 ASP 29 HB1 ASP 29 4.966 7.606 -7.248 257 H SER 30 HN SER 30 5.383 7.839 -3.700 258 HA SER 30 HA SER 30 7.410 9.671 -4.385 259 HB2 SER 30 HB2 SER 30 5.632 10.289 -2.834 260 HB3 SER 30 HB1 SER 30 6.159 9.054 -1.693 261 HG SER 30 HG SER 30 6.887 11.470 -1.596 262 H LEU 31 HN LEU 31 7.394 6.855 -2.232 263 HA LEU 31 HA LEU 31 10.034 7.168 -1.295 264 HB2 LEU 31 HB2 LEU 31 8.349 5.723 -0.207 265 HB3 LEU 31 HB1 LEU 31 8.431 4.624 -1.570 266 HG LEU 31 HG LEU 31 10.825 4.210 -1.051 267 HD11 LEU 31 HD11 LEU 31 11.437 6.213 0.080 268 HD12 LEU 31 HD12 LEU 31 11.609 4.878 1.222 269 HD13 LEU 31 HD13 LEU 31 10.215 5.952 1.325 270 HD21 LEU 31 HD21 LEU 31 10.431 2.794 0.871 271 HD22 LEU 31 HD22 LEU 31 9.061 2.712 -0.235 272 HD23 LEU 31 HD23 LEU 31 8.948 3.670 1.241 273 H LEU 32 HN LEU 32 8.685 5.140 -3.883 274 HA LEU 32 HA LEU 32 11.071 4.044 -4.798 275 HB2 LEU 32 HB2 LEU 32 8.561 4.721 -6.329 276 HB3 LEU 32 HB1 LEU 32 9.836 3.666 -6.910 277 HG LEU 32 HG LEU 32 8.186 3.135 -4.442 278 HD11 LEU 32 HD11 LEU 32 7.941 1.994 -7.218 279 HD12 LEU 32 HD12 LEU 32 6.789 3.068 -6.425 280 HD13 LEU 32 HD13 LEU 32 7.055 1.441 -5.799 281 HD21 LEU 32 HD21 LEU 32 10.372 2.091 -4.369 282 HD22 LEU 32 HD22 LEU 32 10.125 1.412 -5.977 283 HD23 LEU 32 HD23 LEU 32 9.122 0.876 -4.629 284 H SER 33 HN SER 33 9.550 7.130 -5.474 285 HA SER 33 HA SER 33 11.141 7.902 -7.662 286 HB2 SER 33 HB2 SER 33 9.046 9.063 -7.006 287 HB3 SER 33 HB1 SER 33 9.852 9.671 -5.563 288 HG SER 33 HG SER 33 11.160 10.930 -6.820 289 H GLU 34 HN GLU 34 11.579 8.232 -4.162 290 HA GLU 34 HA GLU 34 13.981 9.791 -4.448 291 HB2 GLU 34 HB2 GLU 34 12.785 8.423 -2.035 292 HB3 GLU 34 HB1 GLU 34 14.192 9.474 -1.998 293 HG2 GLU 34 HG2 GLU 34 12.816 11.325 -2.838 294 HG3 GLU 34 HG1 GLU 34 11.405 10.272 -2.804 295 H SER 35 HN SER 35 13.090 6.465 -4.057 296 HA SER 35 HA SER 35 15.690 5.468 -3.455 297 HB2 SER 35 HB2 SER 35 13.291 3.994 -4.571 298 HB3 SER 35 HB1 SER 35 14.698 3.264 -3.798 299 HG SER 35 HG SER 35 12.796 5.003 -2.594 300 H GLN 36 HN GLN 36 14.446 6.767 -6.253 301 HA GLN 36 HA GLN 36 15.843 4.909 -8.041 302 HB2 GLN 36 HB2 GLN 36 13.429 5.399 -8.472 303 HB3 GLN 36 HB1 GLN 36 13.846 7.090 -8.693 304 HG2 GLN 36 HG2 GLN 36 15.204 6.523 -10.621 305 HG3 GLN 36 HG1 GLN 36 14.848 4.813 -10.387 306 HE21 GLN 36 HE21 GLN 36 12.510 7.354 -9.894 307 HE22 GLN 36 HE22 GLN 36 11.497 6.947 -11.234 308 H LEU 37 HN LEU 37 16.155 7.809 -6.449 309 HA LEU 37 HA LEU 37 17.414 9.444 -8.381 310 HB2 LEU 37 HB2 LEU 37 17.684 9.443 -5.373 311 HB3 LEU 37 HB1 LEU 37 18.208 10.733 -6.432 312 HG LEU 37 HG LEU 37 15.346 9.857 -6.064 313 HD11 LEU 37 HD11 LEU 37 15.079 11.968 -4.858 314 HD12 LEU 37 HD12 LEU 37 16.813 12.263 -4.996 315 HD13 LEU 37 HD13 LEU 37 16.223 10.896 -4.051 316 HD21 LEU 37 HD21 LEU 37 15.682 10.786 -8.257 317 HD22 LEU 37 HD22 LEU 37 16.562 12.155 -7.581 318 HD23 LEU 37 HD23 LEU 37 14.840 11.963 -7.251 319 H LYS 38 HN LYS 38 19.494 9.564 -9.022 320 HA LYS 38 HA LYS 38 21.284 7.441 -8.535 321 HB2 LYS 38 HB2 LYS 38 22.970 8.859 -9.694 322 HB3 LYS 38 HB1 LYS 38 21.462 8.712 -10.585 323 HG2 LYS 38 HG2 LYS 38 20.788 10.916 -9.922 324 HG3 LYS 38 HG1 LYS 38 22.178 11.066 -8.847 325 HD2 LYS 38 HD2 LYS 38 22.564 12.293 -10.908 326 HD3 LYS 38 HD1 LYS 38 23.676 10.929 -10.790 327 HE2 LYS 38 HE2 LYS 38 22.794 11.133 -13.047 328 HE3 LYS 38 HE1 LYS 38 22.249 9.637 -12.298 329 HZ1 LYS 38 HZ1 LYS 38 20.643 12.124 -12.545 330 HZ2 LYS 38 HZ2 LYS 38 20.119 10.678 -11.843 331 HZ3 LYS 38 HZ3 LYS 38 20.466 10.737 -13.494 332 H GLU 39 HN GLU 39 20.757 10.503 -7.008 333 HA GLU 39 HA GLU 39 23.134 10.539 -5.431 334 HB2 GLU 39 HB2 GLU 39 20.487 11.959 -5.118 335 HB3 GLU 39 HB1 GLU 39 21.889 12.258 -4.102 336 HG2 GLU 39 HG2 GLU 39 21.769 12.661 -7.081 337 HG3 GLU 39 HG1 GLU 39 21.655 13.931 -5.862 338 H ALA 40 HN ALA 40 20.237 8.771 -5.257 339 HA ALA 40 HA ALA 40 20.279 8.455 -2.386 340 HB1 ALA 40 HB1 ALA 40 18.324 7.022 -2.729 341 HB2 ALA 40 HB2 ALA 40 18.526 7.193 -4.473 342 HB3 ALA 40 HB3 ALA 40 18.136 8.601 -3.487 343 H LEU 41 HN LEU 41 22.036 7.184 -4.823 344 HA LEU 41 HA LEU 41 22.121 4.435 -4.060 345 HB2 LEU 41 HB2 LEU 41 22.819 5.244 -6.290 346 HB3 LEU 41 HB1 LEU 41 24.168 6.087 -5.551 347 HG LEU 41 HG LEU 41 25.053 3.884 -4.784 348 HD11 LEU 41 HD11 LEU 41 23.006 2.610 -4.763 349 HD12 LEU 41 HD12 LEU 41 24.166 1.861 -5.857 350 HD13 LEU 41 HD13 LEU 41 22.829 2.809 -6.505 351 HD21 LEU 41 HD21 LEU 41 24.633 4.166 -7.755 352 HD22 LEU 41 HD22 LEU 41 25.880 3.197 -6.974 353 HD23 LEU 41 HD23 LEU 41 25.896 4.953 -6.810 354 H GLU 42 HN GLU 42 23.156 7.213 -2.565 355 HA GLU 42 HA GLU 42 25.593 6.279 -1.415 356 HB2 GLU 42 HB2 GLU 42 23.785 8.520 -0.486 357 HB3 GLU 42 HB1 GLU 42 25.443 8.249 0.026 358 HG2 GLU 42 HG2 GLU 42 24.502 9.012 -2.728 359 HG3 GLU 42 HG1 GLU 42 25.398 10.015 -1.587 360 HA PRO 43 HA PRO 43 24.084 3.260 1.330 361 HB2 PRO 43 HB2 PRO 43 26.080 4.398 3.244 362 HB3 PRO 43 HB1 PRO 43 25.804 2.718 2.774 363 HG2 PRO 43 HG2 PRO 43 27.844 4.103 1.766 364 HG3 PRO 43 HG1 PRO 43 26.940 2.946 0.773 365 HD2 PRO 43 HD2 PRO 43 26.910 5.918 0.722 366 HD3 PRO 43 HD1 PRO 43 26.610 4.759 -0.588 367 H ASN 44 HN ASN 44 24.649 6.433 2.869 368 HA ASN 44 HA ASN 44 23.098 5.940 5.155 369 HB2 ASN 44 HB2 ASN 44 23.938 8.498 3.806 370 HB3 ASN 44 HB1 ASN 44 22.896 8.512 5.227 371 HD21 ASN 44 HD21 ASN 44 25.595 9.564 4.943 372 HD22 ASN 44 HD22 ASN 44 26.558 8.738 6.117 373 H LYS 45 HN LYS 45 22.180 7.398 2.037 374 HA LYS 45 HA LYS 45 19.537 8.002 2.753 375 HB2 LYS 45 HB2 LYS 45 20.657 8.945 0.779 376 HB3 LYS 45 HB1 LYS 45 20.701 7.353 0.037 377 HG2 LYS 45 HG2 LYS 45 18.917 8.583 -0.958 378 HG3 LYS 45 HG1 LYS 45 18.206 7.341 0.070 379 HD2 LYS 45 HD2 LYS 45 17.016 9.431 0.343 380 HD3 LYS 45 HD1 LYS 45 17.867 9.026 1.834 381 HE2 LYS 45 HE2 LYS 45 19.594 10.618 1.351 382 HE3 LYS 45 HE1 LYS 45 18.942 10.911 -0.260 383 HZ1 LYS 45 HZ1 LYS 45 16.995 11.896 0.710 384 HZ2 LYS 45 HZ2 LYS 45 18.367 12.659 1.344 385 HZ3 LYS 45 HZ3 LYS 45 17.525 11.529 2.272 386 H ARG 46 HN ARG 46 20.991 5.126 1.282 387 HA ARG 46 HA ARG 46 18.652 3.704 0.729 388 HB2 ARG 46 HB2 ARG 46 21.419 2.760 1.465 389 HB3 ARG 46 HB1 ARG 46 20.127 1.649 1.041 390 HG2 ARG 46 HG2 ARG 46 21.264 3.802 -0.728 391 HG3 ARG 46 HG1 ARG 46 21.583 2.072 -0.849 392 HD2 ARG 46 HD2 ARG 46 18.997 1.879 -1.053 393 HD3 ARG 46 HD1 ARG 46 19.084 3.587 -1.482 394 HE ARG 46 HE ARG 46 20.672 1.586 -2.944 395 HH11 ARG 46 HH11 ARG 46 18.273 4.140 -2.937 396 HH12 ARG 46 HH12 ARG 46 18.138 4.187 -4.666 397 HH21 ARG 46 HH21 ARG 46 20.481 1.636 -5.203 398 HH22 ARG 46 HH22 ARG 46 19.406 2.775 -5.954 399 H GLN 47 HN GLN 47 20.595 3.829 3.676 400 HA GLN 47 HA GLN 47 19.165 1.942 5.176 401 HB2 GLN 47 HB2 GLN 47 20.744 4.362 6.057 402 HB3 GLN 47 HB1 GLN 47 20.162 3.111 7.146 403 HG2 GLN 47 HG2 GLN 47 21.577 1.484 6.192 404 HG3 GLN 47 HG1 GLN 47 21.956 2.515 4.814 405 HE21 GLN 47 HE21 GLN 47 24.153 2.343 5.180 406 HE22 GLN 47 HE22 GLN 47 24.940 3.162 6.488 407 H HIS 48 HN HIS 48 18.701 5.399 4.697 408 HA HIS 48 HA HIS 48 16.653 5.696 6.653 409 HB2 HIS 48 HB2 HIS 48 18.103 7.548 5.622 410 HB3 HIS 48 HB1 HIS 48 17.044 7.455 4.219 411 HD1 HIS 48 HD1 HIS 48 17.210 8.714 7.710 412 HD2 HIS 48 HD2 HIS 48 14.421 8.464 4.638 413 HE1 HIS 48 HE1 HIS 48 15.336 10.245 8.376 414 HE2 HIS 48 HE2 HIS 48 13.600 9.965 6.580 415 H ILE 49 HN ILE 49 16.704 4.903 3.238 416 HA ILE 49 HA ILE 49 13.929 5.127 2.742 417 HB ILE 49 HB ILE 49 16.062 3.484 1.371 418 HG12 ILE 49 HG12 ILE 49 14.703 6.070 0.575 419 HG13 ILE 49 HG11 ILE 49 16.307 5.953 1.290 420 HG21 ILE 49 HG21 ILE 49 14.501 3.210 -0.483 421 HG22 ILE 49 HG22 ILE 49 13.245 4.033 0.441 422 HG23 ILE 49 HG23 ILE 49 13.865 2.477 0.990 423 HD11 ILE 49 HD11 ILE 49 16.394 6.269 -1.126 424 HD12 ILE 49 HD12 ILE 49 15.484 4.775 -1.351 425 HD13 ILE 49 HD13 ILE 49 17.097 4.724 -0.644 426 H TYR 50 HN TYR 50 15.967 2.377 3.713 427 HA TYR 50 HA TYR 50 14.117 0.343 3.692 428 HB2 TYR 50 HB2 TYR 50 16.503 0.019 4.158 429 HB3 TYR 50 HB1 TYR 50 16.324 0.828 5.710 430 HD1 TYR 50 HD1 TYR 50 16.080 -0.478 7.600 431 HD2 TYR 50 HD2 TYR 50 14.932 -2.108 3.838 432 HE1 TYR 50 HE1 TYR 50 15.634 -2.641 8.678 433 HE2 TYR 50 HE2 TYR 50 14.481 -4.274 4.910 434 HH TYR 50 HH TYR 50 14.247 -4.662 8.251 435 H GLN 51 HN GLN 51 14.632 2.771 6.212 436 HA GLN 51 HA GLN 51 12.838 1.640 8.102 437 HB2 GLN 51 HB2 GLN 51 14.633 3.326 8.615 438 HB3 GLN 51 HB1 GLN 51 13.646 4.543 7.822 439 HG2 GLN 51 HG2 GLN 51 13.410 4.682 10.222 440 HG3 GLN 51 HG1 GLN 51 11.887 4.201 9.480 441 HE21 GLN 51 HE21 GLN 51 11.203 3.378 11.490 442 HE22 GLN 51 HE22 GLN 51 11.782 1.856 12.081 443 H ARG 52 HN ARG 52 12.481 4.108 5.595 444 HA ARG 52 HA ARG 52 9.790 4.767 6.168 445 HB2 ARG 52 HB2 ARG 52 11.484 5.077 3.700 446 HB3 ARG 52 HB1 ARG 52 9.803 5.590 3.744 447 HG2 ARG 52 HG2 ARG 52 10.332 7.104 5.601 448 HG3 ARG 52 HG1 ARG 52 12.023 6.608 5.505 449 HD2 ARG 52 HD2 ARG 52 12.257 7.526 3.328 450 HD3 ARG 52 HD1 ARG 52 10.519 7.776 3.174 451 HE ARG 52 HE ARG 52 11.337 9.253 5.373 452 HH11 ARG 52 HH11 ARG 52 11.967 9.182 1.935 453 HH12 ARG 52 HH12 ARG 52 12.260 10.884 1.820 454 HH21 ARG 52 HH21 ARG 52 11.718 11.506 5.229 455 HH22 ARG 52 HH22 ARG 52 12.132 12.204 3.694 456 H CYS 53 HN CYS 53 11.269 2.241 4.310 457 HA CYS 53 HA CYS 53 8.964 1.524 2.794 458 HB2 CYS 53 HB2 CYS 53 11.242 0.839 2.111 459 HB3 CYS 53 HB1 CYS 53 11.349 -0.198 3.538 460 HG CYS 53 HG CYS 53 10.789 -1.467 0.908 461 H ILE 54 HN ILE 54 10.371 0.370 5.820 462 HA ILE 54 HA ILE 54 8.516 -1.613 6.438 463 HB ILE 54 HB ILE 54 10.086 0.218 8.249 464 HG12 ILE 54 HG12 ILE 54 10.496 -2.667 7.414 465 HG13 ILE 54 HG11 ILE 54 11.442 -1.286 6.858 466 HG21 ILE 54 HG21 ILE 54 8.511 -2.241 8.993 467 HG22 ILE 54 HG22 ILE 54 8.148 -0.581 9.465 468 HG23 ILE 54 HG23 ILE 54 9.610 -1.368 10.060 469 HD11 ILE 54 HD11 ILE 54 11.308 -2.310 9.686 470 HD12 ILE 54 HD12 ILE 54 12.263 -0.936 9.128 471 HD13 ILE 54 HD13 ILE 54 12.631 -2.560 8.548 472 H GLN 55 HN GLN 55 8.396 1.871 6.959 473 HA GLN 55 HA GLN 55 6.097 1.892 8.596 474 HB2 GLN 55 HB2 GLN 55 7.069 4.077 6.749 475 HB3 GLN 55 HB1 GLN 55 5.986 4.274 8.119 476 HG2 GLN 55 HG2 GLN 55 8.873 3.438 8.227 477 HG3 GLN 55 HG1 GLN 55 8.213 5.007 8.686 478 HE21 GLN 55 HE21 GLN 55 9.712 2.975 10.209 479 HE22 GLN 55 HE22 GLN 55 8.741 2.645 11.603 480 H LEU 56 HN LEU 56 6.428 2.605 5.105 481 HA LEU 56 HA LEU 56 3.729 2.823 4.545 482 HB2 LEU 56 HB2 LEU 56 5.843 1.724 2.693 483 HB3 LEU 56 HB1 LEU 56 4.306 2.409 2.213 484 HG LEU 56 HG LEU 56 6.614 3.889 3.477 485 HD11 LEU 56 HD11 LEU 56 6.940 3.291 1.134 486 HD12 LEU 56 HD12 LEU 56 6.731 5.031 1.336 487 HD13 LEU 56 HD13 LEU 56 5.400 4.048 0.725 488 HD21 LEU 56 HD21 LEU 56 5.265 5.909 3.098 489 HD22 LEU 56 HD22 LEU 56 4.527 4.825 4.274 490 HD23 LEU 56 HD23 LEU 56 3.902 4.897 2.627 491 H LYS 57 HN LYS 57 5.738 -0.073 4.665 492 HA LYS 57 HA LYS 57 3.857 -1.847 3.559 493 HB2 LYS 57 HB2 LYS 57 6.219 -2.437 3.832 494 HB3 LYS 57 HB1 LYS 57 6.042 -2.388 5.581 495 HG2 LYS 57 HG2 LYS 57 4.556 -4.279 5.534 496 HG3 LYS 57 HG1 LYS 57 4.562 -4.282 3.771 497 HD2 LYS 57 HD2 LYS 57 6.938 -4.805 3.761 498 HD3 LYS 57 HD1 LYS 57 6.973 -4.743 5.524 499 HE2 LYS 57 HE2 LYS 57 5.289 -6.654 3.915 500 HE3 LYS 57 HE1 LYS 57 6.864 -7.046 4.599 501 HZ1 LYS 57 HZ1 LYS 57 5.963 -6.581 6.804 502 HZ2 LYS 57 HZ2 LYS 57 5.096 -7.810 6.031 503 HZ3 LYS 57 HZ3 LYS 57 4.447 -6.255 6.131 504 H GLN 58 HN GLN 58 4.471 -0.823 6.880 505 HA GLN 58 HA GLN 58 2.512 -2.422 8.116 506 HB2 GLN 58 HB2 GLN 58 4.316 -1.186 9.319 507 HB3 GLN 58 HB1 GLN 58 3.463 0.316 8.985 508 HG2 GLN 58 HG2 GLN 58 1.511 -0.603 10.228 509 HG3 GLN 58 HG1 GLN 58 2.512 -1.981 10.675 510 HE21 GLN 58 HE21 GLN 58 1.239 -0.028 12.377 511 HE22 GLN 58 HE22 GLN 58 2.499 0.715 13.298 512 H ALA 59 HN ALA 59 2.373 0.757 6.603 513 HA ALA 59 HA ALA 59 -0.240 1.435 7.405 514 HB1 ALA 59 HB1 ALA 59 1.284 2.362 4.975 515 HB2 ALA 59 HB2 ALA 59 1.400 3.063 6.589 516 HB3 ALA 59 HB3 ALA 59 -0.119 3.152 5.696 517 H ILE 60 HN ILE 60 0.998 -0.098 4.442 518 HA ILE 60 HA ILE 60 -1.508 -0.277 3.146 519 HB ILE 60 HB ILE 60 0.910 -2.067 2.790 520 HG12 ILE 60 HG12 ILE 60 0.065 0.392 1.235 521 HG13 ILE 60 HG11 ILE 60 1.355 0.359 2.434 522 HG21 ILE 60 HG21 ILE 60 -1.435 -1.566 0.957 523 HG22 ILE 60 HG22 ILE 60 -1.158 -3.035 1.893 524 HG23 ILE 60 HG23 ILE 60 -0.040 -2.586 0.606 525 HD11 ILE 60 HD11 ILE 60 2.259 0.262 0.192 526 HD12 ILE 60 HD12 ILE 60 1.298 -1.173 -0.157 527 HD13 ILE 60 HD13 ILE 60 2.582 -1.246 1.048 528 H ASP 61 HN ASP 61 0.279 -2.486 5.235 529 HA ASP 61 HA ASP 61 -1.477 -4.671 5.179 530 HB2 ASP 61 HB2 ASP 61 0.783 -4.784 6.164 531 HB3 ASP 61 HB1 ASP 61 0.282 -3.692 7.452 532 H GLU 62 HN GLU 62 -1.463 -1.738 7.074 533 HA GLU 62 HA GLU 62 -3.498 -2.346 8.896 534 HB2 GLU 62 HB2 GLU 62 -2.033 -0.423 9.168 535 HB3 GLU 62 HB1 GLU 62 -2.684 0.314 7.713 536 HG2 GLU 62 HG2 GLU 62 -3.613 1.386 9.647 537 HG3 GLU 62 HG1 GLU 62 -4.875 0.485 8.812 538 H ASN 63 HN ASN 63 -3.679 -0.769 5.699 539 HA ASN 63 HA ASN 63 -6.520 -0.524 5.819 540 HB2 ASN 63 HB2 ASN 63 -4.568 -0.238 3.545 541 HB3 ASN 63 HB1 ASN 63 -6.308 -0.069 3.326 542 HD21 ASN 63 HD21 ASN 63 -4.482 1.976 2.809 543 HD22 ASN 63 HD22 ASN 63 -4.735 3.256 3.946 544 H LYS 64 HN LYS 64 -4.305 -2.917 4.464 545 HA LYS 64 HA LYS 64 -6.129 -4.565 3.155 546 HB2 LYS 64 HB2 LYS 64 -3.738 -4.976 3.058 547 HB3 LYS 64 HB1 LYS 64 -3.683 -5.286 4.785 548 HG2 LYS 64 HG2 LYS 64 -5.132 -7.270 4.419 549 HG3 LYS 64 HG1 LYS 64 -5.003 -6.986 2.682 550 HD2 LYS 64 HD2 LYS 64 -2.573 -7.217 2.827 551 HD3 LYS 64 HD1 LYS 64 -2.695 -7.489 4.561 552 HE2 LYS 64 HE2 LYS 64 -2.427 -9.604 3.432 553 HE3 LYS 64 HE1 LYS 64 -4.050 -9.508 4.111 554 HZ1 LYS 64 HZ1 LYS 64 -4.899 -8.931 1.934 555 HZ2 LYS 64 HZ2 LYS 64 -4.061 -10.399 1.864 556 HZ3 LYS 64 HZ3 LYS 64 -3.342 -8.986 1.277 557 H ASN 65 HN ASN 65 -5.205 -4.487 6.573 558 HA ASN 65 HA ASN 65 -6.875 -6.589 7.434 559 HB2 ASN 65 HB2 ASN 65 -5.669 -4.235 8.889 560 HB3 ASN 65 HB1 ASN 65 -6.608 -5.478 9.708 561 HD21 ASN 65 HD21 ASN 65 -3.798 -4.709 9.990 562 HD22 ASN 65 HD22 ASN 65 -2.883 -6.142 9.681 563 H ALA 66 HN ALA 66 -7.404 -3.131 7.091 564 HA ALA 66 HA ALA 66 -9.953 -3.053 8.318 565 HB1 ALA 66 HB1 ALA 66 -8.797 -1.233 6.203 566 HB2 ALA 66 HB2 ALA 66 -8.622 -1.032 7.946 567 HB3 ALA 66 HB3 ALA 66 -10.212 -0.890 7.197 568 H LEU 67 HN LEU 67 -8.883 -3.383 4.970 569 HA LEU 67 HA LEU 67 -11.395 -3.464 3.747 570 HB2 LEU 67 HB2 LEU 67 -9.263 -3.130 2.569 571 HB3 LEU 67 HB1 LEU 67 -8.814 -4.787 2.908 572 HG LEU 67 HG LEU 67 -10.682 -5.570 1.506 573 HD11 LEU 67 HD11 LEU 67 -11.084 -2.636 0.955 574 HD12 LEU 67 HD12 LEU 67 -12.219 -3.725 1.753 575 HD13 LEU 67 HD13 LEU 67 -11.831 -3.949 0.049 576 HD21 LEU 67 HD21 LEU 67 -8.811 -3.619 0.175 577 HD22 LEU 67 HD22 LEU 67 -9.720 -4.886 -0.646 578 HD23 LEU 67 HD23 LEU 67 -8.477 -5.314 0.529 579 H GLN 68 HN GLN 68 -9.339 -6.075 4.982 580 HA GLN 68 HA GLN 68 -10.988 -8.208 4.256 581 HB2 GLN 68 HB2 GLN 68 -8.600 -8.317 5.075 582 HB3 GLN 68 HB1 GLN 68 -9.228 -8.110 6.705 583 HG2 GLN 68 HG2 GLN 68 -8.834 -10.437 6.308 584 HG3 GLN 68 HG1 GLN 68 -10.572 -10.157 6.404 585 HE21 GLN 68 HE21 GLN 68 -11.064 -12.006 5.246 586 HE22 GLN 68 HE22 GLN 68 -10.784 -12.136 3.544 587 H LYS 69 HN LYS 69 -11.169 -6.008 6.981 588 HA LYS 69 HA LYS 69 -13.063 -7.650 8.410 589 HB2 LYS 69 HB2 LYS 69 -11.443 -6.083 9.537 590 HB3 LYS 69 HB1 LYS 69 -12.391 -4.744 8.905 591 HG2 LYS 69 HG2 LYS 69 -13.039 -5.122 11.169 592 HG3 LYS 69 HG1 LYS 69 -14.365 -5.637 10.126 593 HD2 LYS 69 HD2 LYS 69 -13.581 -7.973 10.342 594 HD3 LYS 69 HD1 LYS 69 -12.322 -7.427 11.450 595 HE2 LYS 69 HE2 LYS 69 -14.119 -8.273 12.768 596 HE3 LYS 69 HE1 LYS 69 -14.131 -6.517 12.923 597 HZ1 LYS 69 HZ1 LYS 69 -15.891 -6.469 11.215 598 HZ2 LYS 69 HZ2 LYS 69 -16.356 -7.298 12.610 599 HZ3 LYS 69 HZ3 LYS 69 -15.927 -8.160 11.223 600 H LEU 70 HN LEU 70 -13.163 -5.031 6.126 601 HA LEU 70 HA LEU 70 -15.965 -4.484 6.530 602 HB2 LEU 70 HB2 LEU 70 -14.100 -3.627 4.311 603 HB3 LEU 70 HB1 LEU 70 -15.727 -3.022 4.558 604 HG LEU 70 HG LEU 70 -13.428 -2.658 6.483 605 HD11 LEU 70 HD11 LEU 70 -13.131 -1.380 4.423 606 HD12 LEU 70 HD12 LEU 70 -13.477 -0.324 5.792 607 HD13 LEU 70 HD13 LEU 70 -14.740 -0.688 4.616 608 HD21 LEU 70 HD21 LEU 70 -14.951 -1.072 7.596 609 HD22 LEU 70 HD22 LEU 70 -15.544 -2.730 7.646 610 HD23 LEU 70 HD23 LEU 70 -16.244 -1.579 6.509 611 H SER 71 HN SER 71 -16.523 -6.788 6.294 612 HA SER 71 HA SER 71 -16.536 -7.765 3.535 613 HB2 SER 71 HB2 SER 71 -17.274 -9.186 6.110 614 HB3 SER 71 HB1 SER 71 -17.104 -9.935 4.522 615 HG SER 71 HG SER 71 -15.159 -9.053 6.307 616 H LYS 72 HN LYS 72 -18.502 -8.423 2.509 617 HA LYS 72 HA LYS 72 -20.998 -7.811 3.899 618 HB2 LYS 72 HB2 LYS 72 -19.923 -5.827 2.423 619 HB3 LYS 72 HB1 LYS 72 -20.783 -6.687 1.151 620 HG2 LYS 72 HG2 LYS 72 -22.861 -6.515 2.534 621 HG3 LYS 72 HG1 LYS 72 -21.959 -5.502 3.663 622 HD2 LYS 72 HD2 LYS 72 -21.454 -3.974 1.720 623 HD3 LYS 72 HD1 LYS 72 -22.606 -4.920 0.775 624 HE2 LYS 72 HE2 LYS 72 -23.161 -3.341 3.281 625 HE3 LYS 72 HE1 LYS 72 -23.728 -2.987 1.651 626 HZ1 LYS 72 HZ1 LYS 72 -24.503 -5.311 3.335 627 HZ2 LYS 72 HZ2 LYS 72 -24.976 -5.094 1.721 628 HZ3 LYS 72 HZ3 LYS 72 -25.481 -3.998 2.903 629 H ALA 73 HN ALA 73 -19.382 -10.052 2.419 630 HA ALA 73 HA ALA 73 -21.071 -10.730 0.196 631 HB1 ALA 73 HB1 ALA 73 -18.846 -12.288 1.491 632 HB2 ALA 73 HB2 ALA 73 -18.690 -11.193 0.117 633 HB3 ALA 73 HB3 ALA 73 -19.625 -12.680 -0.040 634 H ASP 74 HN ASP 74 -20.902 -11.634 3.566 635 HA ASP 74 HA ASP 74 -22.501 -14.019 3.141 636 HB2 ASP 74 HB2 ASP 74 -20.773 -14.062 4.892 637 HB3 ASP 74 HB1 ASP 74 -21.577 -12.736 5.728 638 H GLU 75 HN GLU 75 -22.983 -10.712 3.979 639 HA GLU 75 HA GLU 75 -25.700 -11.220 4.907 640 HB2 GLU 75 HB2 GLU 75 -25.760 -8.772 5.336 641 HB3 GLU 75 HB1 GLU 75 -24.457 -9.597 6.181 642 HG2 GLU 75 HG2 GLU 75 -22.834 -8.774 4.667 643 HG3 GLU 75 HG1 GLU 75 -24.072 -8.175 3.566 644 H SER 76 HN SER 76 -24.169 -10.751 1.999 645 HA SER 76 HA SER 76 -26.654 -10.165 0.655 646 HB2 SER 76 HB2 SER 76 -25.632 -7.925 1.288 647 HB3 SER 76 HB1 SER 76 -24.302 -8.318 0.201 648 HG SER 76 HG SER 76 -26.999 -8.363 -0.654 649 H ALA 77 HN ALA 77 -26.703 -11.597 -0.932 650 HA ALA 77 HA ALA 77 -24.256 -12.785 -1.906 651 HB1 ALA 77 HB1 ALA 77 -27.100 -13.420 -2.666 652 HB2 ALA 77 HB2 ALA 77 -26.180 -14.200 -1.381 653 HB3 ALA 77 HB3 ALA 77 -25.670 -14.372 -3.060 654 HA PRO 78 HA PRO 78 -25.693 -10.944 -6.094 655 HB2 PRO 78 HB2 PRO 78 -27.704 -9.168 -6.218 656 HB3 PRO 78 HB1 PRO 78 -28.009 -10.910 -6.201 657 HG2 PRO 78 HG2 PRO 78 -28.153 -8.943 -3.943 658 HG3 PRO 78 HG1 PRO 78 -29.298 -10.226 -4.382 659 HD2 PRO 78 HD2 PRO 78 -27.446 -10.517 -2.409 660 HD3 PRO 78 HD1 PRO 78 -28.030 -11.871 -3.397 661 H VAL 79 HN VAL 79 -23.700 -9.965 -4.717 662 HA VAL 79 HA VAL 79 -23.717 -7.121 -5.437 663 HB VAL 79 HB VAL 79 -22.204 -6.665 -3.470 664 HG11 VAL 79 HG11 VAL 79 -24.054 -6.412 -1.883 665 HG12 VAL 79 HG12 VAL 79 -25.049 -7.463 -2.890 666 HG13 VAL 79 HG13 VAL 79 -24.506 -5.906 -3.511 667 HG21 VAL 79 HG21 VAL 79 -22.375 -8.170 -1.544 668 HG22 VAL 79 HG22 VAL 79 -21.617 -8.962 -2.926 669 HG23 VAL 79 HG23 VAL 79 -23.299 -9.309 -2.525 670 H ALA 80 HN ALA 80 -22.805 -8.977 -7.132 671 HA ALA 80 HA ALA 80 -20.158 -9.824 -6.862 672 HB1 ALA 80 HB1 ALA 80 -21.701 -10.725 -8.526 673 HB2 ALA 80 HB2 ALA 80 -20.191 -10.186 -9.260 674 HB3 ALA 80 HB3 ALA 80 -21.644 -9.197 -9.403 675 H ASN 81 HN ASN 81 -21.507 -6.809 -7.988 676 HA ASN 81 HA ASN 81 -19.131 -5.688 -9.026 677 HB2 ASN 81 HB2 ASN 81 -20.279 -3.504 -8.802 678 HB3 ASN 81 HB1 ASN 81 -21.284 -4.711 -9.589 679 HD21 ASN 81 HD21 ASN 81 -22.040 -2.259 -8.215 680 HD22 ASN 81 HD22 ASN 81 -23.132 -2.733 -6.959 681 H TYR 82 HN TYR 82 -20.557 -5.674 -5.799 682 HA TYR 82 HA TYR 82 -18.636 -3.919 -4.640 683 HB2 TYR 82 HB2 TYR 82 -20.905 -4.457 -3.663 684 HB3 TYR 82 HB1 TYR 82 -20.289 -6.048 -3.240 685 HD1 TYR 82 HD1 TYR 82 -18.486 -6.249 -1.519 686 HD2 TYR 82 HD2 TYR 82 -20.446 -2.537 -2.279 687 HE1 TYR 82 HE1 TYR 82 -17.648 -5.368 0.616 688 HE2 TYR 82 HE2 TYR 82 -19.607 -1.657 -0.149 689 HH TYR 82 HH TYR 82 -17.156 -3.100 1.608 690 H ASN 83 HN ASN 83 -18.906 -7.421 -4.976 691 HA ASN 83 HA ASN 83 -16.662 -8.073 -3.391 692 HB2 ASN 83 HB2 ASN 83 -18.113 -9.577 -5.564 693 HB3 ASN 83 HB1 ASN 83 -16.740 -10.259 -4.698 694 HD21 ASN 83 HD21 ASN 83 -19.556 -11.087 -4.793 695 HD22 ASN 83 HD22 ASN 83 -20.092 -11.108 -3.148 696 H GLN 84 HN GLN 84 -17.055 -7.497 -6.859 697 HA GLN 84 HA GLN 84 -14.504 -8.299 -7.659 698 HB2 GLN 84 HB2 GLN 84 -16.337 -7.907 -9.243 699 HB3 GLN 84 HB1 GLN 84 -16.288 -6.187 -8.889 700 HG2 GLN 84 HG2 GLN 84 -15.138 -6.357 -10.886 701 HG3 GLN 84 HG1 GLN 84 -13.858 -6.286 -9.682 702 HE21 GLN 84 HE21 GLN 84 -14.478 -9.164 -8.936 703 HE22 GLN 84 HE22 GLN 84 -13.708 -10.084 -10.172 704 H ARG 85 HN ARG 85 -15.671 -5.092 -6.681 705 HA ARG 85 HA ARG 85 -13.252 -3.726 -7.186 706 HB2 ARG 85 HB2 ARG 85 -15.370 -3.055 -5.129 707 HB3 ARG 85 HB1 ARG 85 -14.144 -1.955 -5.748 708 HG2 ARG 85 HG2 ARG 85 -15.116 -2.076 -7.962 709 HG3 ARG 85 HG1 ARG 85 -16.309 -3.243 -7.395 710 HD2 ARG 85 HD2 ARG 85 -17.108 -1.503 -5.779 711 HD3 ARG 85 HD1 ARG 85 -16.034 -0.355 -6.580 712 HE ARG 85 HE ARG 85 -17.629 -1.588 -8.522 713 HH11 ARG 85 HH11 ARG 85 -17.913 0.690 -5.878 714 HH12 ARG 85 HH12 ARG 85 -19.314 1.469 -6.542 715 HH21 ARG 85 HH21 ARG 85 -19.466 -0.568 -9.395 716 HH22 ARG 85 HH22 ARG 85 -20.194 0.763 -8.553 717 H LYS 86 HN LYS 86 -14.432 -5.572 -4.488 718 HA LYS 86 HA LYS 86 -12.388 -4.865 -2.651 719 HB2 LYS 86 HB2 LYS 86 -14.427 -5.708 -1.771 720 HB3 LYS 86 HB1 LYS 86 -14.377 -7.123 -2.814 721 HG2 LYS 86 HG2 LYS 86 -12.411 -7.946 -1.548 722 HG3 LYS 86 HG1 LYS 86 -12.577 -6.561 -0.458 723 HD2 LYS 86 HD2 LYS 86 -14.815 -8.512 -0.959 724 HD3 LYS 86 HD1 LYS 86 -13.620 -8.746 0.314 725 HE2 LYS 86 HE2 LYS 86 -15.420 -6.337 0.037 726 HE3 LYS 86 HE1 LYS 86 -15.689 -7.686 1.134 727 HZ1 LYS 86 HZ1 LYS 86 -14.663 -5.890 2.314 728 HZ2 LYS 86 HZ2 LYS 86 -13.394 -5.810 1.197 729 HZ3 LYS 86 HZ3 LYS 86 -13.555 -7.164 2.195 730 H GLU 87 HN GLU 87 -12.847 -7.566 -4.906 731 HA GLU 87 HA GLU 87 -10.504 -8.979 -4.136 732 HB2 GLU 87 HB2 GLU 87 -12.035 -9.104 -6.744 733 HB3 GLU 87 HB1 GLU 87 -10.861 -10.287 -6.182 734 HG2 GLU 87 HG2 GLU 87 -12.307 -10.795 -4.269 735 HG3 GLU 87 HG1 GLU 87 -13.492 -9.636 -4.870 736 H GLU 88 HN GLU 88 -11.203 -6.678 -6.742 737 HA GLU 88 HA GLU 88 -8.664 -6.821 -7.979 738 HB2 GLU 88 HB2 GLU 88 -10.770 -4.662 -7.970 739 HB3 GLU 88 HB1 GLU 88 -9.299 -4.558 -8.927 740 HG2 GLU 88 HG2 GLU 88 -11.420 -6.684 -9.163 741 HG3 GLU 88 HG1 GLU 88 -11.167 -5.334 -10.267 742 H GLU 89 HN GLU 89 -9.877 -4.981 -5.260 743 HA GLU 89 HA GLU 89 -7.686 -3.184 -5.098 744 HB2 GLU 89 HB2 GLU 89 -9.969 -2.964 -3.959 745 HB3 GLU 89 HB1 GLU 89 -9.349 -4.081 -2.749 746 HG2 GLU 89 HG2 GLU 89 -9.089 -1.853 -1.939 747 HG3 GLU 89 HG1 GLU 89 -7.492 -2.496 -2.316 748 H HIS 90 HN HIS 90 -8.333 -6.385 -3.789 749 HA HIS 90 HA HIS 90 -6.043 -6.629 -2.171 750 HB2 HIS 90 HB2 HIS 90 -7.798 -8.628 -3.571 751 HB3 HIS 90 HB1 HIS 90 -6.299 -9.164 -2.821 752 HD1 HIS 90 HD1 HIS 90 -6.802 -10.164 -0.632 753 HD2 HIS 90 HD2 HIS 90 -9.225 -6.881 -1.415 754 HE1 HIS 90 HE1 HIS 90 -8.222 -9.866 1.421 755 HE2 HIS 90 HE2 HIS 90 -9.752 -7.946 0.881 756 H THR 91 HN THR 91 -6.581 -7.281 -5.595 757 HA THR 91 HA THR 91 -4.063 -8.328 -6.216 758 HB THR 91 HB THR 91 -5.811 -6.665 -8.041 759 HG1 THR 91 HG1 THR 91 -6.846 -8.668 -8.507 760 HG21 THR 91 HG21 THR 91 -3.587 -7.238 -8.925 761 HG22 THR 91 HG22 THR 91 -4.873 -8.057 -9.807 762 HG23 THR 91 HG23 THR 91 -3.914 -8.944 -8.624 763 H LEU 92 HN LEU 92 -5.235 -4.996 -6.038 764 HA LEU 92 HA LEU 92 -2.880 -3.809 -7.111 765 HB2 LEU 92 HB2 LEU 92 -5.020 -2.657 -7.170 766 HB3 LEU 92 HB1 LEU 92 -5.096 -2.651 -5.419 767 HG LEU 92 HG LEU 92 -3.080 -1.192 -5.381 768 HD11 LEU 92 HD11 LEU 92 -3.504 -1.118 -8.364 769 HD12 LEU 92 HD12 LEU 92 -2.112 -1.798 -7.520 770 HD13 LEU 92 HD13 LEU 92 -2.420 -0.064 -7.457 771 HD21 LEU 92 HD21 LEU 92 -4.249 0.831 -6.068 772 HD22 LEU 92 HD22 LEU 92 -5.331 -0.263 -5.206 773 HD23 LEU 92 HD23 LEU 92 -5.418 -0.138 -6.963 774 H LEU 93 HN LEU 93 -4.129 -4.181 -3.795 775 HA LEU 93 HA LEU 93 -1.988 -2.827 -2.555 776 HB2 LEU 93 HB2 LEU 93 -3.876 -4.880 -1.399 777 HB3 LEU 93 HB1 LEU 93 -2.798 -3.867 -0.461 778 HG LEU 93 HG LEU 93 -5.085 -2.883 -2.168 779 HD11 LEU 93 HD11 LEU 93 -6.121 -2.301 -0.033 780 HD12 LEU 93 HD12 LEU 93 -4.769 -3.039 0.828 781 HD13 LEU 93 HD13 LEU 93 -5.838 -4.037 -0.158 782 HD21 LEU 93 HD21 LEU 93 -3.192 -1.395 -0.351 783 HD22 LEU 93 HD22 LEU 93 -4.609 -0.706 -1.142 784 HD23 LEU 93 HD23 LEU 93 -3.253 -1.285 -2.109 785 H ASP 94 HN ASP 94 -2.443 -6.179 -3.472 786 HA ASP 94 HA ASP 94 -0.343 -7.262 -1.925 787 HB2 ASP 94 HB2 ASP 94 -2.072 -8.667 -3.030 788 HB3 ASP 94 HB1 ASP 94 -1.374 -8.262 -4.597 789 H LYS 95 HN LYS 95 -0.405 -6.068 -5.301 790 HA LYS 95 HA LYS 95 2.252 -6.505 -5.919 791 HB2 LYS 95 HB2 LYS 95 0.618 -5.844 -7.591 792 HB3 LYS 95 HB1 LYS 95 0.377 -4.295 -6.793 793 HG2 LYS 95 HG2 LYS 95 2.790 -3.781 -7.284 794 HG3 LYS 95 HG1 LYS 95 2.816 -5.236 -8.285 795 HD2 LYS 95 HD2 LYS 95 1.035 -4.336 -9.676 796 HD3 LYS 95 HD1 LYS 95 0.935 -2.903 -8.653 797 HE2 LYS 95 HE2 LYS 95 2.198 -2.447 -10.690 798 HE3 LYS 95 HE1 LYS 95 3.221 -2.299 -9.264 799 HZ1 LYS 95 HZ1 LYS 95 4.010 -4.580 -9.721 800 HZ2 LYS 95 HZ2 LYS 95 4.403 -3.485 -10.943 801 HZ3 LYS 95 HZ3 LYS 95 3.132 -4.575 -11.164 802 H LEU 96 HN LEU 96 0.761 -3.573 -4.560 803 HA LEU 96 HA LEU 96 3.093 -2.059 -4.379 804 HB2 LEU 96 HB2 LEU 96 0.711 -1.965 -2.525 805 HB3 LEU 96 HB1 LEU 96 1.932 -0.718 -2.681 806 HG LEU 96 HG LEU 96 -0.005 -1.564 -4.838 807 HD11 LEU 96 HD11 LEU 96 -1.090 -0.324 -3.056 808 HD12 LEU 96 HD12 LEU 96 -0.964 0.665 -4.510 809 HD13 LEU 96 HD13 LEU 96 0.140 0.936 -3.162 810 HD21 LEU 96 HD21 LEU 96 2.077 0.617 -4.820 811 HD22 LEU 96 HD22 LEU 96 0.869 0.359 -6.078 812 HD23 LEU 96 HD23 LEU 96 2.115 -0.855 -5.793 813 H THR 97 HN THR 97 1.622 -4.145 -1.900 814 HA THR 97 HA THR 97 3.573 -3.859 0.065 815 HB THR 97 HB THR 97 2.023 -6.384 -0.550 816 HG1 THR 97 HG1 THR 97 0.525 -4.746 -0.328 817 HG21 THR 97 HG21 THR 97 2.255 -6.847 1.817 818 HG22 THR 97 HG22 THR 97 3.113 -5.328 2.058 819 HG23 THR 97 HG23 THR 97 3.852 -6.613 1.101 820 H GLN 98 HN GLN 98 3.383 -6.174 -2.619 821 HA GLN 98 HA GLN 98 5.666 -7.671 -1.944 822 HB2 GLN 98 HB2 GLN 98 3.890 -8.423 -3.487 823 HB3 GLN 98 HB1 GLN 98 4.415 -7.224 -4.659 824 HG2 GLN 98 HG2 GLN 98 5.293 -9.309 -5.334 825 HG3 GLN 98 HG1 GLN 98 6.632 -8.356 -4.705 826 HE21 GLN 98 HE21 GLN 98 6.332 -11.248 -5.004 827 HE22 GLN 98 HE22 GLN 98 6.569 -11.919 -3.427 828 H GLN 99 HN GLN 99 5.204 -4.847 -3.991 829 HA GLN 99 HA GLN 99 7.769 -4.799 -5.152 830 HB2 GLN 99 HB2 GLN 99 5.571 -3.529 -5.768 831 HB3 GLN 99 HB1 GLN 99 6.166 -2.312 -4.648 832 HG2 GLN 99 HG2 GLN 99 8.195 -2.075 -5.968 833 HG3 GLN 99 HG1 GLN 99 7.625 -3.321 -7.078 834 HE21 GLN 99 HE21 GLN 99 8.319 -0.611 -7.697 835 HE22 GLN 99 HE22 GLN 99 6.901 0.139 -8.341 836 H LEU 100 HN LEU 100 6.430 -3.264 -2.261 837 HA LEU 100 HA LEU 100 8.788 -1.803 -1.616 838 HB2 LEU 100 HB2 LEU 100 6.398 -2.609 0.032 839 HB3 LEU 100 HB1 LEU 100 7.699 -1.613 0.654 840 HG LEU 100 HG LEU 100 5.877 -0.892 -1.644 841 HD11 LEU 100 HD11 LEU 100 6.034 0.157 1.176 842 HD12 LEU 100 HD12 LEU 100 4.753 -0.859 0.516 843 HD13 LEU 100 HD13 LEU 100 4.987 0.774 -0.100 844 HD21 LEU 100 HD21 LEU 100 8.121 0.619 -0.314 845 HD22 LEU 100 HD22 LEU 100 6.945 1.342 -1.409 846 HD23 LEU 100 HD23 LEU 100 8.039 0.090 -1.995 847 H GLN 101 HN GLN 101 7.405 -4.840 -0.427 848 HA GLN 101 HA GLN 101 9.362 -5.375 1.505 849 HB2 GLN 101 HB2 GLN 101 7.200 -6.518 1.455 850 HB3 GLN 101 HB1 GLN 101 7.623 -7.290 -0.065 851 HG2 GLN 101 HG2 GLN 101 7.821 -8.804 1.844 852 HG3 GLN 101 HG1 GLN 101 9.356 -8.572 1.013 853 HE21 GLN 101 HE21 GLN 101 10.494 -9.256 2.840 854 HE22 GLN 101 HE22 GLN 101 10.672 -8.253 4.240 855 H GLY 102 HN GLY 102 9.206 -6.104 -1.945 856 HA2 GLY 102 HA2 GLY 102 11.540 -7.689 -2.081 857 HA3 GLY 102 HA1 GLY 102 10.844 -6.774 -3.409 858 H LEU 103 HN LEU 103 11.013 -4.210 -2.452 859 HA LEU 103 HA LEU 103 13.682 -3.524 -3.048 860 HB2 LEU 103 HB2 LEU 103 11.812 -2.026 -3.516 861 HB3 LEU 103 HB1 LEU 103 11.463 -1.890 -1.803 862 HG LEU 103 HG LEU 103 13.666 -0.770 -1.481 863 HD11 LEU 103 HD11 LEU 103 14.839 -1.700 -3.399 864 HD12 LEU 103 HD12 LEU 103 14.854 0.062 -3.453 865 HD13 LEU 103 HD13 LEU 103 13.756 -0.843 -4.496 866 HD21 LEU 103 HD21 LEU 103 12.994 1.356 -2.465 867 HD22 LEU 103 HD22 LEU 103 11.614 0.524 -1.749 868 HD23 LEU 103 HD23 LEU 103 11.834 0.520 -3.499 869 H ALA 104 HN ALA 104 11.878 -3.725 -0.027 870 HA ALA 104 HA ALA 104 13.764 -2.615 1.697 871 HB1 ALA 104 HB1 ALA 104 12.625 -3.892 3.474 872 HB2 ALA 104 HB2 ALA 104 11.749 -4.793 2.236 873 HB3 ALA 104 HB3 ALA 104 11.497 -3.055 2.408 874 H VAL 105 HN VAL 105 13.319 -6.000 0.696 875 HA VAL 105 HA VAL 105 15.485 -6.998 2.219 876 HB VAL 105 HB VAL 105 14.157 -8.161 -0.229 877 HG11 VAL 105 HG11 VAL 105 16.004 -9.474 1.756 878 HG12 VAL 105 HG12 VAL 105 16.385 -9.098 0.075 879 HG13 VAL 105 HG13 VAL 105 15.139 -10.288 0.453 880 HG21 VAL 105 HG21 VAL 105 12.998 -9.590 1.389 881 HG22 VAL 105 HG22 VAL 105 12.641 -7.881 1.646 882 HG23 VAL 105 HG23 VAL 105 13.778 -8.714 2.706 883 H THR 106 HN THR 106 15.208 -5.706 -1.036 884 HA THR 106 HA THR 106 17.751 -6.400 -1.984 885 HB THR 106 HB THR 106 16.098 -3.955 -2.654 886 HG1 THR 106 HG1 THR 106 15.455 -6.398 -3.039 887 HG21 THR 106 HG21 THR 106 18.412 -3.679 -3.372 888 HG22 THR 106 HG22 THR 106 17.356 -3.927 -4.762 889 HG23 THR 106 HG23 THR 106 18.363 -5.248 -4.172 890 H ILE 107 HN ILE 107 16.645 -3.623 -0.089 891 HA ILE 107 HA ILE 107 19.244 -2.397 -0.015 892 HB ILE 107 HB ILE 107 16.831 -1.843 1.717 893 HG12 ILE 107 HG12 ILE 107 17.742 -0.389 -0.778 894 HG13 ILE 107 HG11 ILE 107 16.443 -1.578 -0.753 895 HG21 ILE 107 HG21 ILE 107 19.332 -0.250 1.185 896 HG22 ILE 107 HG22 ILE 107 18.841 -0.979 2.714 897 HG23 ILE 107 HG23 ILE 107 17.917 0.365 2.038 898 HD11 ILE 107 HD11 ILE 107 15.175 -0.168 0.773 899 HD12 ILE 107 HD12 ILE 107 15.582 0.692 -0.714 900 HD13 ILE 107 HD13 ILE 107 16.482 1.018 0.769 901 H SER 108 HN SER 108 17.339 -4.496 2.058 902 HA SER 108 HA SER 108 18.947 -4.358 4.368 903 HB2 SER 108 HB2 SER 108 16.701 -5.286 4.465 904 HB3 SER 108 HB1 SER 108 17.145 -6.574 3.350 905 HG SER 108 HG SER 108 17.724 -6.271 6.059 906 H ARG 109 HN ARG 109 19.292 -6.039 1.369 907 HA ARG 109 HA ARG 109 21.712 -7.363 2.387 908 HB2 ARG 109 HB2 ARG 109 19.891 -8.285 0.152 909 HB3 ARG 109 HB1 ARG 109 21.351 -9.104 0.689 910 HG2 ARG 109 HG2 ARG 109 20.327 -9.483 2.882 911 HG3 ARG 109 HG1 ARG 109 18.856 -8.684 2.323 912 HD2 ARG 109 HD2 ARG 109 18.619 -11.096 2.180 913 HD3 ARG 109 HD1 ARG 109 18.617 -10.379 0.570 914 HE ARG 109 HE ARG 109 21.188 -11.318 1.519 915 HH11 ARG 109 HH11 ARG 109 18.319 -12.010 -0.367 916 HH12 ARG 109 HH12 ARG 109 19.058 -13.314 -1.238 917 HH21 ARG 109 HH21 ARG 109 22.164 -13.016 0.372 918 HH22 ARG 109 HH22 ARG 109 21.251 -13.885 -0.818 919 H GLU 110 HN GLU 110 22.167 -4.917 1.732 920 HA GLU 110 HA GLU 110 22.476 -4.486 -1.096 921 HB2 GLU 110 HB2 GLU 110 22.022 -2.826 1.005 922 HB3 GLU 110 HB1 GLU 110 23.757 -2.625 0.808 923 HG2 GLU 110 HG2 GLU 110 21.666 -2.179 -1.309 924 HG3 GLU 110 HG1 GLU 110 22.526 -0.930 -0.412 925 H ASN 111 HN ASN 111 24.704 -4.556 1.684 926 HA ASN 111 HA ASN 111 26.746 -5.845 0.089 927 HB2 ASN 111 HB2 ASN 111 26.969 -3.360 -0.364 928 HB3 ASN 111 HB1 ASN 111 27.335 -3.153 1.344 929 HD21 ASN 111 HD21 ASN 111 29.383 -2.374 0.961 930 HD22 ASN 111 HD22 ASN 111 30.675 -3.373 0.392 931 H ILE 112 HN ILE 112 25.981 -7.333 1.856 932 HA ILE 112 HA ILE 112 26.876 -6.609 4.527 933 HB ILE 112 HB ILE 112 25.542 -9.179 3.699 934 HG12 ILE 112 HG12 ILE 112 24.245 -6.691 4.822 935 HG13 ILE 112 HG11 ILE 112 24.153 -7.183 3.139 936 HG21 ILE 112 HG21 ILE 112 25.845 -7.819 6.371 937 HG22 ILE 112 HG22 ILE 112 26.678 -9.280 5.841 938 HG23 ILE 112 HG23 ILE 112 24.931 -9.297 6.076 939 HD11 ILE 112 HD11 ILE 112 22.979 -9.208 3.777 940 HD12 ILE 112 HD12 ILE 112 22.143 -7.779 4.388 941 HD13 ILE 112 HD13 ILE 112 23.117 -8.763 5.478 942 H THR 113 HN THR 113 27.091 -9.775 2.909 943 HA THR 113 HA THR 113 29.672 -10.117 4.254 944 HB THR 113 HB THR 113 28.188 -12.364 2.941 945 HG1 THR 113 HG1 THR 113 27.555 -11.867 5.600 946 HG21 THR 113 HG21 THR 113 30.395 -12.760 3.961 947 HG22 THR 113 HG22 THR 113 29.119 -13.648 4.790 948 HG23 THR 113 HG23 THR 113 29.775 -12.176 5.505 949 H GLU 114 HN GLU 114 28.651 -9.168 1.312 950 HA GLU 114 HA GLU 114 30.335 -10.845 -0.314 951 HB2 GLU 114 HB2 GLU 114 29.589 -9.340 -2.172 952 HB3 GLU 114 HB1 GLU 114 28.302 -10.175 -1.326 953 HG2 GLU 114 HG2 GLU 114 27.856 -8.137 -0.031 954 HG3 GLU 114 HG1 GLU 114 29.111 -7.307 -0.951 955 H VAL 115 HN VAL 115 31.263 -8.809 1.805 956 HA VAL 115 HA VAL 115 33.524 -7.884 0.175 957 HB VAL 115 HB VAL 115 33.814 -6.069 1.959 958 HG11 VAL 115 HG11 VAL 115 32.275 -4.547 0.814 959 HG12 VAL 115 HG12 VAL 115 31.446 -5.928 0.096 960 HG13 VAL 115 HG13 VAL 115 33.125 -5.588 -0.327 961 HG21 VAL 115 HG21 VAL 115 30.921 -6.771 2.462 962 HG22 VAL 115 HG22 VAL 115 31.746 -5.337 3.074 963 HG23 VAL 115 HG23 VAL 115 32.251 -6.940 3.608 964 H GLY 116 HN GLY 116 32.974 -10.343 1.672 965 HA2 GLY 116 HA2 GLY 116 35.075 -10.183 3.742 966 HA3 GLY 116 HA1 GLY 116 33.745 -11.331 3.769 967 H ALA 117 HN ALA 117 36.950 -10.899 2.986 968 HA ALA 117 HA ALA 117 36.958 -13.338 1.338 969 HB1 ALA 117 HB1 ALA 117 37.386 -11.386 -0.077 970 HB2 ALA 117 HB2 ALA 117 38.820 -12.406 0.048 971 HB3 ALA 117 HB3 ALA 117 38.718 -10.911 0.976 972 HA PRO 118 HA PRO 118 39.954 -14.693 4.303 973 HB2 PRO 118 HB2 PRO 118 41.218 -16.649 2.978 974 HB3 PRO 118 HB1 PRO 118 39.508 -16.785 3.405 975 HG2 PRO 118 HG2 PRO 118 40.759 -16.094 0.783 976 HG3 PRO 118 HG1 PRO 118 39.343 -17.106 1.117 977 HD2 PRO 118 HD2 PRO 118 39.249 -14.464 0.299 978 HD3 PRO 118 HD1 PRO 118 37.935 -15.315 1.133 979 H THR 119 HN THR 119 40.827 -12.336 3.502 980 HA THR 119 HA THR 119 43.700 -12.704 3.292 981 HB THR 119 HB THR 119 42.269 -10.837 1.382 982 HG1 THR 119 HG1 THR 119 42.994 -13.510 1.174 983 HG21 THR 119 HG21 THR 119 45.165 -11.677 1.583 984 HG22 THR 119 HG22 THR 119 44.510 -10.101 2.032 985 HG23 THR 119 HG23 THR 119 44.482 -10.621 0.347 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 -19.258 23.399 -2.939 2 H2 GLY 1 HT2 GLY 1 -18.443 22.908 -1.544 3 H3 GLY 1 HT3 GLY 1 -19.967 23.627 -1.420 4 HA2 GLY 1 HA1 GLY 1 -20.958 21.748 -2.597 5 HA3 GLY 1 HA2 GLY 1 -19.370 20.999 -2.657 6 HA PRO 2 HA PRO 2 -21.612 20.761 1.707 7 HB2 PRO 2 HB2 PRO 2 -23.548 18.805 0.628 8 HB3 PRO 2 HB1 PRO 2 -23.807 20.136 1.758 9 HG2 PRO 2 HG2 PRO 2 -24.683 20.262 -0.769 10 HG3 PRO 2 HG1 PRO 2 -24.066 21.694 0.075 11 HD2 PRO 2 HD2 PRO 2 -22.729 19.979 -1.979 12 HD3 PRO 2 HD1 PRO 2 -22.685 21.743 -1.777 13 H MET 3 HN MET 3 -21.252 18.292 -0.796 14 HA MET 3 HA MET 3 -19.825 16.621 1.158 15 HB2 MET 3 HB2 MET 3 -21.751 15.642 -0.961 16 HB3 MET 3 HB1 MET 3 -20.738 14.606 0.032 17 HG2 MET 3 HG2 MET 3 -22.919 16.423 1.035 18 HG3 MET 3 HG1 MET 3 -23.025 14.675 0.849 19 HE1 MET 3 HE1 MET 3 -23.692 16.317 3.531 20 HE2 MET 3 HE2 MET 3 -22.974 15.258 4.743 21 HE3 MET 3 HE3 MET 3 -23.875 14.568 3.393 22 H ALA 4 HN ALA 4 -18.223 18.155 -0.079 23 HA ALA 4 HA ALA 4 -17.492 17.358 -2.726 24 HB1 ALA 4 HB1 ALA 4 -17.032 19.610 -1.884 25 HB2 ALA 4 HB2 ALA 4 -15.559 18.806 -2.423 26 HB3 ALA 4 HB3 ALA 4 -15.911 18.937 -0.702 27 H MET 5 HN MET 5 -16.639 16.347 0.488 28 HA MET 5 HA MET 5 -14.621 14.511 -0.602 29 HB2 MET 5 HB2 MET 5 -13.970 15.878 1.371 30 HB3 MET 5 HB1 MET 5 -15.269 15.128 2.287 31 HG2 MET 5 HG2 MET 5 -14.198 12.936 1.961 32 HG3 MET 5 HG1 MET 5 -12.872 13.733 1.119 33 HE1 MET 5 HE1 MET 5 -14.672 13.125 4.527 34 HE2 MET 5 HE2 MET 5 -14.889 14.865 4.343 35 HE3 MET 5 HE3 MET 5 -13.832 14.238 5.608 36 H LEU 6 HN LEU 6 -15.792 12.854 -1.466 37 HA LEU 6 HA LEU 6 -18.139 11.845 -0.172 38 HB2 LEU 6 HB2 LEU 6 -16.583 10.826 -2.546 39 HB3 LEU 6 HB1 LEU 6 -18.087 10.125 -1.983 40 HG LEU 6 HG LEU 6 -17.747 12.942 -3.018 41 HD11 LEU 6 HD11 LEU 6 -19.043 10.512 -4.245 42 HD12 LEU 6 HD12 LEU 6 -17.554 11.289 -4.783 43 HD13 LEU 6 HD13 LEU 6 -19.091 12.145 -4.909 44 HD21 LEU 6 HD21 LEU 6 -20.208 11.440 -2.126 45 HD22 LEU 6 HD22 LEU 6 -20.208 13.007 -2.935 46 HD23 LEU 6 HD23 LEU 6 -19.487 12.842 -1.335 47 H ALA 7 HN ALA 7 -16.723 11.515 1.849 48 HA ALA 7 HA ALA 7 -15.344 8.980 1.937 49 HB1 ALA 7 HB1 ALA 7 -15.136 9.420 4.335 50 HB2 ALA 7 HB2 ALA 7 -16.200 10.817 4.172 51 HB3 ALA 7 HB3 ALA 7 -14.622 10.814 3.384 52 H ARG 8 HN ARG 8 -17.136 7.786 1.038 53 HA ARG 8 HA ARG 8 -19.721 7.769 2.107 54 HB2 ARG 8 HB2 ARG 8 -18.428 5.463 0.659 55 HB3 ARG 8 HB1 ARG 8 -20.136 5.866 0.723 56 HG2 ARG 8 HG2 ARG 8 -17.968 7.406 -0.685 57 HG3 ARG 8 HG1 ARG 8 -19.255 6.458 -1.429 58 HD2 ARG 8 HD2 ARG 8 -19.663 8.915 0.270 59 HD3 ARG 8 HD1 ARG 8 -19.686 8.887 -1.491 60 HE ARG 8 HE ARG 8 -21.556 7.034 -0.716 61 HH11 ARG 8 HH11 ARG 8 -21.032 10.448 -0.139 62 HH12 ARG 8 HH12 ARG 8 -22.723 10.819 -0.044 63 HH21 ARG 8 HH21 ARG 8 -23.787 7.530 -0.579 64 HH22 ARG 8 HH22 ARG 8 -24.288 9.165 -0.287 65 H ARG 9 HN ARG 9 -17.453 5.029 2.290 66 HA ARG 9 HA ARG 9 -16.806 3.664 3.971 67 HB2 ARG 9 HB2 ARG 9 -18.065 5.807 5.657 68 HB3 ARG 9 HB1 ARG 9 -17.357 4.361 6.363 69 HG2 ARG 9 HG2 ARG 9 -15.202 4.913 5.416 70 HG3 ARG 9 HG1 ARG 9 -15.893 6.316 4.601 71 HD2 ARG 9 HD2 ARG 9 -16.377 7.364 6.711 72 HD3 ARG 9 HD1 ARG 9 -15.868 5.922 7.589 73 HE ARG 9 HE ARG 9 -13.608 6.422 6.458 74 HH11 ARG 9 HH11 ARG 9 -15.890 8.858 7.533 75 HH12 ARG 9 HH12 ARG 9 -14.665 10.039 7.869 76 HH21 ARG 9 HH21 ARG 9 -11.991 7.978 6.903 77 HH22 ARG 9 HH22 ARG 9 -12.448 9.540 7.505 78 H GLN 10 HN GLN 10 -20.128 4.772 4.633 79 HA GLN 10 HA GLN 10 -20.899 2.470 6.037 80 HB2 GLN 10 HB2 GLN 10 -22.061 4.639 6.192 81 HB3 GLN 10 HB1 GLN 10 -22.655 4.428 4.551 82 HG2 GLN 10 HG2 GLN 10 -24.362 3.881 6.195 83 HG3 GLN 10 HG1 GLN 10 -23.917 2.467 5.240 84 HE21 GLN 10 HE21 GLN 10 -24.642 1.043 6.802 85 HE22 GLN 10 HE22 GLN 10 -23.804 0.793 8.294 86 H ARG 11 HN ARG 11 -22.105 3.423 2.808 87 HA ARG 11 HA ARG 11 -22.696 0.604 2.305 88 HB2 ARG 11 HB2 ARG 11 -23.593 3.113 0.881 89 HB3 ARG 11 HB1 ARG 11 -23.978 1.490 0.332 90 HG2 ARG 11 HG2 ARG 11 -25.112 1.081 2.500 91 HG3 ARG 11 HG1 ARG 11 -24.822 2.768 2.923 92 HD2 ARG 11 HD2 ARG 11 -26.370 1.822 0.514 93 HD3 ARG 11 HD1 ARG 11 -27.087 2.376 2.025 94 HE ARG 11 HE ARG 11 -25.454 4.426 1.212 95 HH11 ARG 11 HH11 ARG 11 -28.152 2.692 -0.192 96 HH12 ARG 11 HH12 ARG 11 -28.735 4.064 -1.079 97 HH21 ARG 11 HH21 ARG 11 -26.214 6.226 0.047 98 HH22 ARG 11 HH22 ARG 11 -27.624 6.076 -0.951 99 H ASP 12 HN ASP 12 -20.542 3.105 1.407 100 HA ASP 12 HA ASP 12 -19.394 1.319 -0.632 101 HB2 ASP 12 HB2 ASP 12 -19.776 4.303 -0.714 102 HB3 ASP 12 HB1 ASP 12 -18.476 3.550 -1.631 103 HA PRO 13 HA PRO 13 -16.245 2.168 2.743 104 HB2 PRO 13 HB2 PRO 13 -15.462 -0.444 2.932 105 HB3 PRO 13 HB1 PRO 13 -16.737 0.261 3.932 106 HG2 PRO 13 HG2 PRO 13 -16.971 -1.393 1.449 107 HG3 PRO 13 HG1 PRO 13 -17.924 -1.474 2.942 108 HD2 PRO 13 HD2 PRO 13 -18.852 -0.259 0.724 109 HD3 PRO 13 HD1 PRO 13 -19.241 0.334 2.352 110 H LEU 14 HN LEU 14 -16.310 0.154 -0.132 111 HA LEU 14 HA LEU 14 -13.533 -0.074 -0.521 112 HB2 LEU 14 HB2 LEU 14 -15.688 -0.078 -2.641 113 HB3 LEU 14 HB1 LEU 14 -14.059 -0.714 -2.810 114 HG LEU 14 HG LEU 14 -16.168 -1.821 -0.946 115 HD11 LEU 14 HD11 LEU 14 -15.126 -2.862 -3.574 116 HD12 LEU 14 HD12 LEU 14 -16.733 -2.202 -3.280 117 HD13 LEU 14 HD13 LEU 14 -16.241 -3.705 -2.501 118 HD21 LEU 14 HD21 LEU 14 -13.981 -2.236 -0.053 119 HD22 LEU 14 HD22 LEU 14 -13.383 -2.751 -1.629 120 HD23 LEU 14 HD23 LEU 14 -14.578 -3.729 -0.776 121 H GLN 15 HN GLN 15 -15.870 2.345 -1.646 122 HA GLN 15 HA GLN 15 -14.061 3.720 -3.326 123 HB2 GLN 15 HB2 GLN 15 -16.492 4.015 -3.498 124 HB3 GLN 15 HB1 GLN 15 -16.518 4.779 -1.915 125 HG2 GLN 15 HG2 GLN 15 -15.077 6.576 -2.786 126 HG3 GLN 15 HG1 GLN 15 -15.140 5.826 -4.379 127 HE21 GLN 15 HE21 GLN 15 -17.933 5.035 -4.070 128 HE22 GLN 15 HE22 GLN 15 -18.860 6.480 -4.254 129 H ALA 16 HN ALA 16 -15.045 4.303 0.046 130 HA ALA 16 HA ALA 16 -13.425 6.603 0.393 131 HB1 ALA 16 HB1 ALA 16 -13.849 6.279 2.792 132 HB2 ALA 16 HB2 ALA 16 -14.554 4.700 2.440 133 HB3 ALA 16 HB3 ALA 16 -15.324 6.165 1.832 134 H LEU 17 HN LEU 17 -12.967 3.200 1.265 135 HA LEU 17 HA LEU 17 -10.407 3.472 2.370 136 HB2 LEU 17 HB2 LEU 17 -11.841 1.466 2.593 137 HB3 LEU 17 HB1 LEU 17 -11.519 1.078 0.914 138 HG LEU 17 HG LEU 17 -9.132 0.808 1.430 139 HD11 LEU 17 HD11 LEU 17 -9.983 1.338 4.273 140 HD12 LEU 17 HD12 LEU 17 -8.925 2.347 3.285 141 HD13 LEU 17 HD13 LEU 17 -8.401 0.737 3.777 142 HD21 LEU 17 HD21 LEU 17 -10.572 -1.136 1.501 143 HD22 LEU 17 HD22 LEU 17 -10.983 -0.796 3.182 144 HD23 LEU 17 HD23 LEU 17 -9.334 -1.249 2.752 145 H ARG 18 HN ARG 18 -11.439 2.998 -0.977 146 HA ARG 18 HA ARG 18 -8.934 2.575 -2.147 147 HB2 ARG 18 HB2 ARG 18 -11.112 2.361 -3.333 148 HB3 ARG 18 HB1 ARG 18 -11.249 4.113 -3.340 149 HG2 ARG 18 HG2 ARG 18 -9.185 4.240 -4.682 150 HG3 ARG 18 HG1 ARG 18 -9.132 2.476 -4.723 151 HD2 ARG 18 HD2 ARG 18 -11.382 2.492 -5.781 152 HD3 ARG 18 HD1 ARG 18 -11.294 4.251 -5.848 153 HE ARG 18 HE ARG 18 -9.014 3.218 -7.088 154 HH11 ARG 18 HH11 ARG 18 -12.475 3.358 -7.580 155 HH12 ARG 18 HH12 ARG 18 -12.367 3.244 -9.307 156 HH21 ARG 18 HH21 ARG 18 -8.859 3.085 -9.359 157 HH22 ARG 18 HH22 ARG 18 -10.303 3.094 -10.322 158 H ARG 19 HN ARG 19 -10.553 5.540 -1.167 159 HA ARG 19 HA ARG 19 -8.763 7.386 -2.291 160 HB2 ARG 19 HB2 ARG 19 -10.416 7.569 0.236 161 HB3 ARG 19 HB1 ARG 19 -9.605 8.931 -0.526 162 HG2 ARG 19 HG2 ARG 19 -10.975 8.643 -2.520 163 HG3 ARG 19 HG1 ARG 19 -11.773 7.256 -1.776 164 HD2 ARG 19 HD2 ARG 19 -13.115 9.305 -1.598 165 HD3 ARG 19 HD1 ARG 19 -12.657 8.667 -0.021 166 HE ARG 19 HE ARG 19 -10.958 10.411 0.085 167 HH11 ARG 19 HH11 ARG 19 -13.485 10.813 -2.310 168 HH12 ARG 19 HH12 ARG 19 -13.298 12.537 -2.391 169 HH21 ARG 19 HH21 ARG 19 -10.721 12.670 -0.017 170 HH22 ARG 19 HH22 ARG 19 -11.733 13.594 -1.082 171 H ARG 20 HN ARG 20 -8.787 5.744 0.844 172 HA ARG 20 HA ARG 20 -6.336 6.863 1.738 173 HB2 ARG 20 HB2 ARG 20 -7.777 4.350 2.589 174 HB3 ARG 20 HB1 ARG 20 -6.378 5.019 3.416 175 HG2 ARG 20 HG2 ARG 20 -9.053 6.364 3.083 176 HG3 ARG 20 HG1 ARG 20 -8.435 5.612 4.555 177 HD2 ARG 20 HD2 ARG 20 -6.584 7.231 4.588 178 HD3 ARG 20 HD1 ARG 20 -7.230 7.989 3.134 179 HE ARG 20 HE ARG 20 -8.995 7.860 5.462 180 HH11 ARG 20 HH11 ARG 20 -6.860 9.772 3.439 181 HH12 ARG 20 HH12 ARG 20 -7.414 11.289 4.073 182 HH21 ARG 20 HH21 ARG 20 -9.727 9.863 6.284 183 HH22 ARG 20 HH22 ARG 20 -9.045 11.339 5.680 184 H ASN 21 HN ASN 21 -7.153 3.912 -0.042 185 HA ASN 21 HA ASN 21 -4.558 2.810 -0.070 186 HB2 ASN 21 HB2 ASN 21 -6.822 2.512 -2.058 187 HB3 ASN 21 HB1 ASN 21 -5.309 1.624 -2.174 188 HD21 ASN 21 HD21 ASN 21 -7.882 0.462 -1.914 189 HD22 ASN 21 HD22 ASN 21 -7.897 -0.395 -0.411 190 H GLN 22 HN GLN 22 -6.154 5.110 -2.238 191 HA GLN 22 HA GLN 22 -4.057 5.376 -4.094 192 HB2 GLN 22 HB2 GLN 22 -6.303 6.216 -4.547 193 HB3 GLN 22 HB1 GLN 22 -6.151 7.384 -3.241 194 HG2 GLN 22 HG2 GLN 22 -4.331 8.487 -4.448 195 HG3 GLN 22 HG1 GLN 22 -4.499 7.321 -5.758 196 HE21 GLN 22 HE21 GLN 22 -4.773 10.226 -5.787 197 HE22 GLN 22 HE22 GLN 22 -6.356 10.546 -6.395 198 H GLU 23 HN GLU 23 -4.606 6.715 -0.952 199 HA GLU 23 HA GLU 23 -2.759 8.867 -1.069 200 HB2 GLU 23 HB2 GLU 23 -4.633 8.494 0.624 201 HB3 GLU 23 HB1 GLU 23 -3.586 7.309 1.386 202 HG2 GLU 23 HG2 GLU 23 -3.391 9.339 2.589 203 HG3 GLU 23 HG1 GLU 23 -1.894 9.103 1.688 204 H LEU 24 HN LEU 24 -2.629 5.568 0.192 205 HA LEU 24 HA LEU 24 0.111 5.607 0.898 206 HB2 LEU 24 HB2 LEU 24 -1.681 3.262 0.257 207 HB3 LEU 24 HB1 LEU 24 -0.109 3.154 1.022 208 HG LEU 24 HG LEU 24 -2.517 4.546 2.210 209 HD11 LEU 24 HD11 LEU 24 -1.247 1.906 2.923 210 HD12 LEU 24 HD12 LEU 24 -2.792 2.113 2.097 211 HD13 LEU 24 HD13 LEU 24 -2.597 2.676 3.756 212 HD21 LEU 24 HD21 LEU 24 0.209 3.944 3.356 213 HD22 LEU 24 HD22 LEU 24 -1.155 4.614 4.250 214 HD23 LEU 24 HD23 LEU 24 -0.419 5.540 2.941 215 H LYS 25 HN LYS 25 -1.635 4.681 -2.022 216 HA LYS 25 HA LYS 25 0.450 3.481 -3.422 217 HB2 LYS 25 HB2 LYS 25 -1.780 3.334 -4.279 218 HB3 LYS 25 HB1 LYS 25 -1.913 5.081 -4.404 219 HG2 LYS 25 HG2 LYS 25 -1.608 4.056 -6.587 220 HG3 LYS 25 HG1 LYS 25 -0.247 5.100 -6.176 221 HD2 LYS 25 HD2 LYS 25 0.972 3.048 -5.406 222 HD3 LYS 25 HD1 LYS 25 -0.349 2.093 -6.080 223 HE2 LYS 25 HE2 LYS 25 1.332 4.050 -7.638 224 HE3 LYS 25 HE1 LYS 25 1.591 2.308 -7.604 225 HZ1 LYS 25 HZ1 LYS 25 0.330 3.043 -9.550 226 HZ2 LYS 25 HZ2 LYS 25 -0.901 3.623 -8.546 227 HZ3 LYS 25 HZ3 LYS 25 -0.555 1.968 -8.592 228 H GLN 26 HN GLN 26 -0.486 6.906 -3.284 229 HA GLN 26 HA GLN 26 1.513 7.826 -5.040 230 HB2 GLN 26 HB2 GLN 26 0.071 9.276 -2.818 231 HB3 GLN 26 HB1 GLN 26 1.082 10.058 -4.024 232 HG2 GLN 26 HG2 GLN 26 -1.253 8.370 -4.824 233 HG3 GLN 26 HG1 GLN 26 -1.466 10.048 -4.345 234 HE21 GLN 26 HE21 GLN 26 1.400 9.005 -6.060 235 HE22 GLN 26 HE22 GLN 26 1.007 9.765 -7.557 236 H GLN 27 HN GLN 27 1.498 7.092 -1.637 237 HA GLN 27 HA GLN 27 3.978 8.368 -1.027 238 HB2 GLN 27 HB2 GLN 27 2.430 6.200 0.399 239 HB3 GLN 27 HB1 GLN 27 3.877 6.967 1.044 240 HG2 GLN 27 HG2 GLN 27 2.749 9.121 1.070 241 HG3 GLN 27 HG1 GLN 27 1.314 8.391 0.355 242 HE21 GLN 27 HE21 GLN 27 3.263 6.850 2.815 243 HE22 GLN 27 HE22 GLN 27 2.084 6.935 4.070 244 H VAL 28 HN VAL 28 2.979 5.198 -2.164 245 HA VAL 28 HA VAL 28 5.497 3.915 -1.898 246 HB VAL 28 HB VAL 28 3.178 3.321 -3.749 247 HG11 VAL 28 HG11 VAL 28 4.219 1.112 -4.047 248 HG12 VAL 28 HG12 VAL 28 5.626 1.673 -3.143 249 HG13 VAL 28 HG13 VAL 28 5.218 2.418 -4.688 250 HG21 VAL 28 HG21 VAL 28 2.725 1.485 -2.177 251 HG22 VAL 28 HG22 VAL 28 2.612 3.065 -1.399 252 HG23 VAL 28 HG23 VAL 28 4.038 2.058 -1.149 253 H ASP 29 HN ASP 29 3.874 5.617 -4.564 254 HA ASP 29 HA ASP 29 5.884 5.398 -6.495 255 HB2 ASP 29 HB2 ASP 29 3.844 7.568 -5.986 256 HB3 ASP 29 HB1 ASP 29 4.979 7.652 -7.327 257 H SER 30 HN SER 30 5.499 7.586 -3.791 258 HA SER 30 HA SER 30 7.647 9.307 -4.419 259 HB2 SER 30 HB2 SER 30 6.440 8.667 -1.718 260 HB3 SER 30 HB1 SER 30 7.462 10.054 -2.090 261 HG SER 30 HG SER 30 4.915 9.490 -3.243 262 H LEU 31 HN LEU 31 7.411 6.334 -2.525 263 HA LEU 31 HA LEU 31 10.033 6.404 -1.475 264 HB2 LEU 31 HB2 LEU 31 7.995 4.976 -0.776 265 HB3 LEU 31 HB1 LEU 31 8.481 3.889 -2.057 266 HG LEU 31 HG LEU 31 9.222 3.173 0.200 267 HD11 LEU 31 HD11 LEU 31 11.558 2.692 -0.383 268 HD12 LEU 31 HD12 LEU 31 11.440 3.830 -1.725 269 HD13 LEU 31 HD13 LEU 31 10.446 2.373 -1.714 270 HD21 LEU 31 HD21 LEU 31 10.991 5.609 0.091 271 HD22 LEU 31 HD22 LEU 31 11.016 4.353 1.328 272 HD23 LEU 31 HD23 LEU 31 9.602 5.391 1.154 273 H LEU 32 HN LEU 32 8.621 5.020 -4.404 274 HA LEU 32 HA LEU 32 10.891 3.646 -5.309 275 HB2 LEU 32 HB2 LEU 32 8.597 4.866 -6.849 276 HB3 LEU 32 HB1 LEU 32 9.760 3.739 -7.520 277 HG LEU 32 HG LEU 32 7.845 3.124 -5.269 278 HD11 LEU 32 HD11 LEU 32 7.796 2.312 -8.170 279 HD12 LEU 32 HD12 LEU 32 6.677 3.420 -7.377 280 HD13 LEU 32 HD13 LEU 32 6.705 1.717 -6.919 281 HD21 LEU 32 HD21 LEU 32 9.751 1.353 -6.791 282 HD22 LEU 32 HD22 LEU 32 8.558 0.807 -5.612 283 HD23 LEU 32 HD23 LEU 32 9.894 1.835 -5.101 284 H SER 33 HN SER 33 9.770 6.967 -5.839 285 HA SER 33 HA SER 33 11.826 7.601 -7.690 286 HB2 SER 33 HB2 SER 33 11.116 9.997 -7.161 287 HB3 SER 33 HB1 SER 33 9.886 8.928 -7.828 288 HG SER 33 HG SER 33 10.145 9.111 -5.039 289 H GLU 34 HN GLU 34 11.649 7.673 -4.192 290 HA GLU 34 HA GLU 34 13.901 9.441 -3.889 291 HB2 GLU 34 HB2 GLU 34 12.536 7.654 -1.873 292 HB3 GLU 34 HB1 GLU 34 13.783 8.833 -1.499 293 HG2 GLU 34 HG2 GLU 34 11.053 9.430 -2.613 294 HG3 GLU 34 HG1 GLU 34 11.585 9.685 -0.954 295 H SER 35 HN SER 35 13.334 5.989 -3.918 296 HA SER 35 HA SER 35 15.841 5.268 -2.795 297 HB2 SER 35 HB2 SER 35 15.185 2.959 -3.613 298 HB3 SER 35 HB1 SER 35 14.033 3.739 -2.528 299 HG SER 35 HG SER 35 12.615 3.819 -4.083 300 H GLN 36 HN GLN 36 15.117 6.483 -5.846 301 HA GLN 36 HA GLN 36 17.221 4.886 -7.126 302 HB2 GLN 36 HB2 GLN 36 15.100 6.617 -8.414 303 HB3 GLN 36 HB1 GLN 36 16.319 5.685 -9.270 304 HG2 GLN 36 HG2 GLN 36 14.028 4.631 -7.633 305 HG3 GLN 36 HG1 GLN 36 14.243 4.520 -9.377 306 HE21 GLN 36 HE21 GLN 36 15.014 3.183 -6.314 307 HE22 GLN 36 HE22 GLN 36 15.887 1.808 -6.894 308 H LEU 37 HN LEU 37 16.889 7.616 -5.442 309 HA LEU 37 HA LEU 37 18.195 9.525 -7.137 310 HB2 LEU 37 HB2 LEU 37 17.729 9.518 -4.156 311 HB3 LEU 37 HB1 LEU 37 18.361 10.876 -5.065 312 HG LEU 37 HG LEU 37 15.623 9.680 -5.478 313 HD11 LEU 37 HD11 LEU 37 15.826 10.688 -3.265 314 HD12 LEU 37 HD12 LEU 37 14.789 11.652 -4.314 315 HD13 LEU 37 HD13 LEU 37 16.443 12.170 -3.994 316 HD21 LEU 37 HD21 LEU 37 16.434 10.775 -7.463 317 HD22 LEU 37 HD22 LEU 37 16.934 12.181 -6.526 318 HD23 LEU 37 HD23 LEU 37 15.221 11.796 -6.695 319 H LYS 38 HN LYS 38 20.282 10.003 -7.274 320 HA LYS 38 HA LYS 38 22.176 8.016 -6.616 321 HB2 LYS 38 HB2 LYS 38 22.705 10.868 -7.471 322 HB3 LYS 38 HB1 LYS 38 23.804 9.505 -7.627 323 HG2 LYS 38 HG2 LYS 38 22.349 8.462 -9.250 324 HG3 LYS 38 HG1 LYS 38 21.151 9.741 -9.039 325 HD2 LYS 38 HD2 LYS 38 22.809 11.384 -9.845 326 HD3 LYS 38 HD1 LYS 38 23.951 10.067 -10.119 327 HE2 LYS 38 HE2 LYS 38 22.863 10.679 -12.197 328 HE3 LYS 38 HE1 LYS 38 22.380 9.056 -11.714 329 HZ1 LYS 38 HZ1 LYS 38 20.295 9.906 -10.930 330 HZ2 LYS 38 HZ2 LYS 38 20.524 10.436 -12.520 331 HZ3 LYS 38 HZ3 LYS 38 20.767 11.502 -11.228 332 H GLU 39 HN GLU 39 21.270 11.057 -5.140 333 HA GLU 39 HA GLU 39 23.463 11.112 -3.294 334 HB2 GLU 39 HB2 GLU 39 20.829 12.597 -3.197 335 HB3 GLU 39 HB1 GLU 39 22.248 12.949 -2.220 336 HG2 GLU 39 HG2 GLU 39 22.037 13.190 -5.208 337 HG3 GLU 39 HG1 GLU 39 22.067 14.515 -4.046 338 H ALA 40 HN ALA 40 20.440 9.526 -3.439 339 HA ALA 40 HA ALA 40 20.257 9.185 -0.561 340 HB1 ALA 40 HB1 ALA 40 18.238 9.724 -1.874 341 HB2 ALA 40 HB2 ALA 40 18.095 8.220 -0.967 342 HB3 ALA 40 HB3 ALA 40 18.402 8.177 -2.702 343 H LEU 41 HN LEU 41 21.897 7.764 -2.982 344 HA LEU 41 HA LEU 41 21.503 5.007 -2.194 345 HB2 LEU 41 HB2 LEU 41 23.492 6.254 -4.091 346 HB3 LEU 41 HB1 LEU 41 23.283 4.531 -3.847 347 HG LEU 41 HG LEU 41 21.221 6.418 -4.983 348 HD11 LEU 41 HD11 LEU 41 23.067 5.995 -6.509 349 HD12 LEU 41 HD12 LEU 41 21.594 5.202 -7.064 350 HD13 LEU 41 HD13 LEU 41 22.865 4.257 -6.289 351 HD21 LEU 41 HD21 LEU 41 20.184 4.615 -3.711 352 HD22 LEU 41 HD22 LEU 41 21.134 3.428 -4.602 353 HD23 LEU 41 HD23 LEU 41 19.925 4.397 -5.441 354 H GLU 42 HN GLU 42 22.955 7.462 -0.731 355 HA GLU 42 HA GLU 42 25.491 6.398 -0.039 356 HB2 GLU 42 HB2 GLU 42 23.762 8.446 1.365 357 HB3 GLU 42 HB1 GLU 42 25.408 8.053 1.835 358 HG2 GLU 42 HG2 GLU 42 24.549 9.222 -0.801 359 HG3 GLU 42 HG1 GLU 42 25.353 10.075 0.519 360 HA PRO 43 HA PRO 43 24.610 3.047 2.534 361 HB2 PRO 43 HB2 PRO 43 26.282 3.568 4.723 362 HB3 PRO 43 HB1 PRO 43 26.725 2.695 3.255 363 HG2 PRO 43 HG2 PRO 43 27.192 5.546 3.978 364 HG3 PRO 43 HG1 PRO 43 28.229 4.429 3.073 365 HD2 PRO 43 HD2 PRO 43 26.844 6.335 1.825 366 HD3 PRO 43 HD1 PRO 43 27.033 4.721 1.103 367 H ASN 44 HN ASN 44 24.880 6.025 4.494 368 HA ASN 44 HA ASN 44 23.344 4.958 6.634 369 HB2 ASN 44 HB2 ASN 44 24.035 7.833 5.977 370 HB3 ASN 44 HB1 ASN 44 23.274 7.305 7.472 371 HD21 ASN 44 HD21 ASN 44 24.978 8.084 8.717 372 HD22 ASN 44 HD22 ASN 44 26.521 7.306 8.761 373 H LYS 45 HN LYS 45 22.545 7.091 3.904 374 HA LYS 45 HA LYS 45 19.934 7.691 4.661 375 HB2 LYS 45 HB2 LYS 45 21.261 8.818 2.865 376 HB3 LYS 45 HB1 LYS 45 21.013 7.406 1.849 377 HG2 LYS 45 HG2 LYS 45 19.474 9.167 1.235 378 HG3 LYS 45 HG1 LYS 45 18.588 7.800 1.911 379 HD2 LYS 45 HD2 LYS 45 18.211 8.931 3.949 380 HD3 LYS 45 HD1 LYS 45 19.407 10.173 3.568 381 HE2 LYS 45 HE2 LYS 45 17.124 11.010 3.302 382 HE3 LYS 45 HE1 LYS 45 17.996 11.007 1.774 383 HZ1 LYS 45 HZ1 LYS 45 16.851 8.995 1.143 384 HZ2 LYS 45 HZ2 LYS 45 15.726 10.188 1.543 385 HZ3 LYS 45 HZ3 LYS 45 16.048 8.936 2.630 386 H ARG 46 HN ARG 46 21.288 4.879 3.075 387 HA ARG 46 HA ARG 46 18.981 3.710 2.037 388 HB2 ARG 46 HB2 ARG 46 21.333 2.290 3.300 389 HB3 ARG 46 HB1 ARG 46 20.164 1.572 2.204 390 HG2 ARG 46 HG2 ARG 46 20.918 3.029 0.413 391 HG3 ARG 46 HG1 ARG 46 22.062 3.805 1.513 392 HD2 ARG 46 HD2 ARG 46 23.086 1.540 1.877 393 HD3 ARG 46 HD1 ARG 46 22.065 0.947 0.570 394 HE ARG 46 HE ARG 46 23.506 3.199 -0.317 395 HH11 ARG 46 HH11 ARG 46 23.967 -0.174 0.504 396 HH12 ARG 46 HH12 ARG 46 25.385 -0.354 -0.477 397 HH21 ARG 46 HH21 ARG 46 25.353 2.979 -1.614 398 HH22 ARG 46 HH22 ARG 46 26.174 1.451 -1.705 399 H GLN 47 HN GLN 47 20.332 3.551 5.308 400 HA GLN 47 HA GLN 47 18.454 1.727 6.360 401 HB2 GLN 47 HB2 GLN 47 20.336 3.714 7.565 402 HB3 GLN 47 HB1 GLN 47 19.112 2.970 8.583 403 HG2 GLN 47 HG2 GLN 47 21.235 1.797 8.730 404 HG3 GLN 47 HG1 GLN 47 19.979 0.764 8.052 405 HE21 GLN 47 HE21 GLN 47 22.921 2.467 7.454 406 HE22 GLN 47 HE22 GLN 47 23.266 1.762 5.914 407 H HIS 48 HN HIS 48 18.447 5.211 5.997 408 HA HIS 48 HA HIS 48 16.138 5.666 7.598 409 HB2 HIS 48 HB2 HIS 48 17.925 7.388 6.845 410 HB3 HIS 48 HB1 HIS 48 17.016 7.471 5.340 411 HD1 HIS 48 HD1 HIS 48 17.034 8.672 8.818 412 HD2 HIS 48 HD2 HIS 48 14.351 8.540 5.647 413 HE1 HIS 48 HE1 HIS 48 15.199 10.289 9.410 414 HE2 HIS 48 HE2 HIS 48 13.573 10.173 7.487 415 H ILE 49 HN ILE 49 16.691 5.086 4.155 416 HA ILE 49 HA ILE 49 13.989 5.483 3.355 417 HB ILE 49 HB ILE 49 16.175 3.879 2.009 418 HG12 ILE 49 HG12 ILE 49 15.195 6.703 1.535 419 HG13 ILE 49 HG11 ILE 49 16.727 6.258 2.279 420 HG21 ILE 49 HG21 ILE 49 13.554 4.878 0.897 421 HG22 ILE 49 HG22 ILE 49 13.949 3.199 1.264 422 HG23 ILE 49 HG23 ILE 49 14.820 4.051 -0.010 423 HD11 ILE 49 HD11 ILE 49 17.432 5.217 0.183 424 HD12 ILE 49 HD12 ILE 49 17.037 6.923 -0.027 425 HD13 ILE 49 HD13 ILE 49 15.899 5.683 -0.555 426 H TYR 50 HN TYR 50 15.909 2.586 4.124 427 HA TYR 50 HA TYR 50 13.996 0.640 3.822 428 HB2 TYR 50 HB2 TYR 50 16.358 0.203 4.380 429 HB3 TYR 50 HB1 TYR 50 16.088 0.814 6.008 430 HD1 TYR 50 HD1 TYR 50 15.836 -0.777 7.660 431 HD2 TYR 50 HD2 TYR 50 14.598 -1.747 3.707 432 HE1 TYR 50 HE1 TYR 50 15.213 -3.035 8.413 433 HE2 TYR 50 HE2 TYR 50 13.977 -4.004 4.451 434 HH TYR 50 HH TYR 50 13.816 -4.863 7.778 435 H GLN 51 HN GLN 51 14.463 2.810 6.579 436 HA GLN 51 HA GLN 51 12.489 1.669 8.256 437 HB2 GLN 51 HB2 GLN 51 14.240 3.284 9.024 438 HB3 GLN 51 HB1 GLN 51 13.396 4.558 8.153 439 HG2 GLN 51 HG2 GLN 51 12.839 4.669 10.490 440 HG3 GLN 51 HG1 GLN 51 11.418 4.194 9.561 441 HE21 GLN 51 HE21 GLN 51 10.425 3.263 11.330 442 HE22 GLN 51 HE22 GLN 51 10.960 1.764 12.015 443 H ARG 52 HN ARG 52 12.377 4.297 5.882 444 HA ARG 52 HA ARG 52 9.674 4.984 6.311 445 HB2 ARG 52 HB2 ARG 52 11.432 5.383 3.888 446 HB3 ARG 52 HB1 ARG 52 9.844 6.108 4.089 447 HG2 ARG 52 HG2 ARG 52 12.273 6.604 5.797 448 HG3 ARG 52 HG1 ARG 52 11.562 7.713 4.625 449 HD2 ARG 52 HD2 ARG 52 10.330 6.735 7.198 450 HD3 ARG 52 HD1 ARG 52 10.880 8.370 6.838 451 HE ARG 52 HE ARG 52 9.024 7.997 4.941 452 HH11 ARG 52 HH11 ARG 52 8.963 7.443 8.397 453 HH12 ARG 52 HH12 ARG 52 7.251 7.688 8.533 454 HH21 ARG 52 HH21 ARG 52 6.777 8.305 5.103 455 HH22 ARG 52 HH22 ARG 52 6.002 8.178 6.651 456 H CYS 53 HN CYS 53 11.236 2.600 4.312 457 HA CYS 53 HA CYS 53 8.977 1.969 2.701 458 HB2 CYS 53 HB2 CYS 53 11.359 1.365 2.137 459 HB3 CYS 53 HB1 CYS 53 11.284 0.131 3.398 460 HG CYS 53 HG CYS 53 9.024 -1.123 2.081 461 H ILE 54 HN ILE 54 10.324 0.618 5.680 462 HA ILE 54 HA ILE 54 8.457 -1.391 6.150 463 HB ILE 54 HB ILE 54 9.958 0.335 8.115 464 HG12 ILE 54 HG12 ILE 54 10.405 -2.501 7.143 465 HG13 ILE 54 HG11 ILE 54 11.362 -1.092 6.685 466 HG21 ILE 54 HG21 ILE 54 9.413 -1.332 9.818 467 HG22 ILE 54 HG22 ILE 54 8.384 -2.177 8.661 468 HG23 ILE 54 HG23 ILE 54 7.962 -0.549 9.192 469 HD11 ILE 54 HD11 ILE 54 12.497 -2.446 8.352 470 HD12 ILE 54 HD12 ILE 54 11.138 -2.244 9.456 471 HD13 ILE 54 HD13 ILE 54 12.110 -0.850 8.992 472 H GLN 55 HN GLN 55 8.328 2.054 6.915 473 HA GLN 55 HA GLN 55 5.988 2.037 8.454 474 HB2 GLN 55 HB2 GLN 55 7.479 3.969 8.340 475 HB3 GLN 55 HB1 GLN 55 7.090 4.195 6.641 476 HG2 GLN 55 HG2 GLN 55 5.907 5.803 7.989 477 HG3 GLN 55 HG1 GLN 55 4.767 4.682 7.243 478 HE21 GLN 55 HE21 GLN 55 3.184 5.062 8.761 479 HE22 GLN 55 HE22 GLN 55 3.292 4.483 10.384 480 H LEU 56 HN LEU 56 6.372 2.743 4.980 481 HA LEU 56 HA LEU 56 3.689 2.905 4.334 482 HB2 LEU 56 HB2 LEU 56 5.838 1.765 2.545 483 HB3 LEU 56 HB1 LEU 56 4.335 2.503 2.034 484 HG LEU 56 HG LEU 56 6.656 3.910 3.359 485 HD11 LEU 56 HD11 LEU 56 7.098 3.320 1.056 486 HD12 LEU 56 HD12 LEU 56 6.844 5.061 1.203 487 HD13 LEU 56 HD13 LEU 56 5.565 4.034 0.556 488 HD21 LEU 56 HD21 LEU 56 4.009 4.997 2.410 489 HD22 LEU 56 HD22 LEU 56 5.389 5.972 2.912 490 HD23 LEU 56 HD23 LEU 56 4.581 4.925 4.077 491 H LYS 57 HN LYS 57 5.752 0.048 4.524 492 HA LYS 57 HA LYS 57 3.964 -1.784 3.372 493 HB2 LYS 57 HB2 LYS 57 6.345 -2.275 3.739 494 HB3 LYS 57 HB1 LYS 57 6.085 -2.261 5.477 495 HG2 LYS 57 HG2 LYS 57 4.624 -4.202 5.291 496 HG3 LYS 57 HG1 LYS 57 4.837 -4.203 3.540 497 HD2 LYS 57 HD2 LYS 57 6.276 -5.872 4.541 498 HD3 LYS 57 HD1 LYS 57 7.255 -4.573 3.861 499 HE2 LYS 57 HE2 LYS 57 7.553 -3.608 6.070 500 HE3 LYS 57 HE1 LYS 57 6.505 -4.841 6.771 501 HZ1 LYS 57 HZ1 LYS 57 8.093 -6.527 6.153 502 HZ2 LYS 57 HZ2 LYS 57 8.872 -5.339 7.066 503 HZ3 LYS 57 HZ3 LYS 57 9.080 -5.387 5.390 504 H GLN 58 HN GLN 58 4.495 -0.869 6.745 505 HA GLN 58 HA GLN 58 2.538 -2.549 7.870 506 HB2 GLN 58 HB2 GLN 58 3.647 0.080 8.862 507 HB3 GLN 58 HB1 GLN 58 2.636 -0.994 9.818 508 HG2 GLN 58 HG2 GLN 58 4.304 -2.711 9.771 509 HG3 GLN 58 HG1 GLN 58 5.289 -1.782 8.640 510 HE21 GLN 58 HE21 GLN 58 5.971 -2.807 11.274 511 HE22 GLN 58 HE22 GLN 58 6.419 -1.435 12.228 512 H ALA 59 HN ALA 59 2.353 0.694 6.516 513 HA ALA 59 HA ALA 59 -0.268 1.287 7.373 514 HB1 ALA 59 HB1 ALA 59 1.286 3.005 6.630 515 HB2 ALA 59 HB2 ALA 59 -0.200 3.053 5.681 516 HB3 ALA 59 HB3 ALA 59 1.260 2.340 4.997 517 H ILE 60 HN ILE 60 1.009 -0.241 4.447 518 HA ILE 60 HA ILE 60 -1.469 -0.413 3.084 519 HB ILE 60 HB ILE 60 0.995 -2.147 2.798 520 HG12 ILE 60 HG12 ILE 60 0.064 0.241 1.183 521 HG13 ILE 60 HG11 ILE 60 1.359 0.272 2.378 522 HG21 ILE 60 HG21 ILE 60 -0.979 -3.255 1.902 523 HG22 ILE 60 HG22 ILE 60 0.087 -2.735 0.596 524 HG23 ILE 60 HG23 ILE 60 -1.373 -1.818 0.960 525 HD11 ILE 60 HD11 ILE 60 2.621 -1.334 1.016 526 HD12 ILE 60 HD12 ILE 60 2.269 0.160 0.148 527 HD13 ILE 60 HD13 ILE 60 1.334 -1.297 -0.188 528 H ASP 61 HN ASP 61 0.293 -2.654 5.180 529 HA ASP 61 HA ASP 61 -1.483 -4.828 5.039 530 HB2 ASP 61 HB2 ASP 61 0.791 -4.966 6.033 531 HB3 ASP 61 HB1 ASP 61 0.248 -3.973 7.383 532 H GLU 62 HN GLU 62 -1.447 -1.950 7.022 533 HA GLU 62 HA GLU 62 -3.528 -2.562 8.785 534 HB2 GLU 62 HB2 GLU 62 -2.095 -0.662 9.164 535 HB3 GLU 62 HB1 GLU 62 -2.601 0.081 7.654 536 HG2 GLU 62 HG2 GLU 62 -4.848 0.379 8.547 537 HG3 GLU 62 HG1 GLU 62 -4.349 -0.381 10.056 538 H ASN 63 HN ASN 63 -3.618 -0.917 5.634 539 HA ASN 63 HA ASN 63 -6.419 -0.545 5.568 540 HB2 ASN 63 HB2 ASN 63 -4.283 -0.561 3.452 541 HB3 ASN 63 HB1 ASN 63 -5.982 -0.432 3.012 542 HD21 ASN 63 HD21 ASN 63 -5.566 1.641 2.151 543 HD22 ASN 63 HD22 ASN 63 -5.375 3.014 3.193 544 H LYS 64 HN LYS 64 -4.314 -3.089 4.309 545 HA LYS 64 HA LYS 64 -6.272 -4.614 3.012 546 HB2 LYS 64 HB2 LYS 64 -3.888 -5.020 2.699 547 HB3 LYS 64 HB1 LYS 64 -3.726 -5.507 4.380 548 HG2 LYS 64 HG2 LYS 64 -5.289 -7.392 3.910 549 HG3 LYS 64 HG1 LYS 64 -5.228 -6.939 2.205 550 HD2 LYS 64 HD2 LYS 64 -2.830 -7.304 2.171 551 HD3 LYS 64 HD1 LYS 64 -2.845 -7.689 3.889 552 HE2 LYS 64 HE2 LYS 64 -4.326 -9.605 3.418 553 HE3 LYS 64 HE1 LYS 64 -4.224 -9.236 1.696 554 HZ1 LYS 64 HZ1 LYS 64 -1.819 -9.591 1.830 555 HZ2 LYS 64 HZ2 LYS 64 -2.684 -10.973 2.273 556 HZ3 LYS 64 HZ3 LYS 64 -1.967 -10.009 3.463 557 H ASN 65 HN ASN 65 -5.087 -4.731 6.356 558 HA ASN 65 HA ASN 65 -6.654 -6.963 7.120 559 HB2 ASN 65 HB2 ASN 65 -5.160 -4.853 8.633 560 HB3 ASN 65 HB1 ASN 65 -6.230 -5.951 9.493 561 HD21 ASN 65 HD21 ASN 65 -4.376 -6.812 6.645 562 HD22 ASN 65 HD22 ASN 65 -3.303 -7.905 7.442 563 H ALA 66 HN ALA 66 -7.221 -3.495 7.201 564 HA ALA 66 HA ALA 66 -9.623 -3.536 8.667 565 HB1 ALA 66 HB1 ALA 66 -8.742 -1.603 6.524 566 HB2 ALA 66 HB2 ALA 66 -8.371 -1.483 8.242 567 HB3 ALA 66 HB3 ALA 66 -10.038 -1.331 7.688 568 H LEU 67 HN LEU 67 -9.003 -3.620 5.173 569 HA LEU 67 HA LEU 67 -11.690 -3.774 4.362 570 HB2 LEU 67 HB2 LEU 67 -9.886 -3.172 2.844 571 HB3 LEU 67 HB1 LEU 67 -9.177 -4.763 3.009 572 HG LEU 67 HG LEU 67 -11.115 -5.753 1.882 573 HD11 LEU 67 HD11 LEU 67 -12.853 -4.216 2.520 574 HD12 LEU 67 HD12 LEU 67 -12.745 -4.270 0.761 575 HD13 LEU 67 HD13 LEU 67 -12.064 -2.904 1.646 576 HD21 LEU 67 HD21 LEU 67 -9.851 -3.465 0.383 577 HD22 LEU 67 HD22 LEU 67 -10.682 -4.837 -0.349 578 HD23 LEU 67 HD23 LEU 67 -9.191 -5.091 0.558 579 H GLN 68 HN GLN 68 -9.282 -6.289 5.010 580 HA GLN 68 HA GLN 68 -10.860 -8.502 4.332 581 HB2 GLN 68 HB2 GLN 68 -8.392 -8.510 4.662 582 HB3 GLN 68 HB1 GLN 68 -8.651 -8.343 6.392 583 HG2 GLN 68 HG2 GLN 68 -9.762 -10.497 6.454 584 HG3 GLN 68 HG1 GLN 68 -9.571 -10.660 4.709 585 HE21 GLN 68 HE21 GLN 68 -8.357 -12.527 4.879 586 HE22 GLN 68 HE22 GLN 68 -6.728 -12.529 5.460 587 H LYS 69 HN LYS 69 -10.777 -6.518 7.194 588 HA LYS 69 HA LYS 69 -12.127 -8.407 8.884 589 HB2 LYS 69 HB2 LYS 69 -10.601 -6.610 9.732 590 HB3 LYS 69 HB1 LYS 69 -11.801 -5.421 9.252 591 HG2 LYS 69 HG2 LYS 69 -13.378 -6.299 10.846 592 HG3 LYS 69 HG1 LYS 69 -12.275 -7.609 11.265 593 HD2 LYS 69 HD2 LYS 69 -12.161 -5.885 12.952 594 HD3 LYS 69 HD1 LYS 69 -10.642 -5.946 12.060 595 HE2 LYS 69 HE2 LYS 69 -11.258 -3.651 12.384 596 HE3 LYS 69 HE1 LYS 69 -11.431 -4.048 10.677 597 HZ1 LYS 69 HZ1 LYS 69 -13.821 -4.330 11.053 598 HZ2 LYS 69 HZ2 LYS 69 -13.307 -2.767 11.435 599 HZ3 LYS 69 HZ3 LYS 69 -13.624 -3.876 12.668 600 H LEU 70 HN LEU 70 -13.083 -6.095 6.535 601 HA LEU 70 HA LEU 70 -15.767 -5.744 7.486 602 HB2 LEU 70 HB2 LEU 70 -14.534 -5.179 4.787 603 HB3 LEU 70 HB1 LEU 70 -16.155 -4.711 5.261 604 HG LEU 70 HG LEU 70 -13.615 -3.721 6.559 605 HD11 LEU 70 HD11 LEU 70 -15.521 -2.354 4.662 606 HD12 LEU 70 HD12 LEU 70 -13.872 -2.863 4.296 607 HD13 LEU 70 HD13 LEU 70 -14.159 -1.592 5.485 608 HD21 LEU 70 HD21 LEU 70 -15.471 -3.790 8.122 609 HD22 LEU 70 HD22 LEU 70 -16.499 -2.939 6.969 610 HD23 LEU 70 HD23 LEU 70 -15.105 -2.123 7.676 611 H SER 71 HN SER 71 -16.131 -8.063 7.790 612 HA SER 71 HA SER 71 -16.564 -9.604 5.350 613 HB2 SER 71 HB2 SER 71 -16.770 -10.440 8.257 614 HB3 SER 71 HB1 SER 71 -16.853 -11.520 6.864 615 HG SER 71 HG SER 71 -14.671 -10.379 6.410 616 H LYS 72 HN LYS 72 -18.291 -7.454 5.635 617 HA LYS 72 HA LYS 72 -20.766 -8.374 6.775 618 HB2 LYS 72 HB2 LYS 72 -21.721 -6.293 5.779 619 HB3 LYS 72 HB1 LYS 72 -20.351 -6.000 6.840 620 HG2 LYS 72 HG2 LYS 72 -18.901 -5.594 4.965 621 HG3 LYS 72 HG1 LYS 72 -20.154 -6.104 3.826 622 HD2 LYS 72 HD2 LYS 72 -21.577 -4.220 4.795 623 HD3 LYS 72 HD1 LYS 72 -20.093 -3.632 5.549 624 HE2 LYS 72 HE2 LYS 72 -19.044 -3.408 3.385 625 HE3 LYS 72 HE1 LYS 72 -20.449 -4.120 2.596 626 HZ1 LYS 72 HZ1 LYS 72 -20.632 -1.806 2.332 627 HZ2 LYS 72 HZ2 LYS 72 -20.276 -1.498 3.956 628 HZ3 LYS 72 HZ3 LYS 72 -21.748 -2.211 3.537 629 H ALA 73 HN ALA 73 -21.205 -10.304 5.693 630 HA ALA 73 HA ALA 73 -21.240 -10.397 2.824 631 HB1 ALA 73 HB1 ALA 73 -20.589 -12.343 4.153 632 HB2 ALA 73 HB2 ALA 73 -21.960 -12.699 3.103 633 HB3 ALA 73 HB3 ALA 73 -22.216 -12.425 4.825 634 H ASP 74 HN ASP 74 -23.605 -9.849 5.345 635 HA ASP 74 HA ASP 74 -25.758 -10.139 3.373 636 HB2 ASP 74 HB2 ASP 74 -26.008 -11.349 5.536 637 HB3 ASP 74 HB1 ASP 74 -26.015 -9.796 6.366 638 H GLU 75 HN GLU 75 -24.092 -7.775 5.296 639 HA GLU 75 HA GLU 75 -26.030 -5.712 4.604 640 HB2 GLU 75 HB2 GLU 75 -23.515 -5.672 6.261 641 HB3 GLU 75 HB1 GLU 75 -24.379 -4.207 5.832 642 HG2 GLU 75 HG2 GLU 75 -26.406 -5.194 6.915 643 HG3 GLU 75 HG1 GLU 75 -25.375 -6.503 7.493 644 H SER 76 HN SER 76 -24.926 -6.889 2.415 645 HA SER 76 HA SER 76 -23.741 -4.663 1.066 646 HB2 SER 76 HB2 SER 76 -21.754 -5.739 2.162 647 HB3 SER 76 HB1 SER 76 -22.120 -7.221 1.284 648 HG SER 76 HG SER 76 -21.320 -4.711 0.245 649 H ALA 77 HN ALA 77 -23.553 -5.153 -1.290 650 HA ALA 77 HA ALA 77 -25.350 -7.355 -2.057 651 HB1 ALA 77 HB1 ALA 77 -26.344 -5.162 -2.454 652 HB2 ALA 77 HB2 ALA 77 -26.028 -6.002 -3.972 653 HB3 ALA 77 HB3 ALA 77 -24.956 -4.706 -3.441 654 HA PRO 78 HA PRO 78 -21.326 -8.414 -3.995 655 HB2 PRO 78 HB2 PRO 78 -22.231 -11.167 -3.646 656 HB3 PRO 78 HB1 PRO 78 -20.804 -10.379 -2.973 657 HG2 PRO 78 HG2 PRO 78 -22.911 -11.136 -1.449 658 HG3 PRO 78 HG1 PRO 78 -21.904 -9.728 -1.063 659 HD2 PRO 78 HD2 PRO 78 -24.595 -9.822 -2.385 660 HD3 PRO 78 HD1 PRO 78 -23.992 -8.709 -1.140 661 H VAL 79 HN VAL 79 -23.101 -7.468 -5.689 662 HA VAL 79 HA VAL 79 -24.307 -9.518 -7.315 663 HB VAL 79 HB VAL 79 -24.050 -6.587 -7.965 664 HG11 VAL 79 HG11 VAL 79 -26.006 -6.978 -9.377 665 HG12 VAL 79 HG12 VAL 79 -25.977 -8.687 -8.945 666 HG13 VAL 79 HG13 VAL 79 -24.646 -7.986 -9.867 667 HG21 VAL 79 HG21 VAL 79 -26.230 -8.019 -6.463 668 HG22 VAL 79 HG22 VAL 79 -26.312 -6.353 -7.033 669 HG23 VAL 79 HG23 VAL 79 -25.122 -6.809 -5.813 670 H ALA 80 HN ALA 80 -22.099 -6.868 -8.281 671 HA ALA 80 HA ALA 80 -20.369 -8.729 -9.644 672 HB1 ALA 80 HB1 ALA 80 -21.973 -6.746 -11.247 673 HB2 ALA 80 HB2 ALA 80 -22.174 -8.496 -11.261 674 HB3 ALA 80 HB3 ALA 80 -20.683 -7.776 -11.867 675 H ASN 81 HN ASN 81 -21.211 -5.263 -9.858 676 HA ASN 81 HA ASN 81 -18.611 -4.359 -10.329 677 HB2 ASN 81 HB2 ASN 81 -20.928 -2.898 -9.040 678 HB3 ASN 81 HB1 ASN 81 -19.441 -2.121 -9.561 679 HD21 ASN 81 HD21 ASN 81 -20.498 -0.801 -11.014 680 HD22 ASN 81 HD22 ASN 81 -21.155 -1.399 -12.499 681 H TYR 82 HN TYR 82 -20.363 -4.760 -7.297 682 HA TYR 82 HA TYR 82 -18.395 -3.592 -5.633 683 HB2 TYR 82 HB2 TYR 82 -20.845 -4.072 -5.059 684 HB3 TYR 82 HB1 TYR 82 -20.357 -5.742 -4.789 685 HD1 TYR 82 HD1 TYR 82 -18.800 -6.283 -2.927 686 HD2 TYR 82 HD2 TYR 82 -20.387 -2.359 -3.426 687 HE1 TYR 82 HE1 TYR 82 -18.169 -5.736 -0.616 688 HE2 TYR 82 HE2 TYR 82 -19.751 -1.810 -1.117 689 HH TYR 82 HH TYR 82 -19.248 -2.866 0.958 690 H ASN 83 HN ASN 83 -18.935 -6.878 -6.796 691 HA ASN 83 HA ASN 83 -16.995 -8.123 -5.131 692 HB2 ASN 83 HB2 ASN 83 -18.079 -9.031 -7.809 693 HB3 ASN 83 HB1 ASN 83 -17.149 -10.027 -6.697 694 HD21 ASN 83 HD21 ASN 83 -19.756 -10.553 -7.719 695 HD22 ASN 83 HD22 ASN 83 -20.830 -10.622 -6.365 696 H GLN 84 HN GLN 84 -16.961 -6.760 -8.363 697 HA GLN 84 HA GLN 84 -14.436 -7.649 -9.171 698 HB2 GLN 84 HB2 GLN 84 -16.184 -6.661 -10.656 699 HB3 GLN 84 HB1 GLN 84 -15.822 -5.084 -9.967 700 HG2 GLN 84 HG2 GLN 84 -13.496 -5.318 -10.783 701 HG3 GLN 84 HG1 GLN 84 -13.964 -6.824 -11.569 702 HE21 GLN 84 HE21 GLN 84 -16.030 -4.012 -11.343 703 HE22 GLN 84 HE22 GLN 84 -16.008 -3.622 -13.025 704 H ARG 85 HN ARG 85 -15.413 -4.571 -7.665 705 HA ARG 85 HA ARG 85 -12.788 -3.496 -7.719 706 HB2 ARG 85 HB2 ARG 85 -15.327 -2.690 -6.368 707 HB3 ARG 85 HB1 ARG 85 -13.814 -1.930 -5.896 708 HG2 ARG 85 HG2 ARG 85 -13.590 -1.619 -8.522 709 HG3 ARG 85 HG1 ARG 85 -15.352 -1.691 -8.412 710 HD2 ARG 85 HD2 ARG 85 -14.382 0.616 -8.229 711 HD3 ARG 85 HD1 ARG 85 -15.405 0.133 -6.874 712 HE ARG 85 HE ARG 85 -12.482 -0.159 -6.699 713 HH11 ARG 85 HH11 ARG 85 -15.433 1.368 -5.587 714 HH12 ARG 85 HH12 ARG 85 -14.740 1.896 -4.092 715 HH21 ARG 85 HH21 ARG 85 -11.565 0.504 -4.735 716 HH22 ARG 85 HH22 ARG 85 -12.536 1.407 -3.597 717 H LYS 86 HN LYS 86 -14.579 -5.340 -5.312 718 HA LYS 86 HA LYS 86 -12.880 -4.870 -3.138 719 HB2 LYS 86 HB2 LYS 86 -15.011 -5.917 -2.782 720 HB3 LYS 86 HB1 LYS 86 -14.586 -7.266 -3.833 721 HG2 LYS 86 HG2 LYS 86 -12.865 -7.977 -2.220 722 HG3 LYS 86 HG1 LYS 86 -13.305 -6.627 -1.167 723 HD2 LYS 86 HD2 LYS 86 -15.137 -8.898 -1.970 724 HD3 LYS 86 HD1 LYS 86 -14.302 -8.745 -0.425 725 HE2 LYS 86 HE2 LYS 86 -15.511 -6.643 0.007 726 HE3 LYS 86 HE1 LYS 86 -16.378 -6.840 -1.517 727 HZ1 LYS 86 HZ1 LYS 86 -17.685 -7.608 0.363 728 HZ2 LYS 86 HZ2 LYS 86 -16.479 -8.717 0.782 729 HZ3 LYS 86 HZ3 LYS 86 -17.319 -8.893 -0.673 730 H GLU 87 HN GLU 87 -12.710 -7.219 -5.756 731 HA GLU 87 HA GLU 87 -10.396 -8.564 -4.786 732 HB2 GLU 87 HB2 GLU 87 -12.028 -9.526 -6.406 733 HB3 GLU 87 HB1 GLU 87 -11.452 -8.389 -7.613 734 HG2 GLU 87 HG2 GLU 87 -10.451 -10.530 -7.989 735 HG3 GLU 87 HG1 GLU 87 -9.212 -9.397 -7.451 736 H GLU 88 HN GLU 88 -10.970 -5.859 -6.972 737 HA GLU 88 HA GLU 88 -8.366 -5.687 -8.028 738 HB2 GLU 88 HB2 GLU 88 -10.516 -3.589 -7.768 739 HB3 GLU 88 HB1 GLU 88 -9.017 -3.346 -8.652 740 HG2 GLU 88 HG2 GLU 88 -11.189 -5.334 -9.269 741 HG3 GLU 88 HG1 GLU 88 -10.762 -3.896 -10.191 742 H GLU 89 HN GLU 89 -9.855 -4.188 -5.183 743 HA GLU 89 HA GLU 89 -7.731 -2.470 -4.522 744 HB2 GLU 89 HB2 GLU 89 -9.592 -3.911 -2.616 745 HB3 GLU 89 HB1 GLU 89 -8.590 -2.524 -2.220 746 HG2 GLU 89 HG2 GLU 89 -10.895 -2.568 -4.153 747 HG3 GLU 89 HG1 GLU 89 -10.882 -1.846 -2.546 748 H HIS 90 HN HIS 90 -8.357 -5.849 -3.693 749 HA HIS 90 HA HIS 90 -6.046 -6.251 -2.122 750 HB2 HIS 90 HB2 HIS 90 -7.823 -8.128 -3.661 751 HB3 HIS 90 HB1 HIS 90 -6.357 -8.714 -2.891 752 HD1 HIS 90 HD1 HIS 90 -6.486 -9.250 -0.457 753 HD2 HIS 90 HD2 HIS 90 -9.755 -7.054 -1.774 754 HE1 HIS 90 HE1 HIS 90 -8.116 -9.258 1.452 755 HE2 HIS 90 HE2 HIS 90 -10.134 -8.019 0.594 756 H THR 91 HN THR 91 -6.636 -6.453 -5.585 757 HA THR 91 HA THR 91 -4.171 -7.636 -6.294 758 HB THR 91 HB THR 91 -5.880 -5.803 -7.988 759 HG1 THR 91 HG1 THR 91 -6.555 -8.093 -6.881 760 HG21 THR 91 HG21 THR 91 -3.706 -6.263 -8.974 761 HG22 THR 91 HG22 THR 91 -4.968 -7.119 -9.858 762 HG23 THR 91 HG23 THR 91 -3.938 -7.994 -8.726 763 H LEU 92 HN LEU 92 -5.200 -4.280 -5.893 764 HA LEU 92 HA LEU 92 -2.807 -3.115 -6.910 765 HB2 LEU 92 HB2 LEU 92 -4.862 -1.844 -6.867 766 HB3 LEU 92 HB1 LEU 92 -4.989 -2.021 -5.129 767 HG LEU 92 HG LEU 92 -2.901 -0.662 -4.900 768 HD11 LEU 92 HD11 LEU 92 -1.939 -1.047 -7.088 769 HD12 LEU 92 HD12 LEU 92 -2.190 0.680 -6.827 770 HD13 LEU 92 HD13 LEU 92 -3.300 -0.228 -7.854 771 HD21 LEU 92 HD21 LEU 92 -5.127 0.316 -4.630 772 HD22 LEU 92 HD22 LEU 92 -5.177 0.668 -6.357 773 HD23 LEU 92 HD23 LEU 92 -3.988 1.468 -5.329 774 H LEU 93 HN LEU 93 -4.045 -3.668 -3.616 775 HA LEU 93 HA LEU 93 -1.805 -2.530 -2.322 776 HB2 LEU 93 HB2 LEU 93 -3.824 -4.510 -1.261 777 HB3 LEU 93 HB1 LEU 93 -2.686 -3.606 -0.284 778 HG LEU 93 HG LEU 93 -4.932 -2.426 -1.920 779 HD11 LEU 93 HD11 LEU 93 -5.898 -1.867 0.257 780 HD12 LEU 93 HD12 LEU 93 -4.583 -2.722 1.059 781 HD13 LEU 93 HD13 LEU 93 -5.724 -3.609 0.050 782 HD21 LEU 93 HD21 LEU 93 -2.945 -1.100 -0.080 783 HD22 LEU 93 HD22 LEU 93 -4.340 -0.317 -0.821 784 HD23 LEU 93 HD23 LEU 93 -3.026 -0.918 -1.831 785 H ASP 94 HN ASP 94 -2.525 -5.778 -3.428 786 HA ASP 94 HA ASP 94 -0.537 -7.119 -1.937 787 HB2 ASP 94 HB2 ASP 94 -2.346 -8.354 -3.019 788 HB3 ASP 94 HB1 ASP 94 -1.759 -7.860 -4.606 789 H LYS 95 HN LYS 95 -0.460 -5.753 -5.243 790 HA LYS 95 HA LYS 95 2.172 -6.505 -5.818 791 HB2 LYS 95 HB2 LYS 95 0.593 -5.677 -7.519 792 HB3 LYS 95 HB1 LYS 95 0.631 -4.081 -6.780 793 HG2 LYS 95 HG2 LYS 95 3.058 -3.957 -7.286 794 HG3 LYS 95 HG1 LYS 95 2.921 -5.496 -8.139 795 HD2 LYS 95 HD2 LYS 95 1.257 -4.483 -9.649 796 HD3 LYS 95 HD1 LYS 95 1.468 -2.939 -8.822 797 HE2 LYS 95 HE2 LYS 95 2.772 -2.986 -10.870 798 HE3 LYS 95 HE1 LYS 95 3.837 -2.930 -9.466 799 HZ1 LYS 95 HZ1 LYS 95 4.635 -4.515 -11.084 800 HZ2 LYS 95 HZ2 LYS 95 3.167 -5.348 -11.051 801 HZ3 LYS 95 HZ3 LYS 95 4.159 -5.328 -9.682 802 H LEU 96 HN LEU 96 0.857 -3.538 -4.408 803 HA LEU 96 HA LEU 96 3.244 -2.133 -4.137 804 HB2 LEU 96 HB2 LEU 96 0.875 -2.078 -2.266 805 HB3 LEU 96 HB1 LEU 96 2.121 -0.851 -2.383 806 HG LEU 96 HG LEU 96 0.162 -1.554 -4.568 807 HD11 LEU 96 HD11 LEU 96 -0.857 0.590 -4.075 808 HD12 LEU 96 HD12 LEU 96 0.294 0.859 -2.768 809 HD13 LEU 96 HD13 LEU 96 -0.887 -0.446 -2.650 810 HD21 LEU 96 HD21 LEU 96 2.311 -0.767 -5.431 811 HD22 LEU 96 HD22 LEU 96 2.206 0.655 -4.393 812 HD23 LEU 96 HD23 LEU 96 1.035 0.422 -5.689 813 H THR 97 HN THR 97 1.656 -4.296 -1.806 814 HA THR 97 HA THR 97 3.551 -4.195 0.220 815 HB THR 97 HB THR 97 1.954 -6.637 -0.582 816 HG1 THR 97 HG1 THR 97 0.607 -4.781 -0.301 817 HG21 THR 97 HG21 THR 97 3.036 -5.763 2.100 818 HG22 THR 97 HG22 THR 97 3.704 -7.052 1.095 819 HG23 THR 97 HG23 THR 97 2.087 -7.216 1.784 820 H GLN 98 HN GLN 98 3.398 -6.348 -2.606 821 HA GLN 98 HA GLN 98 5.629 -7.921 -1.850 822 HB2 GLN 98 HB2 GLN 98 3.876 -8.702 -3.400 823 HB3 GLN 98 HB1 GLN 98 4.405 -7.519 -4.585 824 HG2 GLN 98 HG2 GLN 98 5.249 -9.718 -5.126 825 HG3 GLN 98 HG1 GLN 98 6.568 -8.619 -4.736 826 HE21 GLN 98 HE21 GLN 98 4.487 -10.099 -2.342 827 HE22 GLN 98 HE22 GLN 98 5.702 -11.112 -1.644 828 H GLN 99 HN GLN 99 5.237 -5.130 -3.973 829 HA GLN 99 HA GLN 99 7.846 -5.093 -5.016 830 HB2 GLN 99 HB2 GLN 99 5.961 -3.831 -5.984 831 HB3 GLN 99 HB1 GLN 99 5.954 -2.777 -4.576 832 HG2 GLN 99 HG2 GLN 99 8.180 -1.986 -5.131 833 HG3 GLN 99 HG1 GLN 99 8.238 -3.078 -6.514 834 HE21 GLN 99 HE21 GLN 99 5.368 -1.335 -5.557 835 HE22 GLN 99 HE22 GLN 99 5.318 -0.281 -6.925 836 H LEU 100 HN LEU 100 6.411 -3.390 -2.248 837 HA LEU 100 HA LEU 100 8.737 -1.963 -1.546 838 HB2 LEU 100 HB2 LEU 100 6.350 -2.787 0.101 839 HB3 LEU 100 HB1 LEU 100 7.625 -1.744 0.700 840 HG LEU 100 HG LEU 100 5.750 -1.139 -1.586 841 HD11 LEU 100 HD11 LEU 100 4.711 -0.983 0.606 842 HD12 LEU 100 HD12 LEU 100 4.930 0.618 -0.097 843 HD13 LEU 100 HD13 LEU 100 6.021 0.054 1.167 844 HD21 LEU 100 HD21 LEU 100 6.813 1.104 -1.536 845 HD22 LEU 100 HD22 LEU 100 7.897 -0.176 -2.078 846 HD23 LEU 100 HD23 LEU 100 8.035 0.460 -0.439 847 H GLN 101 HN GLN 101 7.431 -5.055 -0.414 848 HA GLN 101 HA GLN 101 9.374 -5.541 1.550 849 HB2 GLN 101 HB2 GLN 101 7.245 -6.791 1.360 850 HB3 GLN 101 HB1 GLN 101 7.837 -7.556 -0.106 851 HG2 GLN 101 HG2 GLN 101 8.012 -9.027 1.832 852 HG3 GLN 101 HG1 GLN 101 9.591 -8.665 1.140 853 HE21 GLN 101 HE21 GLN 101 10.613 -9.208 3.075 854 HE22 GLN 101 HE22 GLN 101 10.583 -8.158 4.453 855 H GLY 102 HN GLY 102 9.285 -6.311 -1.902 856 HA2 GLY 102 HA2 GLY 102 11.729 -7.755 -1.962 857 HA3 GLY 102 HA1 GLY 102 10.939 -7.010 -3.344 858 H LEU 103 HN LEU 103 10.925 -4.362 -2.544 859 HA LEU 103 HA LEU 103 13.545 -3.569 -3.275 860 HB2 LEU 103 HB2 LEU 103 11.542 -2.287 -3.876 861 HB3 LEU 103 HB1 LEU 103 11.247 -1.938 -2.183 862 HG LEU 103 HG LEU 103 13.320 -0.611 -2.089 863 HD11 LEU 103 HD11 LEU 103 14.507 -0.066 -4.165 864 HD12 LEU 103 HD12 LEU 103 13.508 -1.230 -5.036 865 HD13 LEU 103 HD13 LEU 103 14.615 -1.783 -3.778 866 HD21 LEU 103 HD21 LEU 103 11.208 0.482 -2.626 867 HD22 LEU 103 HD22 LEU 103 11.469 0.163 -4.341 868 HD23 LEU 103 HD23 LEU 103 12.551 1.250 -3.472 869 H ALA 104 HN ALA 104 11.765 -3.498 -0.215 870 HA ALA 104 HA ALA 104 13.575 -2.095 1.350 871 HB1 ALA 104 HB1 ALA 104 11.337 -2.666 2.104 872 HB2 ALA 104 HB2 ALA 104 12.537 -3.227 3.265 873 HB3 ALA 104 HB3 ALA 104 11.774 -4.374 2.164 874 H VAL 105 HN VAL 105 13.383 -5.588 0.752 875 HA VAL 105 HA VAL 105 15.632 -6.286 2.297 876 HB VAL 105 HB VAL 105 14.375 -7.725 -0.041 877 HG11 VAL 105 HG11 VAL 105 16.666 -8.478 0.293 878 HG12 VAL 105 HG12 VAL 105 15.514 -9.721 0.783 879 HG13 VAL 105 HG13 VAL 105 16.333 -8.748 2.004 880 HG21 VAL 105 HG21 VAL 105 12.864 -7.417 1.839 881 HG22 VAL 105 HG22 VAL 105 14.069 -8.101 2.931 882 HG23 VAL 105 HG23 VAL 105 13.334 -9.111 1.686 883 H THR 106 HN THR 106 15.260 -5.214 -1.014 884 HA THR 106 HA THR 106 17.890 -5.775 -1.883 885 HB THR 106 HB THR 106 16.013 -3.614 -2.865 886 HG1 THR 106 HG1 THR 106 14.992 -5.568 -3.157 887 HG21 THR 106 HG21 THR 106 18.385 -4.920 -4.198 888 HG22 THR 106 HG22 THR 106 18.303 -3.256 -3.620 889 HG23 THR 106 HG23 THR 106 17.282 -3.775 -4.961 890 H ILE 107 HN ILE 107 16.395 -2.939 -0.372 891 HA ILE 107 HA ILE 107 18.672 -1.253 -0.570 892 HB ILE 107 HB ILE 107 16.378 -1.087 1.392 893 HG12 ILE 107 HG12 ILE 107 16.731 0.333 -1.260 894 HG13 ILE 107 HG11 ILE 107 15.695 -1.070 -1.017 895 HG21 ILE 107 HG21 ILE 107 18.363 1.003 0.508 896 HG22 ILE 107 HG22 ILE 107 18.297 0.228 2.090 897 HG23 ILE 107 HG23 ILE 107 16.980 1.279 1.567 898 HD11 ILE 107 HD11 ILE 107 15.391 1.603 0.328 899 HD12 ILE 107 HD12 ILE 107 14.350 0.200 0.571 900 HD13 ILE 107 HD13 ILE 107 14.415 0.989 -1.006 901 H SER 108 HN SER 108 17.457 -3.433 1.923 902 HA SER 108 HA SER 108 19.530 -2.701 3.794 903 HB2 SER 108 HB2 SER 108 17.316 -3.387 4.615 904 HB3 SER 108 HB1 SER 108 17.523 -4.974 3.877 905 HG SER 108 HG SER 108 19.599 -4.837 5.294 906 H ARG 109 HN ARG 109 19.425 -4.516 1.056 907 HA ARG 109 HA ARG 109 20.861 -5.906 0.018 908 HB2 ARG 109 HB2 ARG 109 22.612 -5.236 2.383 909 HB3 ARG 109 HB1 ARG 109 23.150 -6.208 1.021 910 HG2 ARG 109 HG2 ARG 109 22.123 -3.393 0.790 911 HG3 ARG 109 HG1 ARG 109 23.827 -3.831 0.902 912 HD2 ARG 109 HD2 ARG 109 23.652 -5.122 -1.147 913 HD3 ARG 109 HD1 ARG 109 21.928 -4.768 -1.244 914 HE ARG 109 HE ARG 109 22.943 -2.315 -1.216 915 HH11 ARG 109 HH11 ARG 109 23.903 -5.133 -3.055 916 HH12 ARG 109 HH12 ARG 109 24.476 -4.210 -4.407 917 HH21 ARG 109 HH21 ARG 109 23.692 -1.101 -2.996 918 HH22 ARG 109 HH22 ARG 109 24.360 -1.924 -4.370 919 H GLU 110 HN GLU 110 22.569 -7.863 0.896 920 HA GLU 110 HA GLU 110 20.698 -9.866 1.711 921 HB2 GLU 110 HB2 GLU 110 22.675 -11.390 1.440 922 HB3 GLU 110 HB1 GLU 110 22.268 -10.454 0.009 923 HG2 GLU 110 HG2 GLU 110 24.059 -8.846 0.623 924 HG3 GLU 110 HG1 GLU 110 24.511 -9.923 1.944 925 H ASN 111 HN ASN 111 20.865 -8.078 3.732 926 HA ASN 111 HA ASN 111 22.656 -9.058 5.783 927 HB2 ASN 111 HB2 ASN 111 21.943 -6.633 5.608 928 HB3 ASN 111 HB1 ASN 111 20.332 -7.138 6.105 929 HD21 ASN 111 HD21 ASN 111 20.351 -5.968 8.001 930 HD22 ASN 111 HD22 ASN 111 21.360 -6.377 9.345 931 H ILE 112 HN ILE 112 21.742 -11.254 5.388 932 HA ILE 112 HA ILE 112 19.137 -11.973 6.147 933 HB ILE 112 HB ILE 112 21.657 -13.634 6.299 934 HG12 ILE 112 HG12 ILE 112 19.577 -13.479 4.110 935 HG13 ILE 112 HG11 ILE 112 21.140 -12.687 4.046 936 HG21 ILE 112 HG21 ILE 112 20.149 -15.564 6.174 937 HG22 ILE 112 HG22 ILE 112 18.766 -14.474 6.266 938 HG23 ILE 112 HG23 ILE 112 19.879 -14.603 7.627 939 HD11 ILE 112 HD11 ILE 112 20.675 -15.652 4.209 940 HD12 ILE 112 HD12 ILE 112 22.246 -14.855 4.128 941 HD13 ILE 112 HD13 ILE 112 21.131 -14.747 2.767 942 H THR 113 HN THR 113 22.123 -11.616 7.957 943 HA THR 113 HA THR 113 20.928 -12.306 10.477 944 HB THR 113 HB THR 113 23.509 -10.796 10.024 945 HG1 THR 113 HG1 THR 113 22.851 -13.346 9.347 946 HG21 THR 113 HG21 THR 113 24.169 -11.769 12.150 947 HG22 THR 113 HG22 THR 113 22.633 -12.630 12.258 948 HG23 THR 113 HG23 THR 113 22.665 -10.869 12.340 949 H GLU 114 HN GLU 114 19.136 -10.678 9.700 950 HA GLU 114 HA GLU 114 19.752 -7.939 10.477 951 HB2 GLU 114 HB2 GLU 114 17.484 -7.425 9.697 952 HB3 GLU 114 HB1 GLU 114 18.411 -8.260 8.467 953 HG2 GLU 114 HG2 GLU 114 17.258 -10.311 8.895 954 HG3 GLU 114 HG1 GLU 114 16.442 -9.612 10.290 955 H VAL 115 HN VAL 115 18.688 -10.769 11.885 956 HA VAL 115 HA VAL 115 16.768 -9.616 13.699 957 HB VAL 115 HB VAL 115 18.009 -12.363 13.818 958 HG11 VAL 115 HG11 VAL 115 15.961 -12.943 15.059 959 HG12 VAL 115 HG12 VAL 115 15.464 -11.251 14.996 960 HG13 VAL 115 HG13 VAL 115 16.917 -11.710 15.883 961 HG21 VAL 115 HG21 VAL 115 15.499 -11.461 12.411 962 HG22 VAL 115 HG22 VAL 115 16.000 -13.137 12.629 963 HG23 VAL 115 HG23 VAL 115 16.976 -12.047 11.645 964 H GLY 116 HN GLY 116 18.030 -8.017 14.734 965 HA2 GLY 116 HA2 GLY 116 20.256 -8.876 16.401 966 HA3 GLY 116 HA1 GLY 116 19.622 -7.241 16.262 967 H ALA 117 HN ALA 117 18.805 -10.451 17.537 968 HA ALA 117 HA ALA 117 17.291 -9.107 19.679 969 HB1 ALA 117 HB1 ALA 117 15.784 -11.021 19.729 970 HB2 ALA 117 HB2 ALA 117 16.689 -11.779 18.419 971 HB3 ALA 117 HB3 ALA 117 15.803 -10.283 18.127 972 HA PRO 118 HA PRO 118 20.435 -11.430 21.983 973 HB2 PRO 118 HB2 PRO 118 20.437 -9.879 24.167 974 HB3 PRO 118 HB1 PRO 118 21.213 -9.352 22.668 975 HG2 PRO 118 HG2 PRO 118 18.534 -8.604 23.778 976 HG3 PRO 118 HG1 PRO 118 19.758 -7.567 23.024 977 HD2 PRO 118 HD2 PRO 118 17.552 -8.537 21.715 978 HD3 PRO 118 HD1 PRO 118 19.068 -8.092 20.906 979 H THR 119 HN THR 119 17.398 -11.841 21.938 980 HA THR 119 HA THR 119 16.891 -12.621 24.694 981 HB THR 119 HB THR 119 14.613 -13.295 23.620 982 HG1 THR 119 HG1 THR 119 14.912 -13.083 21.474 983 HG21 THR 119 HG21 THR 119 13.803 -10.998 23.868 984 HG22 THR 119 HG22 THR 119 15.463 -10.404 23.820 985 HG23 THR 119 HG23 THR 119 14.927 -11.420 25.159 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 -30.970 19.363 5.280 2 H2 GLY 1 HT2 GLY 1 -31.290 17.708 5.174 3 H3 GLY 1 HT3 GLY 1 -29.810 18.318 4.636 4 HA2 GLY 1 HA1 GLY 1 -30.769 18.302 7.442 5 HA3 GLY 1 HA2 GLY 1 -29.544 17.235 6.773 6 HA PRO 2 HA PRO 2 -27.302 20.722 8.785 7 HB2 PRO 2 HB2 PRO 2 -25.180 18.662 8.856 8 HB3 PRO 2 HB1 PRO 2 -25.800 19.682 10.157 9 HG2 PRO 2 HG2 PRO 2 -26.382 17.081 10.056 10 HG3 PRO 2 HG1 PRO 2 -27.584 18.270 10.594 11 HD2 PRO 2 HD2 PRO 2 -27.327 16.896 7.945 12 HD3 PRO 2 HD1 PRO 2 -28.787 17.244 8.894 13 H MET 3 HN MET 3 -26.430 22.184 7.518 14 HA MET 3 HA MET 3 -25.234 23.233 5.896 15 HB2 MET 3 HB2 MET 3 -23.524 20.746 6.086 16 HB3 MET 3 HB1 MET 3 -23.083 22.187 5.185 17 HG2 MET 3 HG2 MET 3 -23.134 23.490 7.255 18 HG3 MET 3 HG1 MET 3 -23.552 22.033 8.152 19 HE1 MET 3 HE1 MET 3 -21.962 19.953 8.413 20 HE2 MET 3 HE2 MET 3 -20.326 19.862 7.762 21 HE3 MET 3 HE3 MET 3 -21.711 19.830 6.671 22 H ALA 4 HN ALA 4 -23.852 22.120 3.640 23 HA ALA 4 HA ALA 4 -26.176 21.481 2.016 24 HB1 ALA 4 HB1 ALA 4 -23.340 22.084 1.192 25 HB2 ALA 4 HB2 ALA 4 -24.662 23.247 1.264 26 HB3 ALA 4 HB3 ALA 4 -24.720 21.916 0.110 27 H MET 5 HN MET 5 -22.857 20.225 2.312 28 HA MET 5 HA MET 5 -23.924 17.554 1.701 29 HB2 MET 5 HB2 MET 5 -22.812 18.434 -0.296 30 HB3 MET 5 HB1 MET 5 -21.361 18.759 0.641 31 HG2 MET 5 HG2 MET 5 -21.136 16.738 -0.701 32 HG3 MET 5 HG1 MET 5 -21.033 16.391 1.023 33 HE1 MET 5 HE1 MET 5 -24.713 15.459 -1.605 34 HE2 MET 5 HE2 MET 5 -23.224 16.188 -2.205 35 HE3 MET 5 HE3 MET 5 -24.284 17.102 -1.132 36 H LEU 6 HN LEU 6 -23.912 17.007 3.881 37 HA LEU 6 HA LEU 6 -21.266 16.845 5.145 38 HB2 LEU 6 HB2 LEU 6 -22.941 17.913 6.537 39 HB3 LEU 6 HB1 LEU 6 -24.039 16.564 6.313 40 HG LEU 6 HG LEU 6 -22.474 15.100 7.547 41 HD11 LEU 6 HD11 LEU 6 -20.940 17.645 8.051 42 HD12 LEU 6 HD12 LEU 6 -20.401 16.289 7.064 43 HD13 LEU 6 HD13 LEU 6 -20.629 16.079 8.798 44 HD21 LEU 6 HD21 LEU 6 -22.904 16.041 9.760 45 HD22 LEU 6 HD22 LEU 6 -24.315 16.183 8.712 46 HD23 LEU 6 HD23 LEU 6 -23.303 17.593 9.023 47 H ALA 7 HN ALA 7 -20.243 14.976 5.114 48 HA ALA 7 HA ALA 7 -21.476 12.565 4.198 49 HB1 ALA 7 HB1 ALA 7 -19.144 13.107 3.677 50 HB2 ALA 7 HB2 ALA 7 -19.289 11.558 4.507 51 HB3 ALA 7 HB3 ALA 7 -18.739 12.983 5.388 52 H ARG 8 HN ARG 8 -23.127 12.745 5.950 53 HA ARG 8 HA ARG 8 -22.304 11.962 8.614 54 HB2 ARG 8 HB2 ARG 8 -24.760 12.055 9.093 55 HB3 ARG 8 HB1 ARG 8 -24.093 13.557 8.465 56 HG2 ARG 8 HG2 ARG 8 -24.924 12.917 6.215 57 HG3 ARG 8 HG1 ARG 8 -25.706 11.519 6.950 58 HD2 ARG 8 HD2 ARG 8 -26.230 14.377 7.741 59 HD3 ARG 8 HD1 ARG 8 -27.210 13.470 6.594 60 HE ARG 8 HE ARG 8 -26.984 12.081 9.061 61 HH11 ARG 8 HH11 ARG 8 -28.611 14.767 7.514 62 HH12 ARG 8 HH12 ARG 8 -29.994 14.699 8.561 63 HH21 ARG 8 HH21 ARG 8 -28.804 11.974 10.431 64 HH22 ARG 8 HH22 ARG 8 -30.104 13.107 10.227 65 H ARG 9 HN ARG 9 -23.354 10.444 5.720 66 HA ARG 9 HA ARG 9 -23.627 7.898 7.172 67 HB2 ARG 9 HB2 ARG 9 -24.946 8.709 4.576 68 HB3 ARG 9 HB1 ARG 9 -25.027 7.104 5.282 69 HG2 ARG 9 HG2 ARG 9 -26.133 8.102 7.270 70 HG3 ARG 9 HG1 ARG 9 -26.172 9.644 6.413 71 HD2 ARG 9 HD2 ARG 9 -28.296 8.564 6.134 72 HD3 ARG 9 HD1 ARG 9 -27.443 8.527 4.592 73 HE ARG 9 HE ARG 9 -27.359 6.195 6.380 74 HH11 ARG 9 HH11 ARG 9 -28.255 7.626 3.307 75 HH12 ARG 9 HH12 ARG 9 -28.652 6.104 2.578 76 HH21 ARG 9 HH21 ARG 9 -27.883 4.203 5.418 77 HH22 ARG 9 HH22 ARG 9 -28.446 4.160 3.776 78 H GLN 10 HN GLN 10 -21.862 6.730 6.905 79 HA GLN 10 HA GLN 10 -20.114 7.112 4.651 80 HB2 GLN 10 HB2 GLN 10 -19.281 6.631 6.959 81 HB3 GLN 10 HB1 GLN 10 -19.983 5.024 6.836 82 HG2 GLN 10 HG2 GLN 10 -18.513 4.612 4.863 83 HG3 GLN 10 HG1 GLN 10 -17.731 6.157 5.191 84 HE21 GLN 10 HE21 GLN 10 -18.877 3.984 7.677 85 HE22 GLN 10 HE22 GLN 10 -17.319 3.536 8.274 86 H ARG 11 HN ARG 11 -21.723 6.532 3.032 87 HA ARG 11 HA ARG 11 -22.456 3.724 2.900 88 HB2 ARG 11 HB2 ARG 11 -23.080 5.919 0.918 89 HB3 ARG 11 HB1 ARG 11 -23.813 4.324 0.985 90 HG2 ARG 11 HG2 ARG 11 -24.139 6.577 2.951 91 HG3 ARG 11 HG1 ARG 11 -25.362 5.890 1.883 92 HD2 ARG 11 HD2 ARG 11 -24.006 4.454 4.162 93 HD3 ARG 11 HD1 ARG 11 -25.626 5.139 4.205 94 HE ARG 11 HE ARG 11 -25.667 3.416 2.083 95 HH11 ARG 11 HH11 ARG 11 -24.910 3.155 5.485 96 HH12 ARG 11 HH12 ARG 11 -25.420 1.501 5.608 97 HH21 ARG 11 HH21 ARG 11 -26.352 1.234 2.234 98 HH22 ARG 11 HH22 ARG 11 -26.252 0.410 3.758 99 H ASP 12 HN ASP 12 -21.766 2.320 1.369 100 HA ASP 12 HA ASP 12 -20.277 1.276 0.021 101 HB2 ASP 12 HB2 ASP 12 -21.244 3.043 -1.563 102 HB3 ASP 12 HB1 ASP 12 -19.741 3.927 -1.305 103 HA PRO 13 HA PRO 13 -16.882 2.836 2.829 104 HB2 PRO 13 HB2 PRO 13 -16.583 -0.096 3.156 105 HB3 PRO 13 HB1 PRO 13 -16.630 1.173 4.385 106 HG2 PRO 13 HG2 PRO 13 -18.706 -0.459 4.036 107 HG3 PRO 13 HG1 PRO 13 -18.951 1.263 4.389 108 HD2 PRO 13 HD2 PRO 13 -19.154 -0.186 1.775 109 HD3 PRO 13 HD1 PRO 13 -20.193 1.095 2.437 110 H LEU 14 HN LEU 14 -16.969 0.342 0.339 111 HA LEU 14 HA LEU 14 -14.210 -0.045 0.008 112 HB2 LEU 14 HB2 LEU 14 -16.410 -0.130 -2.063 113 HB3 LEU 14 HB1 LEU 14 -14.759 -0.657 -2.360 114 HG LEU 14 HG LEU 14 -16.629 -1.885 -0.324 115 HD11 LEU 14 HD11 LEU 14 -16.734 -3.775 -1.858 116 HD12 LEU 14 HD12 LEU 14 -15.752 -2.892 -3.025 117 HD13 LEU 14 HD13 LEU 14 -17.364 -2.310 -2.609 118 HD21 LEU 14 HD21 LEU 14 -14.345 -2.156 0.370 119 HD22 LEU 14 HD22 LEU 14 -13.866 -2.655 -1.252 120 HD23 LEU 14 HD23 LEU 14 -14.918 -3.690 -0.287 121 H GLN 15 HN GLN 15 -16.340 2.453 -1.320 122 HA GLN 15 HA GLN 15 -14.466 3.689 -3.001 123 HB2 GLN 15 HB2 GLN 15 -16.839 4.202 -3.126 124 HB3 GLN 15 HB1 GLN 15 -16.816 4.860 -1.499 125 HG2 GLN 15 HG2 GLN 15 -15.355 6.663 -2.239 126 HG3 GLN 15 HG1 GLN 15 -15.356 6.000 -3.872 127 HE21 GLN 15 HE21 GLN 15 -18.183 5.976 -1.837 128 HE22 GLN 15 HE22 GLN 15 -19.079 7.147 -2.736 129 H ALA 16 HN ALA 16 -15.256 4.274 0.408 130 HA ALA 16 HA ALA 16 -13.510 6.443 0.808 131 HB1 ALA 16 HB1 ALA 16 -13.770 5.989 3.185 132 HB2 ALA 16 HB2 ALA 16 -14.460 4.407 2.817 133 HB3 ALA 16 HB3 ALA 16 -15.322 5.874 2.354 134 H LEU 17 HN LEU 17 -13.091 2.962 1.320 135 HA LEU 17 HA LEU 17 -10.431 3.105 2.238 136 HB2 LEU 17 HB2 LEU 17 -11.826 1.118 2.531 137 HB3 LEU 17 HB1 LEU 17 -11.837 0.862 0.796 138 HG LEU 17 HG LEU 17 -9.349 0.587 0.894 139 HD11 LEU 17 HD11 LEU 17 -9.850 0.547 3.864 140 HD12 LEU 17 HD12 LEU 17 -8.915 1.749 2.973 141 HD13 LEU 17 HD13 LEU 17 -8.344 0.083 3.071 142 HD21 LEU 17 HD21 LEU 17 -9.434 -1.680 1.745 143 HD22 LEU 17 HD22 LEU 17 -10.864 -1.319 0.779 144 HD23 LEU 17 HD23 LEU 17 -10.971 -1.340 2.540 145 H ARG 18 HN ARG 18 -11.810 2.804 -1.002 146 HA ARG 18 HA ARG 18 -9.451 2.384 -2.437 147 HB2 ARG 18 HB2 ARG 18 -11.745 2.255 -3.397 148 HB3 ARG 18 HB1 ARG 18 -11.859 4.007 -3.304 149 HG2 ARG 18 HG2 ARG 18 -9.899 4.150 -4.828 150 HG3 ARG 18 HG1 ARG 18 -9.970 2.396 -5.001 151 HD2 ARG 18 HD2 ARG 18 -11.097 3.468 -6.859 152 HD3 ARG 18 HD1 ARG 18 -12.260 2.585 -5.871 153 HE ARG 18 HE ARG 18 -12.376 5.086 -4.858 154 HH11 ARG 18 HH11 ARG 18 -12.564 3.869 -8.132 155 HH12 ARG 18 HH12 ARG 18 -13.655 5.106 -8.663 156 HH21 ARG 18 HH21 ARG 18 -13.785 6.745 -5.566 157 HH22 ARG 18 HH22 ARG 18 -14.336 6.751 -7.209 158 H ARG 19 HN ARG 19 -10.933 5.345 -1.227 159 HA ARG 19 HA ARG 19 -9.134 7.177 -2.395 160 HB2 ARG 19 HB2 ARG 19 -11.305 7.796 -1.357 161 HB3 ARG 19 HB1 ARG 19 -10.634 7.419 0.223 162 HG2 ARG 19 HG2 ARG 19 -9.017 9.198 0.002 163 HG3 ARG 19 HG1 ARG 19 -9.582 9.540 -1.635 164 HD2 ARG 19 HD2 ARG 19 -11.796 10.103 -0.734 165 HD3 ARG 19 HD1 ARG 19 -11.200 9.801 0.897 166 HE ARG 19 HE ARG 19 -9.467 11.645 -0.075 167 HH11 ARG 19 HH11 ARG 19 -12.961 11.514 0.116 168 HH12 ARG 19 HH12 ARG 19 -13.140 13.232 0.273 169 HH21 ARG 19 HH21 ARG 19 -9.700 13.904 0.129 170 HH22 ARG 19 HH22 ARG 19 -11.287 14.591 0.286 171 H ARG 20 HN ARG 20 -9.121 5.471 0.704 172 HA ARG 20 HA ARG 20 -6.725 6.513 1.715 173 HB2 ARG 20 HB2 ARG 20 -8.000 3.809 2.162 174 HB3 ARG 20 HB1 ARG 20 -6.651 4.435 3.101 175 HG2 ARG 20 HG2 ARG 20 -8.054 6.306 3.844 176 HG3 ARG 20 HG1 ARG 20 -9.407 5.644 2.926 177 HD2 ARG 20 HD2 ARG 20 -9.533 5.082 5.317 178 HD3 ARG 20 HD1 ARG 20 -9.402 3.646 4.306 179 HE ARG 20 HE ARG 20 -7.043 3.531 4.950 180 HH11 ARG 20 HH11 ARG 20 -9.160 5.512 6.932 181 HH12 ARG 20 HH12 ARG 20 -8.157 5.391 8.341 182 HH21 ARG 20 HH21 ARG 20 -5.721 3.392 6.811 183 HH22 ARG 20 HH22 ARG 20 -6.202 4.193 8.272 184 H ASN 21 HN ASN 21 -7.339 3.693 -0.350 185 HA ASN 21 HA ASN 21 -4.685 2.779 -0.464 186 HB2 ASN 21 HB2 ASN 21 -6.909 2.476 -2.493 187 HB3 ASN 21 HB1 ASN 21 -5.371 1.627 -2.572 188 HD21 ASN 21 HD21 ASN 21 -7.955 0.456 -2.415 189 HD22 ASN 21 HD22 ASN 21 -8.001 -0.455 -0.941 190 H GLN 22 HN GLN 22 -6.410 5.139 -2.450 191 HA GLN 22 HA GLN 22 -4.378 5.550 -4.358 192 HB2 GLN 22 HB2 GLN 22 -6.530 7.422 -3.354 193 HB3 GLN 22 HB1 GLN 22 -5.502 7.754 -4.741 194 HG2 GLN 22 HG2 GLN 22 -7.316 5.365 -4.521 195 HG3 GLN 22 HG1 GLN 22 -7.767 6.883 -5.293 196 HE21 GLN 22 HE21 GLN 22 -8.076 5.844 -7.271 197 HE22 GLN 22 HE22 GLN 22 -6.751 5.312 -8.244 198 H GLU 23 HN GLU 23 -4.889 6.770 -1.148 199 HA GLU 23 HA GLU 23 -2.951 8.855 -1.246 200 HB2 GLU 23 HB2 GLU 23 -4.840 8.701 0.397 201 HB3 GLU 23 HB1 GLU 23 -4.000 7.364 1.167 202 HG2 GLU 23 HG2 GLU 23 -2.140 8.830 1.708 203 HG3 GLU 23 HG1 GLU 23 -2.955 10.172 0.904 204 H LEU 24 HN LEU 24 -2.967 5.507 -0.099 205 HA LEU 24 HA LEU 24 -0.295 5.412 0.794 206 HB2 LEU 24 HB2 LEU 24 -2.045 3.188 -0.249 207 HB3 LEU 24 HB1 LEU 24 -0.520 2.957 0.580 208 HG LEU 24 HG LEU 24 -2.979 4.213 1.807 209 HD11 LEU 24 HD11 LEU 24 -1.762 1.493 2.247 210 HD12 LEU 24 HD12 LEU 24 -3.219 1.806 1.310 211 HD13 LEU 24 HD13 LEU 24 -3.193 2.150 3.036 212 HD21 LEU 24 HD21 LEU 24 -1.740 4.001 3.903 213 HD22 LEU 24 HD22 LEU 24 -0.887 5.047 2.767 214 HD23 LEU 24 HD23 LEU 24 -0.341 3.389 3.022 215 H LYS 25 HN LYS 25 -1.787 4.705 -2.337 216 HA LYS 25 HA LYS 25 0.449 3.628 -3.607 217 HB2 LYS 25 HB2 LYS 25 -1.833 3.618 -4.570 218 HB3 LYS 25 HB1 LYS 25 -1.700 5.348 -4.861 219 HG2 LYS 25 HG2 LYS 25 0.280 4.879 -6.303 220 HG3 LYS 25 HG1 LYS 25 -0.065 3.159 -6.118 221 HD2 LYS 25 HD2 LYS 25 -2.240 3.457 -7.139 222 HD3 LYS 25 HD1 LYS 25 -1.972 5.200 -7.254 223 HE2 LYS 25 HE2 LYS 25 -0.414 3.032 -8.660 224 HE3 LYS 25 HE1 LYS 25 -1.545 4.166 -9.399 225 HZ1 LYS 25 HZ1 LYS 25 0.724 4.870 -9.761 226 HZ2 LYS 25 HZ2 LYS 25 1.038 4.870 -8.100 227 HZ3 LYS 25 HZ3 LYS 25 -0.058 5.981 -8.754 228 H GLN 26 HN GLN 26 -0.549 6.998 -3.199 229 HA GLN 26 HA GLN 26 1.519 8.135 -4.748 230 HB2 GLN 26 HB2 GLN 26 -0.498 9.381 -4.076 231 HB3 GLN 26 HB1 GLN 26 0.036 9.334 -2.401 232 HG2 GLN 26 HG2 GLN 26 1.990 10.660 -2.967 233 HG3 GLN 26 HG1 GLN 26 1.502 10.678 -4.660 234 HE21 GLN 26 HE21 GLN 26 1.930 12.875 -2.787 235 HE22 GLN 26 HE22 GLN 26 0.451 13.768 -2.764 236 H GLN 27 HN GLN 27 1.348 7.032 -1.433 237 HA GLN 27 HA GLN 27 3.768 8.250 -0.546 238 HB2 GLN 27 HB2 GLN 27 2.309 5.832 0.543 239 HB3 GLN 27 HB1 GLN 27 3.581 6.718 1.373 240 HG2 GLN 27 HG2 GLN 27 2.168 8.692 1.470 241 HG3 GLN 27 HG1 GLN 27 0.906 7.846 0.579 242 HE21 GLN 27 HE21 GLN 27 2.869 6.365 3.076 243 HE22 GLN 27 HE22 GLN 27 1.601 6.185 4.232 244 H VAL 28 HN VAL 28 2.920 5.153 -1.998 245 HA VAL 28 HA VAL 28 5.460 3.924 -1.660 246 HB VAL 28 HB VAL 28 3.245 3.339 -3.638 247 HG11 VAL 28 HG11 VAL 28 4.345 1.158 -3.935 248 HG12 VAL 28 HG12 VAL 28 5.691 1.721 -2.945 249 HG13 VAL 28 HG13 VAL 28 5.350 2.497 -4.490 250 HG21 VAL 28 HG21 VAL 28 3.993 2.011 -1.033 251 HG22 VAL 28 HG22 VAL 28 2.737 1.458 -2.141 252 HG23 VAL 28 HG23 VAL 28 2.568 3.012 -1.322 253 H ASP 29 HN ASP 29 3.898 5.592 -4.384 254 HA ASP 29 HA ASP 29 6.052 5.478 -6.170 255 HB2 ASP 29 HB2 ASP 29 3.729 7.364 -5.894 256 HB3 ASP 29 HB1 ASP 29 4.990 7.675 -7.080 257 H SER 30 HN SER 30 5.366 7.639 -3.502 258 HA SER 30 HA SER 30 7.356 9.563 -4.027 259 HB2 SER 30 HB2 SER 30 5.500 9.875 -2.392 260 HB3 SER 30 HB1 SER 30 6.265 8.693 -1.332 261 HG SER 30 HG SER 30 7.197 11.250 -2.091 262 H LEU 31 HN LEU 31 7.388 6.548 -2.178 263 HA LEU 31 HA LEU 31 10.038 6.710 -1.243 264 HB2 LEU 31 HB2 LEU 31 8.395 5.093 -0.381 265 HB3 LEU 31 HB1 LEU 31 8.418 4.253 -1.920 266 HG LEU 31 HG LEU 31 10.866 3.811 -1.538 267 HD11 LEU 31 HD11 LEU 31 11.374 5.518 0.063 268 HD12 LEU 31 HD12 LEU 31 11.633 3.945 0.816 269 HD13 LEU 31 HD13 LEU 31 10.185 4.875 1.194 270 HD21 LEU 31 HD21 LEU 31 10.474 1.967 -0.009 271 HD22 LEU 31 HD22 LEU 31 9.148 2.120 -1.161 272 HD23 LEU 31 HD23 LEU 31 8.948 2.691 0.495 273 H LEU 32 HN LEU 32 8.670 5.145 -4.110 274 HA LEU 32 HA LEU 32 11.026 4.221 -5.245 275 HB2 LEU 32 HB2 LEU 32 8.514 5.202 -6.600 276 HB3 LEU 32 HB1 LEU 32 9.766 4.253 -7.378 277 HG LEU 32 HG LEU 32 8.067 3.324 -5.062 278 HD11 LEU 32 HD11 LEU 32 6.767 3.544 -7.105 279 HD12 LEU 32 HD12 LEU 32 7.016 1.847 -6.700 280 HD13 LEU 32 HD13 LEU 32 7.966 2.596 -7.984 281 HD21 LEU 32 HD21 LEU 32 10.261 2.294 -5.038 282 HD22 LEU 32 HD22 LEU 32 10.098 1.859 -6.738 283 HD23 LEU 32 HD23 LEU 32 9.040 1.125 -5.534 284 H SER 33 HN SER 33 9.568 7.407 -5.299 285 HA SER 33 HA SER 33 11.121 8.547 -7.344 286 HB2 SER 33 HB2 SER 33 9.084 9.606 -6.402 287 HB3 SER 33 HB1 SER 33 9.957 9.916 -4.904 288 HG SER 33 HG SER 33 11.009 10.836 -7.346 289 H GLU 34 HN GLU 34 11.688 8.229 -3.846 290 HA GLU 34 HA GLU 34 14.141 9.711 -3.909 291 HB2 GLU 34 HB2 GLU 34 13.140 7.764 -1.823 292 HB3 GLU 34 HB1 GLU 34 14.438 8.931 -1.621 293 HG2 GLU 34 HG2 GLU 34 11.550 9.611 -2.124 294 HG3 GLU 34 HG1 GLU 34 12.357 9.650 -0.558 295 H SER 35 HN SER 35 13.186 6.354 -3.993 296 HA SER 35 HA SER 35 15.770 5.218 -3.803 297 HB2 SER 35 HB2 SER 35 13.675 4.014 -3.242 298 HB3 SER 35 HB1 SER 35 13.231 4.023 -4.947 299 HG SER 35 HG SER 35 15.721 3.023 -4.616 300 H GLN 36 HN GLN 36 14.416 6.989 -6.278 301 HA GLN 36 HA GLN 36 15.583 5.389 -8.440 302 HB2 GLN 36 HB2 GLN 36 13.228 6.140 -8.663 303 HB3 GLN 36 HB1 GLN 36 13.765 7.808 -8.555 304 HG2 GLN 36 HG2 GLN 36 15.052 7.508 -10.627 305 HG3 GLN 36 HG1 GLN 36 14.447 5.855 -10.741 306 HE21 GLN 36 HE21 GLN 36 13.640 9.224 -10.960 307 HE22 GLN 36 HE22 GLN 36 12.118 9.015 -11.754 308 H LEU 37 HN LEU 37 16.414 7.782 -6.358 309 HA LEU 37 HA LEU 37 17.850 9.472 -8.234 310 HB2 LEU 37 HB2 LEU 37 17.701 9.545 -5.219 311 HB3 LEU 37 HB1 LEU 37 18.446 10.766 -6.232 312 HG LEU 37 HG LEU 37 15.509 10.075 -6.237 313 HD11 LEU 37 HD11 LEU 37 16.961 12.435 -5.055 314 HD12 LEU 37 HD12 LEU 37 16.168 11.142 -4.156 315 HD13 LEU 37 HD13 LEU 37 15.211 12.242 -5.148 316 HD21 LEU 37 HD21 LEU 37 17.095 12.189 -7.675 317 HD22 LEU 37 HD22 LEU 37 15.338 12.200 -7.528 318 HD23 LEU 37 HD23 LEU 37 16.141 10.888 -8.387 319 H LYS 38 HN LYS 38 20.117 9.799 -8.122 320 HA LYS 38 HA LYS 38 21.632 7.418 -7.713 321 HB2 LYS 38 HB2 LYS 38 22.151 9.109 -9.470 322 HB3 LYS 38 HB1 LYS 38 22.610 10.239 -8.208 323 HG2 LYS 38 HG2 LYS 38 24.422 8.750 -7.521 324 HG3 LYS 38 HG1 LYS 38 23.962 7.610 -8.789 325 HD2 LYS 38 HD2 LYS 38 24.399 9.346 -10.480 326 HD3 LYS 38 HD1 LYS 38 24.898 10.452 -9.199 327 HE2 LYS 38 HE2 LYS 38 26.837 9.450 -10.261 328 HE3 LYS 38 HE1 LYS 38 26.707 8.912 -8.588 329 HZ1 LYS 38 HZ1 LYS 38 25.703 6.849 -9.393 330 HZ2 LYS 38 HZ2 LYS 38 27.251 7.074 -10.023 331 HZ3 LYS 38 HZ3 LYS 38 25.897 7.366 -10.990 332 H GLU 39 HN GLU 39 20.994 10.295 -5.875 333 HA GLU 39 HA GLU 39 23.069 10.030 -3.964 334 HB2 GLU 39 HB2 GLU 39 21.850 11.650 -2.646 335 HB3 GLU 39 HB1 GLU 39 21.788 12.128 -4.335 336 HG2 GLU 39 HG2 GLU 39 19.524 11.230 -4.510 337 HG3 GLU 39 HG1 GLU 39 19.586 10.740 -2.817 338 H ALA 40 HN ALA 40 20.210 8.281 -4.475 339 HA ALA 40 HA ALA 40 19.624 7.612 -1.768 340 HB1 ALA 40 HB1 ALA 40 18.046 6.019 -2.716 341 HB2 ALA 40 HB2 ALA 40 18.729 6.295 -4.318 342 HB3 ALA 40 HB3 ALA 40 17.898 7.602 -3.478 343 H LEU 41 HN LEU 41 21.960 6.553 -3.973 344 HA LEU 41 HA LEU 41 22.184 3.896 -2.839 345 HB2 LEU 41 HB2 LEU 41 22.662 4.416 -5.252 346 HB3 LEU 41 HB1 LEU 41 24.088 5.288 -4.723 347 HG LEU 41 HG LEU 41 24.994 3.200 -3.765 348 HD11 LEU 41 HD11 LEU 41 22.547 1.945 -4.995 349 HD12 LEU 41 HD12 LEU 41 22.931 2.039 -3.276 350 HD13 LEU 41 HD13 LEU 41 23.930 1.061 -4.352 351 HD21 LEU 41 HD21 LEU 41 24.199 3.037 -6.668 352 HD22 LEU 41 HD22 LEU 41 25.481 2.097 -5.903 353 HD23 LEU 41 HD23 LEU 41 25.620 3.851 -6.016 354 H GLU 42 HN GLU 42 22.870 6.820 -1.690 355 HA GLU 42 HA GLU 42 25.456 6.298 -0.517 356 HB2 GLU 42 HB2 GLU 42 24.631 8.609 -1.040 357 HB3 GLU 42 HB1 GLU 42 23.412 8.412 0.209 358 HG2 GLU 42 HG2 GLU 42 25.189 9.698 1.108 359 HG3 GLU 42 HG1 GLU 42 25.249 8.104 1.858 360 HA PRO 43 HA PRO 43 23.827 3.317 2.316 361 HB2 PRO 43 HB2 PRO 43 25.953 4.406 4.117 362 HB3 PRO 43 HB1 PRO 43 25.557 2.728 3.730 363 HG2 PRO 43 HG2 PRO 43 27.638 3.942 2.594 364 HG3 PRO 43 HG1 PRO 43 26.628 2.806 1.682 365 HD2 PRO 43 HD2 PRO 43 26.784 5.768 1.510 366 HD3 PRO 43 HD1 PRO 43 26.357 4.580 0.261 367 H ASN 44 HN ASN 44 24.623 6.505 3.731 368 HA ASN 44 HA ASN 44 23.078 6.203 6.054 369 HB2 ASN 44 HB2 ASN 44 23.970 8.664 4.545 370 HB3 ASN 44 HB1 ASN 44 23.038 8.767 6.038 371 HD21 ASN 44 HD21 ASN 44 24.809 9.870 6.996 372 HD22 ASN 44 HD22 ASN 44 26.209 9.006 7.528 373 H LYS 45 HN LYS 45 22.203 7.721 2.932 374 HA LYS 45 HA LYS 45 19.510 8.197 3.723 375 HB2 LYS 45 HB2 LYS 45 20.625 9.534 1.998 376 HB3 LYS 45 HB1 LYS 45 20.787 8.111 0.982 377 HG2 LYS 45 HG2 LYS 45 18.974 9.427 0.156 378 HG3 LYS 45 HG1 LYS 45 18.307 7.966 0.884 379 HD2 LYS 45 HD2 LYS 45 16.899 9.610 1.703 380 HD3 LYS 45 HD1 LYS 45 18.067 9.439 3.011 381 HE2 LYS 45 HE2 LYS 45 18.152 11.548 0.852 382 HE3 LYS 45 HE1 LYS 45 17.554 11.795 2.489 383 HZ1 LYS 45 HZ1 LYS 45 19.770 12.601 2.356 384 HZ2 LYS 45 HZ2 LYS 45 20.334 11.161 1.679 385 HZ3 LYS 45 HZ3 LYS 45 19.807 11.189 3.287 386 H ARG 46 HN ARG 46 21.199 5.676 1.986 387 HA ARG 46 HA ARG 46 18.999 4.327 0.905 388 HB2 ARG 46 HB2 ARG 46 21.353 3.993 0.230 389 HB3 ARG 46 HB1 ARG 46 21.663 3.192 1.760 390 HG2 ARG 46 HG2 ARG 46 20.116 1.417 1.170 391 HG3 ARG 46 HG1 ARG 46 19.747 2.233 -0.353 392 HD2 ARG 46 HD2 ARG 46 22.049 2.008 -1.066 393 HD3 ARG 46 HD1 ARG 46 22.480 1.285 0.481 394 HE ARG 46 HE ARG 46 20.536 -0.025 -1.295 395 HH11 ARG 46 HH11 ARG 46 23.535 -0.031 0.502 396 HH12 ARG 46 HH12 ARG 46 23.873 -1.708 0.203 397 HH21 ARG 46 HH21 ARG 46 20.961 -2.247 -1.693 398 HH22 ARG 46 HH22 ARG 46 22.390 -2.983 -1.023 399 H GLN 47 HN GLN 47 20.694 3.883 4.004 400 HA GLN 47 HA GLN 47 19.085 1.710 4.848 401 HB2 GLN 47 HB2 GLN 47 20.715 3.683 6.451 402 HB3 GLN 47 HB1 GLN 47 19.947 2.256 7.128 403 HG2 GLN 47 HG2 GLN 47 22.201 2.387 5.153 404 HG3 GLN 47 HG1 GLN 47 22.210 1.704 6.778 405 HE21 GLN 47 HE21 GLN 47 21.196 -0.302 7.134 406 HE22 GLN 47 HE22 GLN 47 20.873 -1.389 5.829 407 H HIS 48 HN HIS 48 18.765 5.180 5.036 408 HA HIS 48 HA HIS 48 16.606 5.243 6.873 409 HB2 HIS 48 HB2 HIS 48 18.019 7.240 6.240 410 HB3 HIS 48 HB1 HIS 48 17.194 7.264 4.684 411 HD1 HIS 48 HD1 HIS 48 16.738 8.122 8.281 412 HD2 HIS 48 HD2 HIS 48 14.522 8.189 4.764 413 HE1 HIS 48 HE1 HIS 48 14.703 9.502 8.788 414 HE2 HIS 48 HE2 HIS 48 13.302 9.384 6.704 415 H ILE 49 HN ILE 49 16.834 4.853 3.384 416 HA ILE 49 HA ILE 49 14.117 5.060 2.722 417 HB ILE 49 HB ILE 49 16.278 3.347 1.478 418 HG12 ILE 49 HG12 ILE 49 15.130 6.033 0.682 419 HG13 ILE 49 HG11 ILE 49 16.708 5.768 1.413 420 HG21 ILE 49 HG21 ILE 49 13.578 4.064 0.347 421 HG22 ILE 49 HG22 ILE 49 14.052 2.473 0.939 422 HG23 ILE 49 HG23 ILE 49 14.848 3.161 -0.477 423 HD11 ILE 49 HD11 ILE 49 15.819 4.776 -1.286 424 HD12 ILE 49 HD12 ILE 49 17.400 4.496 -0.555 425 HD13 ILE 49 HD13 ILE 49 16.901 6.135 -0.973 426 H TYR 50 HN TYR 50 16.034 2.267 3.795 427 HA TYR 50 HA TYR 50 14.120 0.287 3.741 428 HB2 TYR 50 HB2 TYR 50 16.481 -0.103 4.284 429 HB3 TYR 50 HB1 TYR 50 16.282 0.735 5.817 430 HD1 TYR 50 HD1 TYR 50 16.518 -0.764 7.548 431 HD2 TYR 50 HD2 TYR 50 14.295 -1.962 4.117 432 HE1 TYR 50 HE1 TYR 50 16.001 -2.909 8.633 433 HE2 TYR 50 HE2 TYR 50 13.781 -4.111 5.201 434 HH TYR 50 HH TYR 50 14.697 -5.553 6.941 435 H GLN 51 HN GLN 51 14.628 2.753 6.241 436 HA GLN 51 HA GLN 51 12.704 1.731 8.063 437 HB2 GLN 51 HB2 GLN 51 14.430 3.341 8.770 438 HB3 GLN 51 HB1 GLN 51 13.724 4.565 7.725 439 HG2 GLN 51 HG2 GLN 51 13.092 4.938 10.032 440 HG3 GLN 51 HG1 GLN 51 11.682 4.546 9.052 441 HE21 GLN 51 HE21 GLN 51 10.470 3.871 10.788 442 HE22 GLN 51 HE22 GLN 51 10.788 2.399 11.641 443 H ARG 52 HN ARG 52 12.527 4.204 5.515 444 HA ARG 52 HA ARG 52 9.826 4.896 5.870 445 HB2 ARG 52 HB2 ARG 52 11.611 4.939 3.445 446 HB3 ARG 52 HB1 ARG 52 9.939 5.473 3.377 447 HG2 ARG 52 HG2 ARG 52 10.458 7.159 5.115 448 HG3 ARG 52 HG1 ARG 52 12.151 6.661 5.033 449 HD2 ARG 52 HD2 ARG 52 12.303 7.315 2.737 450 HD3 ARG 52 HD1 ARG 52 10.568 7.609 2.653 451 HE ARG 52 HE ARG 52 11.986 9.222 4.593 452 HH11 ARG 52 HH11 ARG 52 10.799 8.967 1.313 453 HH12 ARG 52 HH12 ARG 52 10.831 10.676 1.028 454 HH21 ARG 52 HH21 ARG 52 12.029 11.479 4.224 455 HH22 ARG 52 HH22 ARG 52 11.510 12.106 2.692 456 H CYS 53 HN CYS 53 11.372 2.268 4.209 457 HA CYS 53 HA CYS 53 9.131 1.481 2.638 458 HB2 CYS 53 HB2 CYS 53 11.659 0.882 2.346 459 HB3 CYS 53 HB1 CYS 53 11.302 -0.430 3.470 460 HG CYS 53 HG CYS 53 10.318 -2.040 1.733 461 H ILE 54 HN ILE 54 10.470 0.396 5.726 462 HA ILE 54 HA ILE 54 8.640 -1.631 6.293 463 HB ILE 54 HB ILE 54 10.067 0.226 8.198 464 HG12 ILE 54 HG12 ILE 54 10.699 -2.602 7.306 465 HG13 ILE 54 HG11 ILE 54 11.564 -1.150 6.802 466 HG21 ILE 54 HG21 ILE 54 8.131 -0.740 9.290 467 HG22 ILE 54 HG22 ILE 54 9.613 -1.458 9.925 468 HG23 ILE 54 HG23 ILE 54 8.621 -2.354 8.775 469 HD11 ILE 54 HD11 ILE 54 11.414 -2.236 9.607 470 HD12 ILE 54 HD12 ILE 54 12.285 -0.789 9.107 471 HD13 ILE 54 HD13 ILE 54 12.788 -2.369 8.508 472 H GLN 55 HN GLN 55 8.495 1.831 7.067 473 HA GLN 55 HA GLN 55 6.125 1.695 8.576 474 HB2 GLN 55 HB2 GLN 55 7.770 3.578 8.592 475 HB3 GLN 55 HB1 GLN 55 7.169 4.064 7.014 476 HG2 GLN 55 HG2 GLN 55 5.280 3.814 9.312 477 HG3 GLN 55 HG1 GLN 55 6.305 5.239 9.160 478 HE21 GLN 55 HE21 GLN 55 3.388 4.918 8.983 479 HE22 GLN 55 HE22 GLN 55 2.942 5.584 7.451 480 H LEU 56 HN LEU 56 6.598 2.697 5.174 481 HA LEU 56 HA LEU 56 3.937 3.001 4.515 482 HB2 LEU 56 HB2 LEU 56 6.112 1.952 2.700 483 HB3 LEU 56 HB1 LEU 56 4.607 2.683 2.184 484 HG LEU 56 HG LEU 56 6.826 4.089 3.678 485 HD11 LEU 56 HD11 LEU 56 5.931 4.305 0.811 486 HD12 LEU 56 HD12 LEU 56 7.427 3.568 1.385 487 HD13 LEU 56 HD13 LEU 56 7.162 5.300 1.588 488 HD21 LEU 56 HD21 LEU 56 4.221 5.133 2.577 489 HD22 LEU 56 HD22 LEU 56 5.539 6.135 3.179 490 HD23 LEU 56 HD23 LEU 56 4.692 5.046 4.275 491 H LYS 57 HN LYS 57 5.855 0.028 4.581 492 HA LYS 57 HA LYS 57 3.907 -1.619 3.363 493 HB2 LYS 57 HB2 LYS 57 6.289 -2.287 3.696 494 HB3 LYS 57 HB1 LYS 57 5.973 -2.435 5.421 495 HG2 LYS 57 HG2 LYS 57 4.222 -4.134 4.869 496 HG3 LYS 57 HG1 LYS 57 4.782 -4.070 3.198 497 HD2 LYS 57 HD2 LYS 57 7.000 -4.799 3.897 498 HD3 LYS 57 HD1 LYS 57 6.474 -4.816 5.583 499 HE2 LYS 57 HE2 LYS 57 4.741 -6.491 4.951 500 HE3 LYS 57 HE1 LYS 57 5.450 -6.549 3.338 501 HZ1 LYS 57 HZ1 LYS 57 7.515 -7.320 4.308 502 HZ2 LYS 57 HZ2 LYS 57 6.247 -8.348 4.744 503 HZ3 LYS 57 HZ3 LYS 57 6.854 -7.235 5.861 504 H GLN 58 HN GLN 58 4.508 -0.674 6.699 505 HA GLN 58 HA GLN 58 2.582 -2.318 7.925 506 HB2 GLN 58 HB2 GLN 58 3.712 0.354 8.764 507 HB3 GLN 58 HB1 GLN 58 2.675 -0.632 9.785 508 HG2 GLN 58 HG2 GLN 58 4.304 -2.373 9.877 509 HG3 GLN 58 HG1 GLN 58 5.305 -1.568 8.668 510 HE21 GLN 58 HE21 GLN 58 5.939 -2.400 11.391 511 HE22 GLN 58 HE22 GLN 58 6.459 -0.972 12.219 512 H ALA 59 HN ALA 59 2.362 0.851 6.416 513 HA ALA 59 HA ALA 59 -0.266 1.452 7.274 514 HB1 ALA 59 HB1 ALA 59 1.215 2.448 4.844 515 HB2 ALA 59 HB2 ALA 59 1.294 3.152 6.458 516 HB3 ALA 59 HB3 ALA 59 -0.223 3.177 5.558 517 H ILE 60 HN ILE 60 1.031 -0.151 4.395 518 HA ILE 60 HA ILE 60 -1.463 -0.420 3.069 519 HB ILE 60 HB ILE 60 1.006 -2.145 2.786 520 HG12 ILE 60 HG12 ILE 60 0.104 0.269 1.195 521 HG13 ILE 60 HG11 ILE 60 1.426 0.254 2.358 522 HG21 ILE 60 HG21 ILE 60 -1.346 -1.773 0.937 523 HG22 ILE 60 HG22 ILE 60 -1.008 -3.209 1.901 524 HG23 ILE 60 HG23 ILE 60 0.088 -2.741 0.602 525 HD11 ILE 60 HD11 ILE 60 2.622 -1.357 0.951 526 HD12 ILE 60 HD12 ILE 60 2.272 0.146 0.097 527 HD13 ILE 60 HD13 ILE 60 1.306 -1.295 -0.220 528 H ASP 61 HN ASP 61 0.364 -2.517 5.250 529 HA ASP 61 HA ASP 61 -1.326 -4.754 5.205 530 HB2 ASP 61 HB2 ASP 61 0.914 -4.790 6.247 531 HB3 ASP 61 HB1 ASP 61 0.351 -3.695 7.506 532 H GLU 62 HN GLU 62 -1.400 -1.819 7.119 533 HA GLU 62 HA GLU 62 -3.483 -2.481 8.860 534 HB2 GLU 62 HB2 GLU 62 -2.101 -0.552 9.271 535 HB3 GLU 62 HB1 GLU 62 -2.611 0.195 7.763 536 HG2 GLU 62 HG2 GLU 62 -4.879 0.406 8.628 537 HG3 GLU 62 HG1 GLU 62 -4.375 -0.354 10.137 538 H ASN 63 HN ASN 63 -3.570 -0.832 5.717 539 HA ASN 63 HA ASN 63 -6.399 -0.534 5.708 540 HB2 ASN 63 HB2 ASN 63 -4.280 -0.265 3.590 541 HB3 ASN 63 HB1 ASN 63 -5.988 -0.149 3.186 542 HD21 ASN 63 HD21 ASN 63 -3.369 1.333 5.010 543 HD22 ASN 63 HD22 ASN 63 -4.130 2.878 5.179 544 H LYS 64 HN LYS 64 -4.181 -2.941 4.370 545 HA LYS 64 HA LYS 64 -6.056 -4.522 3.016 546 HB2 LYS 64 HB2 LYS 64 -3.636 -4.864 2.827 547 HB3 LYS 64 HB1 LYS 64 -3.561 -5.368 4.508 548 HG2 LYS 64 HG2 LYS 64 -5.099 -7.261 3.904 549 HG3 LYS 64 HG1 LYS 64 -4.863 -6.806 2.214 550 HD2 LYS 64 HD2 LYS 64 -2.457 -7.145 2.449 551 HD3 LYS 64 HD1 LYS 64 -2.675 -7.568 4.149 552 HE2 LYS 64 HE2 LYS 64 -4.118 -9.461 3.437 553 HE3 LYS 64 HE1 LYS 64 -3.740 -9.072 1.760 554 HZ1 LYS 64 HZ1 LYS 64 -1.774 -9.853 3.844 555 HZ2 LYS 64 HZ2 LYS 64 -1.406 -9.474 2.238 556 HZ3 LYS 64 HZ3 LYS 64 -2.333 -10.840 2.589 557 H ASN 65 HN ASN 65 -4.996 -4.561 6.396 558 HA ASN 65 HA ASN 65 -6.631 -6.741 7.175 559 HB2 ASN 65 HB2 ASN 65 -5.149 -4.608 8.668 560 HB3 ASN 65 HB1 ASN 65 -6.287 -5.636 9.526 561 HD21 ASN 65 HD21 ASN 65 -4.350 -6.675 6.811 562 HD22 ASN 65 HD22 ASN 65 -3.342 -7.762 7.695 563 H ALA 66 HN ALA 66 -7.118 -3.260 7.092 564 HA ALA 66 HA ALA 66 -9.552 -3.167 8.481 565 HB1 ALA 66 HB1 ALA 66 -8.245 -1.167 7.948 566 HB2 ALA 66 HB2 ALA 66 -9.909 -1.019 7.378 567 HB3 ALA 66 HB3 ALA 66 -8.614 -1.383 6.236 568 H LEU 67 HN LEU 67 -8.826 -3.587 5.046 569 HA LEU 67 HA LEU 67 -11.480 -3.731 4.137 570 HB2 LEU 67 HB2 LEU 67 -9.593 -3.342 2.656 571 HB3 LEU 67 HB1 LEU 67 -8.955 -4.933 3.005 572 HG LEU 67 HG LEU 67 -10.791 -5.985 1.839 573 HD11 LEU 67 HD11 LEU 67 -12.608 -4.505 2.377 574 HD12 LEU 67 HD12 LEU 67 -12.458 -4.615 0.624 575 HD13 LEU 67 HD13 LEU 67 -11.856 -3.192 1.472 576 HD21 LEU 67 HD21 LEU 67 -9.596 -3.712 0.264 577 HD22 LEU 67 HD22 LEU 67 -10.366 -5.138 -0.426 578 HD23 LEU 67 HD23 LEU 67 -8.881 -5.305 0.509 579 H GLN 68 HN GLN 68 -9.225 -6.255 5.205 580 HA GLN 68 HA GLN 68 -11.053 -8.379 4.671 581 HB2 GLN 68 HB2 GLN 68 -8.560 -8.611 4.778 582 HB3 GLN 68 HB1 GLN 68 -8.664 -8.407 6.520 583 HG2 GLN 68 HG2 GLN 68 -9.921 -10.433 6.744 584 HG3 GLN 68 HG1 GLN 68 -10.040 -10.601 4.992 585 HE21 GLN 68 HE21 GLN 68 -8.261 -11.280 3.825 586 HE22 GLN 68 HE22 GLN 68 -6.877 -11.994 4.575 587 H LYS 69 HN LYS 69 -10.523 -6.221 7.333 588 HA LYS 69 HA LYS 69 -12.038 -7.693 9.267 589 HB2 LYS 69 HB2 LYS 69 -10.373 -5.931 9.871 590 HB3 LYS 69 HB1 LYS 69 -11.429 -4.727 9.150 591 HG2 LYS 69 HG2 LYS 69 -13.169 -5.331 10.807 592 HG3 LYS 69 HG1 LYS 69 -12.007 -6.414 11.572 593 HD2 LYS 69 HD2 LYS 69 -10.504 -4.513 11.956 594 HD3 LYS 69 HD1 LYS 69 -11.683 -3.435 11.210 595 HE2 LYS 69 HE2 LYS 69 -13.307 -4.050 12.961 596 HE3 LYS 69 HE1 LYS 69 -12.079 -5.062 13.721 597 HZ1 LYS 69 HZ1 LYS 69 -12.207 -2.922 14.795 598 HZ2 LYS 69 HZ2 LYS 69 -11.919 -2.124 13.334 599 HZ3 LYS 69 HZ3 LYS 69 -10.710 -3.083 14.024 600 H LEU 70 HN LEU 70 -12.736 -5.555 6.664 601 HA LEU 70 HA LEU 70 -15.458 -5.025 7.426 602 HB2 LEU 70 HB2 LEU 70 -13.787 -3.706 5.844 603 HB3 LEU 70 HB1 LEU 70 -14.456 -4.764 4.620 604 HG LEU 70 HG LEU 70 -16.188 -3.011 6.354 605 HD11 LEU 70 HD11 LEU 70 -15.060 -2.391 3.628 606 HD12 LEU 70 HD12 LEU 70 -14.574 -1.623 5.140 607 HD13 LEU 70 HD13 LEU 70 -16.215 -1.412 4.533 608 HD21 LEU 70 HD21 LEU 70 -17.802 -3.312 4.558 609 HD22 LEU 70 HD22 LEU 70 -17.307 -4.868 5.224 610 HD23 LEU 70 HD23 LEU 70 -16.656 -4.321 3.680 611 H SER 71 HN SER 71 -15.758 -7.367 7.856 612 HA SER 71 HA SER 71 -15.955 -9.100 5.542 613 HB2 SER 71 HB2 SER 71 -16.489 -9.647 8.472 614 HB3 SER 71 HB1 SER 71 -16.408 -10.864 7.201 615 HG SER 71 HG SER 71 -14.184 -9.446 7.045 616 H LYS 72 HN LYS 72 -17.729 -8.195 4.415 617 HA LYS 72 HA LYS 72 -20.334 -8.524 5.741 618 HB2 LYS 72 HB2 LYS 72 -19.574 -7.069 3.190 619 HB3 LYS 72 HB1 LYS 72 -21.239 -7.341 3.686 620 HG2 LYS 72 HG2 LYS 72 -20.836 -6.047 5.746 621 HG3 LYS 72 HG1 LYS 72 -19.169 -5.761 5.233 622 HD2 LYS 72 HD2 LYS 72 -19.940 -4.536 3.284 623 HD3 LYS 72 HD1 LYS 72 -21.619 -4.906 3.677 624 HE2 LYS 72 HE2 LYS 72 -19.746 -3.279 5.398 625 HE3 LYS 72 HE1 LYS 72 -20.971 -2.614 4.320 626 HZ1 LYS 72 HZ1 LYS 72 -21.490 -4.371 6.655 627 HZ2 LYS 72 HZ2 LYS 72 -22.670 -3.741 5.623 628 HZ3 LYS 72 HZ3 LYS 72 -21.755 -2.705 6.596 629 H ALA 73 HN ALA 73 -19.099 -10.836 5.293 630 HA ALA 73 HA ALA 73 -19.613 -11.993 2.739 631 HB1 ALA 73 HB1 ALA 73 -19.063 -13.362 5.363 632 HB2 ALA 73 HB2 ALA 73 -17.833 -12.782 4.239 633 HB3 ALA 73 HB3 ALA 73 -18.930 -14.076 3.755 634 H ASP 74 HN ASP 74 -21.616 -11.189 5.281 635 HA ASP 74 HA ASP 74 -23.529 -13.323 4.951 636 HB2 ASP 74 HB2 ASP 74 -24.923 -12.055 6.506 637 HB3 ASP 74 HB1 ASP 74 -23.279 -12.157 7.126 638 H GLU 75 HN GLU 75 -22.578 -10.955 3.027 639 HA GLU 75 HA GLU 75 -23.326 -10.374 0.969 640 HB2 GLU 75 HB2 GLU 75 -24.718 -12.385 0.899 641 HB3 GLU 75 HB1 GLU 75 -25.986 -11.544 1.779 642 HG2 GLU 75 HG2 GLU 75 -26.192 -9.950 -0.073 643 HG3 GLU 75 HG1 GLU 75 -24.953 -10.839 -0.956 644 H SER 76 HN SER 76 -23.219 -8.263 0.911 645 HA SER 76 HA SER 76 -25.317 -6.687 2.220 646 HB2 SER 76 HB2 SER 76 -23.698 -4.768 1.718 647 HB3 SER 76 HB1 SER 76 -23.165 -5.950 2.914 648 HG SER 76 HG SER 76 -21.532 -5.453 1.354 649 H ALA 77 HN ALA 77 -23.362 -6.499 -0.755 650 HA ALA 77 HA ALA 77 -25.699 -6.456 -2.424 651 HB1 ALA 77 HB1 ALA 77 -24.030 -3.955 -2.245 652 HB2 ALA 77 HB2 ALA 77 -25.679 -4.138 -1.648 653 HB3 ALA 77 HB3 ALA 77 -25.349 -4.246 -3.377 654 HA PRO 78 HA PRO 78 -21.655 -7.741 -4.398 655 HB2 PRO 78 HB2 PRO 78 -21.961 -10.395 -4.499 656 HB3 PRO 78 HB1 PRO 78 -21.425 -9.597 -3.015 657 HG2 PRO 78 HG2 PRO 78 -24.119 -10.660 -3.732 658 HG3 PRO 78 HG1 PRO 78 -23.267 -10.713 -2.178 659 HD2 PRO 78 HD2 PRO 78 -25.245 -8.875 -2.861 660 HD3 PRO 78 HD1 PRO 78 -24.063 -8.668 -1.558 661 H VAL 79 HN VAL 79 -23.457 -6.532 -5.845 662 HA VAL 79 HA VAL 79 -24.936 -8.198 -7.628 663 HB VAL 79 HB VAL 79 -24.243 -5.273 -7.896 664 HG11 VAL 79 HG11 VAL 79 -26.382 -6.906 -9.250 665 HG12 VAL 79 HG12 VAL 79 -24.934 -6.254 -10.016 666 HG13 VAL 79 HG13 VAL 79 -26.172 -5.161 -9.395 667 HG21 VAL 79 HG21 VAL 79 -26.500 -4.889 -6.993 668 HG22 VAL 79 HG22 VAL 79 -25.425 -5.676 -5.837 669 HG23 VAL 79 HG23 VAL 79 -26.647 -6.620 -6.689 670 H ALA 80 HN ALA 80 -22.216 -5.962 -8.279 671 HA ALA 80 HA ALA 80 -20.919 -7.924 -9.929 672 HB1 ALA 80 HB1 ALA 80 -20.971 -6.646 -12.000 673 HB2 ALA 80 HB2 ALA 80 -22.006 -5.439 -11.241 674 HB3 ALA 80 HB3 ALA 80 -22.600 -7.079 -11.487 675 H ASN 81 HN ASN 81 -21.050 -4.386 -9.481 676 HA ASN 81 HA ASN 81 -18.280 -3.996 -9.823 677 HB2 ASN 81 HB2 ASN 81 -20.329 -2.273 -8.413 678 HB3 ASN 81 HB1 ASN 81 -18.681 -1.763 -8.752 679 HD21 ASN 81 HD21 ASN 81 -21.264 -0.701 -9.653 680 HD22 ASN 81 HD22 ASN 81 -21.186 -0.694 -11.381 681 H TYR 82 HN TYR 82 -20.244 -4.616 -6.985 682 HA TYR 82 HA TYR 82 -18.438 -3.919 -4.981 683 HB2 TYR 82 HB2 TYR 82 -20.911 -4.604 -4.785 684 HB3 TYR 82 HB1 TYR 82 -20.340 -6.266 -4.790 685 HD1 TYR 82 HD1 TYR 82 -18.640 -6.916 -2.911 686 HD2 TYR 82 HD2 TYR 82 -21.058 -3.407 -2.810 687 HE1 TYR 82 HE1 TYR 82 -18.352 -6.788 -0.475 688 HE2 TYR 82 HE2 TYR 82 -20.760 -3.270 -0.374 689 HH TYR 82 HH TYR 82 -18.475 -5.207 1.314 690 H ASN 83 HN ASN 83 -18.759 -6.922 -6.818 691 HA ASN 83 HA ASN 83 -16.866 -8.393 -5.275 692 HB2 ASN 83 HB2 ASN 83 -17.959 -8.851 -8.063 693 HB3 ASN 83 HB1 ASN 83 -16.907 -9.983 -7.221 694 HD21 ASN 83 HD21 ASN 83 -18.457 -11.600 -7.264 695 HD22 ASN 83 HD22 ASN 83 -19.865 -11.555 -6.264 696 H GLN 84 HN GLN 84 -16.743 -6.641 -8.325 697 HA GLN 84 HA GLN 84 -14.088 -7.381 -8.965 698 HB2 GLN 84 HB2 GLN 84 -15.790 -5.089 -9.955 699 HB3 GLN 84 HB1 GLN 84 -14.250 -5.561 -10.661 700 HG2 GLN 84 HG2 GLN 84 -15.155 -7.720 -11.271 701 HG3 GLN 84 HG1 GLN 84 -16.681 -7.327 -10.481 702 HE21 GLN 84 HE21 GLN 84 -18.069 -5.864 -11.437 703 HE22 GLN 84 HE22 GLN 84 -17.928 -5.396 -13.097 704 H ARG 85 HN ARG 85 -15.499 -4.454 -7.549 705 HA ARG 85 HA ARG 85 -13.098 -2.977 -7.486 706 HB2 ARG 85 HB2 ARG 85 -15.581 -2.695 -5.789 707 HB3 ARG 85 HB1 ARG 85 -14.275 -1.521 -5.849 708 HG2 ARG 85 HG2 ARG 85 -14.703 -1.168 -8.232 709 HG3 ARG 85 HG1 ARG 85 -16.026 -2.333 -8.161 710 HD2 ARG 85 HD2 ARG 85 -17.147 -0.920 -6.484 711 HD3 ARG 85 HD1 ARG 85 -15.841 0.254 -6.625 712 HE ARG 85 HE ARG 85 -16.728 0.009 -9.171 713 HH11 ARG 85 HH11 ARG 85 -18.295 0.669 -6.113 714 HH12 ARG 85 HH12 ARG 85 -19.554 1.633 -6.816 715 HH21 ARG 85 HH21 ARG 85 -18.392 1.291 -10.106 716 HH22 ARG 85 HH22 ARG 85 -19.606 1.992 -9.084 717 H LYS 86 HN LYS 86 -14.600 -5.146 -5.146 718 HA LYS 86 HA LYS 86 -12.898 -4.606 -2.983 719 HB2 LYS 86 HB2 LYS 86 -14.857 -5.855 -2.525 720 HB3 LYS 86 HB1 LYS 86 -14.491 -7.042 -3.776 721 HG2 LYS 86 HG2 LYS 86 -12.520 -7.769 -2.416 722 HG3 LYS 86 HG1 LYS 86 -13.066 -6.679 -1.136 723 HD2 LYS 86 HD2 LYS 86 -14.656 -8.995 -2.255 724 HD3 LYS 86 HD1 LYS 86 -13.738 -9.018 -0.752 725 HE2 LYS 86 HE2 LYS 86 -15.150 -7.171 0.100 726 HE3 LYS 86 HE1 LYS 86 -16.116 -7.263 -1.374 727 HZ1 LYS 86 HZ1 LYS 86 -17.142 -8.495 0.419 728 HZ2 LYS 86 HZ2 LYS 86 -15.754 -9.444 0.608 729 HZ3 LYS 86 HZ3 LYS 86 -16.666 -9.553 -0.810 730 H GLU 87 HN GLU 87 -12.650 -6.974 -5.609 731 HA GLU 87 HA GLU 87 -10.219 -8.111 -4.653 732 HB2 GLU 87 HB2 GLU 87 -11.647 -8.277 -7.300 733 HB3 GLU 87 HB1 GLU 87 -10.129 -9.106 -6.990 734 HG2 GLU 87 HG2 GLU 87 -11.176 -10.334 -5.154 735 HG3 GLU 87 HG1 GLU 87 -12.698 -9.505 -5.468 736 H GLU 88 HN GLU 88 -11.016 -5.547 -6.922 737 HA GLU 88 HA GLU 88 -8.536 -5.258 -8.171 738 HB2 GLU 88 HB2 GLU 88 -10.722 -3.286 -7.572 739 HB3 GLU 88 HB1 GLU 88 -9.259 -2.809 -8.419 740 HG2 GLU 88 HG2 GLU 88 -11.235 -4.898 -9.309 741 HG3 GLU 88 HG1 GLU 88 -11.039 -3.281 -9.984 742 H GLU 89 HN GLU 89 -9.715 -3.886 -5.124 743 HA GLU 89 HA GLU 89 -7.393 -2.308 -4.693 744 HB2 GLU 89 HB2 GLU 89 -9.405 -3.306 -2.669 745 HB3 GLU 89 HB1 GLU 89 -8.211 -2.044 -2.395 746 HG2 GLU 89 HG2 GLU 89 -10.584 -1.966 -4.237 747 HG3 GLU 89 HG1 GLU 89 -10.282 -0.974 -2.812 748 H HIS 90 HN HIS 90 -8.312 -5.596 -3.786 749 HA HIS 90 HA HIS 90 -6.058 -6.188 -2.198 750 HB2 HIS 90 HB2 HIS 90 -7.929 -7.866 -3.834 751 HB3 HIS 90 HB1 HIS 90 -6.437 -8.591 -3.250 752 HD1 HIS 90 HD1 HIS 90 -6.468 -9.495 -0.939 753 HD2 HIS 90 HD2 HIS 90 -9.610 -6.868 -1.646 754 HE1 HIS 90 HE1 HIS 90 -7.931 -9.623 1.105 755 HE2 HIS 90 HE2 HIS 90 -9.917 -8.175 0.565 756 H THR 91 HN THR 91 -6.623 -6.465 -5.678 757 HA THR 91 HA THR 91 -4.188 -7.584 -6.432 758 HB THR 91 HB THR 91 -5.843 -5.617 -8.033 759 HG1 THR 91 HG1 THR 91 -6.939 -7.517 -8.757 760 HG21 THR 91 HG21 THR 91 -3.699 -6.113 -9.061 761 HG22 THR 91 HG22 THR 91 -4.998 -6.887 -9.966 762 HG23 THR 91 HG23 THR 91 -3.990 -7.842 -8.880 763 H LEU 92 HN LEU 92 -5.110 -4.183 -6.020 764 HA LEU 92 HA LEU 92 -2.643 -3.135 -6.991 765 HB2 LEU 92 HB2 LEU 92 -4.642 -1.787 -7.051 766 HB3 LEU 92 HB1 LEU 92 -4.830 -1.907 -5.313 767 HG LEU 92 HG LEU 92 -2.707 -0.627 -5.044 768 HD11 LEU 92 HD11 LEU 92 -1.850 0.613 -6.978 769 HD12 LEU 92 HD12 LEU 92 -2.954 -0.276 -8.028 770 HD13 LEU 92 HD13 LEU 92 -1.668 -1.130 -7.174 771 HD21 LEU 92 HD21 LEU 92 -3.681 1.535 -5.622 772 HD22 LEU 92 HD22 LEU 92 -4.881 0.466 -4.895 773 HD23 LEU 92 HD23 LEU 92 -4.875 0.729 -6.638 774 H LEU 93 HN LEU 93 -3.979 -3.560 -3.707 775 HA LEU 93 HA LEU 93 -1.767 -2.367 -2.416 776 HB2 LEU 93 HB2 LEU 93 -3.838 -4.262 -1.308 777 HB3 LEU 93 HB1 LEU 93 -2.701 -3.341 -0.346 778 HG LEU 93 HG LEU 93 -4.872 -2.178 -2.091 779 HD11 LEU 93 HD11 LEU 93 -5.901 -1.524 0.027 780 HD12 LEU 93 HD12 LEU 93 -4.628 -2.367 0.910 781 HD13 LEU 93 HD13 LEU 93 -5.751 -3.276 -0.103 782 HD21 LEU 93 HD21 LEU 93 -4.259 -0.046 -1.027 783 HD22 LEU 93 HD22 LEU 93 -2.946 -0.706 -2.001 784 HD23 LEU 93 HD23 LEU 93 -2.894 -0.843 -0.244 785 H ASP 94 HN ASP 94 -2.460 -5.683 -3.355 786 HA ASP 94 HA ASP 94 -0.486 -6.850 -1.674 787 HB2 ASP 94 HB2 ASP 94 -2.361 -8.157 -2.682 788 HB3 ASP 94 HB1 ASP 94 -1.583 -7.993 -4.256 789 H LYS 95 HN LYS 95 -0.428 -5.882 -5.132 790 HA LYS 95 HA LYS 95 2.203 -6.633 -5.632 791 HB2 LYS 95 HB2 LYS 95 0.529 -5.878 -7.339 792 HB3 LYS 95 HB1 LYS 95 0.767 -4.229 -6.776 793 HG2 LYS 95 HG2 LYS 95 3.202 -4.491 -7.358 794 HG3 LYS 95 HG1 LYS 95 2.775 -6.020 -8.129 795 HD2 LYS 95 HD2 LYS 95 2.810 -4.383 -9.845 796 HD3 LYS 95 HD1 LYS 95 1.115 -4.734 -9.519 797 HE2 LYS 95 HE2 LYS 95 0.975 -2.717 -8.126 798 HE3 LYS 95 HE1 LYS 95 2.667 -2.366 -8.469 799 HZ1 LYS 95 HZ1 LYS 95 2.084 -2.214 -10.832 800 HZ2 LYS 95 HZ2 LYS 95 1.257 -1.074 -9.895 801 HZ3 LYS 95 HZ3 LYS 95 0.457 -2.458 -10.444 802 H LEU 96 HN LEU 96 0.893 -3.554 -4.455 803 HA LEU 96 HA LEU 96 3.293 -2.168 -4.220 804 HB2 LEU 96 HB2 LEU 96 0.890 -1.973 -2.403 805 HB3 LEU 96 HB1 LEU 96 2.172 -0.786 -2.531 806 HG LEU 96 HG LEU 96 0.262 -1.525 -4.752 807 HD11 LEU 96 HD11 LEU 96 -0.667 0.715 -4.390 808 HD12 LEU 96 HD12 LEU 96 0.393 0.921 -2.995 809 HD13 LEU 96 HD13 LEU 96 -0.864 -0.316 -2.971 810 HD21 LEU 96 HD21 LEU 96 2.422 -0.831 -5.613 811 HD22 LEU 96 HD22 LEU 96 2.391 0.602 -4.585 812 HD23 LEU 96 HD23 LEU 96 1.217 0.428 -5.889 813 H THR 97 HN THR 97 1.698 -4.269 -1.835 814 HA THR 97 HA THR 97 3.594 -4.109 0.196 815 HB THR 97 HB THR 97 2.032 -6.578 -0.602 816 HG1 THR 97 HG1 THR 97 0.711 -4.673 -0.246 817 HG21 THR 97 HG21 THR 97 3.147 -5.730 2.074 818 HG22 THR 97 HG22 THR 97 3.827 -6.982 1.034 819 HG23 THR 97 HG23 THR 97 2.226 -7.197 1.743 820 H GLN 98 HN GLN 98 3.489 -6.199 -2.656 821 HA GLN 98 HA GLN 98 5.721 -7.788 -1.981 822 HB2 GLN 98 HB2 GLN 98 3.955 -8.378 -3.644 823 HB3 GLN 98 HB1 GLN 98 4.639 -7.184 -4.735 824 HG2 GLN 98 HG2 GLN 98 6.772 -8.447 -4.690 825 HG3 GLN 98 HG1 GLN 98 5.968 -9.685 -3.724 826 HE21 GLN 98 HE21 GLN 98 6.264 -8.224 -6.844 827 HE22 GLN 98 HE22 GLN 98 5.357 -9.408 -7.719 828 H GLN 99 HN GLN 99 5.375 -4.845 -3.914 829 HA GLN 99 HA GLN 99 8.017 -4.752 -4.893 830 HB2 GLN 99 HB2 GLN 99 6.059 -2.503 -4.391 831 HB3 GLN 99 HB1 GLN 99 7.561 -2.333 -5.285 832 HG2 GLN 99 HG2 GLN 99 5.250 -4.105 -6.049 833 HG3 GLN 99 HG1 GLN 99 5.643 -2.546 -6.770 834 HE21 GLN 99 HE21 GLN 99 5.450 -5.191 -7.989 835 HE22 GLN 99 HE22 GLN 99 6.981 -5.484 -8.735 836 H LEU 100 HN LEU 100 6.517 -3.299 -2.028 837 HA LEU 100 HA LEU 100 8.848 -1.960 -1.135 838 HB2 LEU 100 HB2 LEU 100 6.458 -2.917 0.445 839 HB3 LEU 100 HB1 LEU 100 7.670 -1.795 1.031 840 HG LEU 100 HG LEU 100 5.685 -1.316 -1.191 841 HD11 LEU 100 HD11 LEU 100 4.828 0.406 0.292 842 HD12 LEU 100 HD12 LEU 100 6.040 -0.015 1.502 843 HD13 LEU 100 HD13 LEU 100 4.781 -1.173 1.074 844 HD21 LEU 100 HD21 LEU 100 7.922 0.440 -0.191 845 HD22 LEU 100 HD22 LEU 100 6.629 0.961 -1.271 846 HD23 LEU 100 HD23 LEU 100 7.774 -0.271 -1.799 847 H GLN 101 HN GLN 101 7.462 -5.117 -0.485 848 HA GLN 101 HA GLN 101 9.247 -5.949 1.514 849 HB2 GLN 101 HB2 GLN 101 7.106 -7.062 0.991 850 HB3 GLN 101 HB1 GLN 101 7.752 -7.589 -0.552 851 HG2 GLN 101 HG2 GLN 101 9.063 -8.394 2.014 852 HG3 GLN 101 HG1 GLN 101 7.646 -9.248 1.411 853 HE21 GLN 101 HE21 GLN 101 10.342 -10.229 1.801 854 HE22 GLN 101 HE22 GLN 101 10.886 -10.798 0.258 855 H GLY 102 HN GLY 102 9.355 -6.195 -2.017 856 HA2 GLY 102 HA2 GLY 102 11.757 -7.676 -2.178 857 HA3 GLY 102 HA1 GLY 102 11.068 -6.692 -3.459 858 H LEU 103 HN LEU 103 11.124 -4.184 -2.330 859 HA LEU 103 HA LEU 103 13.800 -3.419 -2.789 860 HB2 LEU 103 HB2 LEU 103 11.924 -1.914 -3.205 861 HB3 LEU 103 HB1 LEU 103 11.526 -1.898 -1.498 862 HG LEU 103 HG LEU 103 13.667 -0.753 -1.019 863 HD11 LEU 103 HD11 LEU 103 13.965 -0.722 -4.020 864 HD12 LEU 103 HD12 LEU 103 14.980 -1.603 -2.878 865 HD13 LEU 103 HD13 LEU 103 14.975 0.161 -2.876 866 HD21 LEU 103 HD21 LEU 103 11.947 0.587 -3.103 867 HD22 LEU 103 HD22 LEU 103 13.057 1.406 -2.005 868 HD23 LEU 103 HD23 LEU 103 11.650 0.558 -1.365 869 H ALA 104 HN ALA 104 11.899 -3.747 0.171 870 HA ALA 104 HA ALA 104 13.756 -2.752 1.989 871 HB1 ALA 104 HB1 ALA 104 12.515 -4.074 3.675 872 HB2 ALA 104 HB2 ALA 104 11.648 -4.877 2.367 873 HB3 ALA 104 HB3 ALA 104 11.462 -3.140 2.616 874 H VAL 105 HN VAL 105 13.255 -6.088 0.863 875 HA VAL 105 HA VAL 105 15.333 -7.179 2.453 876 HB VAL 105 HB VAL 105 13.952 -8.264 0.005 877 HG11 VAL 105 HG11 VAL 105 16.163 -9.267 0.160 878 HG12 VAL 105 HG12 VAL 105 14.917 -10.438 0.592 879 HG13 VAL 105 HG13 VAL 105 15.875 -9.666 1.854 880 HG21 VAL 105 HG21 VAL 105 12.494 -8.043 1.901 881 HG22 VAL 105 HG22 VAL 105 13.677 -8.827 2.947 882 HG23 VAL 105 HG23 VAL 105 12.883 -9.748 1.672 883 H THR 106 HN THR 106 15.207 -5.941 -0.849 884 HA THR 106 HA THR 106 17.752 -6.788 -1.660 885 HB THR 106 HB THR 106 16.193 -4.351 -2.537 886 HG1 THR 106 HG1 THR 106 15.023 -6.128 -3.087 887 HG21 THR 106 HG21 THR 106 17.559 -4.423 -4.564 888 HG22 THR 106 HG22 THR 106 18.504 -5.749 -3.888 889 HG23 THR 106 HG23 THR 106 18.561 -4.154 -3.139 890 H ILE 107 HN ILE 107 16.716 -3.893 0.088 891 HA ILE 107 HA ILE 107 19.328 -2.721 0.152 892 HB ILE 107 HB ILE 107 16.931 -2.153 1.900 893 HG12 ILE 107 HG12 ILE 107 17.902 -0.671 -0.553 894 HG13 ILE 107 HG11 ILE 107 16.559 -1.810 -0.552 895 HG21 ILE 107 HG21 ILE 107 19.478 -0.610 1.455 896 HG22 ILE 107 HG22 ILE 107 18.923 -1.345 2.959 897 HG23 ILE 107 HG23 ILE 107 18.057 0.032 2.277 898 HD11 ILE 107 HD11 ILE 107 16.697 0.761 1.005 899 HD12 ILE 107 HD12 ILE 107 15.352 -0.382 1.013 900 HD13 ILE 107 HD13 ILE 107 15.771 0.480 -0.470 901 H SER 108 HN SER 108 17.495 -4.886 2.201 902 HA SER 108 HA SER 108 19.303 -4.711 4.423 903 HB2 SER 108 HB2 SER 108 16.963 -5.256 4.815 904 HB3 SER 108 HB1 SER 108 17.092 -6.687 3.797 905 HG SER 108 HG SER 108 18.658 -7.478 5.323 906 H ARG 109 HN ARG 109 19.289 -6.350 1.466 907 HA ARG 109 HA ARG 109 20.811 -8.638 2.335 908 HB2 ARG 109 HB2 ARG 109 19.118 -8.780 0.528 909 HB3 ARG 109 HB1 ARG 109 20.095 -7.696 -0.447 910 HG2 ARG 109 HG2 ARG 109 21.845 -9.329 -0.608 911 HG3 ARG 109 HG1 ARG 109 20.998 -10.400 0.513 912 HD2 ARG 109 HD2 ARG 109 20.709 -11.058 -1.853 913 HD3 ARG 109 HD1 ARG 109 19.188 -10.680 -1.050 914 HE ARG 109 HE ARG 109 20.560 -8.740 -2.796 915 HH11 ARG 109 HH11 ARG 109 17.667 -10.496 -1.848 916 HH12 ARG 109 HH12 ARG 109 16.636 -9.624 -2.936 917 HH21 ARG 109 HH21 ARG 109 19.199 -7.607 -4.224 918 HH22 ARG 109 HH22 ARG 109 17.504 -7.981 -4.286 919 H GLU 110 HN GLU 110 22.430 -7.073 3.270 920 HA GLU 110 HA GLU 110 24.425 -6.325 1.242 921 HB2 GLU 110 HB2 GLU 110 23.615 -4.861 3.749 922 HB3 GLU 110 HB1 GLU 110 25.080 -4.490 2.852 923 HG2 GLU 110 HG2 GLU 110 22.302 -4.374 1.714 924 HG3 GLU 110 HG1 GLU 110 23.197 -2.989 2.340 925 H ASN 111 HN ASN 111 24.416 -8.826 2.462 926 HA ASN 111 HA ASN 111 26.522 -8.637 4.496 927 HB2 ASN 111 HB2 ASN 111 24.487 -10.091 4.928 928 HB3 ASN 111 HB1 ASN 111 25.051 -11.138 3.629 929 HD21 ASN 111 HD21 ASN 111 25.379 -12.894 4.965 930 HD22 ASN 111 HD22 ASN 111 26.665 -12.962 6.116 931 H ILE 112 HN ILE 112 27.485 -7.847 2.195 932 HA ILE 112 HA ILE 112 28.879 -10.174 1.065 933 HB ILE 112 HB ILE 112 28.654 -7.471 -0.246 934 HG12 ILE 112 HG12 ILE 112 26.978 -9.930 -0.784 935 HG13 ILE 112 HG11 ILE 112 26.408 -8.507 0.066 936 HG21 ILE 112 HG21 ILE 112 29.333 -8.675 -2.244 937 HG22 ILE 112 HG22 ILE 112 29.363 -10.188 -1.337 938 HG23 ILE 112 HG23 ILE 112 30.513 -8.908 -0.953 939 HD11 ILE 112 HD11 ILE 112 25.660 -8.522 -2.242 940 HD12 ILE 112 HD12 ILE 112 27.333 -8.600 -2.794 941 HD13 ILE 112 HD13 ILE 112 26.749 -7.169 -1.945 942 H THR 113 HN THR 113 30.372 -10.149 2.805 943 HA THR 113 HA THR 113 32.223 -7.872 2.853 944 HB THR 113 HB THR 113 32.093 -10.206 4.777 945 HG1 THR 113 HG1 THR 113 30.924 -7.603 4.928 946 HG21 THR 113 HG21 THR 113 33.415 -7.500 5.022 947 HG22 THR 113 HG22 THR 113 34.247 -9.028 4.734 948 HG23 THR 113 HG23 THR 113 33.393 -8.760 6.253 949 H GLU 114 HN GLU 114 33.389 -8.317 0.988 950 HA GLU 114 HA GLU 114 35.097 -9.167 -0.235 951 HB2 GLU 114 HB2 GLU 114 35.553 -10.562 2.358 952 HB3 GLU 114 HB1 GLU 114 36.419 -11.127 0.945 953 HG2 GLU 114 HG2 GLU 114 37.630 -9.472 2.390 954 HG3 GLU 114 HG1 GLU 114 37.536 -9.070 0.680 955 H VAL 115 HN VAL 115 35.181 -10.592 -1.883 956 HA VAL 115 HA VAL 115 33.023 -12.548 -1.944 957 HB VAL 115 HB VAL 115 33.464 -12.707 -4.359 958 HG11 VAL 115 HG11 VAL 115 31.888 -11.051 -3.513 959 HG12 VAL 115 HG12 VAL 115 32.719 -10.460 -4.953 960 HG13 VAL 115 HG13 VAL 115 33.195 -9.877 -3.358 961 HG21 VAL 115 HG21 VAL 115 35.042 -11.182 -5.435 962 HG22 VAL 115 HG22 VAL 115 35.870 -12.287 -4.340 963 HG23 VAL 115 HG23 VAL 115 35.581 -10.618 -3.855 964 H GLY 116 HN GLY 116 36.380 -12.478 -1.476 965 HA2 GLY 116 HA2 GLY 116 36.937 -15.095 -2.563 966 HA3 GLY 116 HA1 GLY 116 38.045 -14.085 -1.647 967 H ALA 117 HN ALA 117 36.210 -16.872 -1.582 968 HA ALA 117 HA ALA 117 35.557 -16.939 1.183 969 HB1 ALA 117 HB1 ALA 117 35.842 -19.290 -0.679 970 HB2 ALA 117 HB2 ALA 117 34.387 -18.316 -0.491 971 HB3 ALA 117 HB3 ALA 117 34.999 -19.259 0.868 972 HA PRO 118 HA PRO 118 39.621 -19.434 1.768 973 HB2 PRO 118 HB2 PRO 118 41.273 -18.975 -0.592 974 HB3 PRO 118 HB1 PRO 118 40.803 -20.504 0.149 975 HG2 PRO 118 HG2 PRO 118 39.869 -19.697 -2.263 976 HG3 PRO 118 HG1 PRO 118 38.923 -20.710 -1.156 977 HD2 PRO 118 HD2 PRO 118 38.743 -17.759 -1.646 978 HD3 PRO 118 HD1 PRO 118 37.442 -18.945 -1.446 979 H THR 119 HN THR 119 40.557 -16.932 -0.591 980 HA THR 119 HA THR 119 41.181 -15.013 1.409 981 HB THR 119 HB THR 119 43.136 -16.367 1.796 982 HG1 THR 119 HG1 THR 119 43.656 -14.043 0.240 983 HG21 THR 119 HG21 THR 119 43.684 -16.198 -1.170 984 HG22 THR 119 HG22 THR 119 43.150 -17.634 -0.296 985 HG23 THR 119 HG23 THR 119 44.737 -16.938 0.037 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 -42.677 8.783 12.735 2 H2 GLY 1 HT2 GLY 1 -42.671 9.740 14.130 3 H3 GLY 1 HT3 GLY 1 -41.230 9.056 13.569 4 HA2 GLY 1 HA1 GLY 1 -42.823 11.120 12.157 5 HA3 GLY 1 HA2 GLY 1 -41.325 11.407 13.034 6 HA PRO 2 HA PRO 2 -40.653 9.528 8.625 7 HB2 PRO 2 HB2 PRO 2 -41.240 11.518 6.876 8 HB3 PRO 2 HB1 PRO 2 -42.416 10.297 7.369 9 HG2 PRO 2 HG2 PRO 2 -42.087 13.109 8.320 10 HG3 PRO 2 HG1 PRO 2 -43.575 12.209 7.976 11 HD2 PRO 2 HD2 PRO 2 -42.605 12.602 10.493 12 HD3 PRO 2 HD1 PRO 2 -43.583 11.197 10.033 13 H MET 3 HN MET 3 -38.551 9.595 8.198 14 HA MET 3 HA MET 3 -37.118 12.147 8.544 15 HB2 MET 3 HB2 MET 3 -36.091 9.310 8.757 16 HB3 MET 3 HB1 MET 3 -35.097 10.751 8.900 17 HG2 MET 3 HG2 MET 3 -36.365 11.435 10.871 18 HG3 MET 3 HG1 MET 3 -37.365 9.990 10.727 19 HE1 MET 3 HE1 MET 3 -32.857 9.927 11.717 20 HE2 MET 3 HE2 MET 3 -33.787 11.401 11.455 21 HE3 MET 3 HE3 MET 3 -33.475 10.304 10.110 22 H ALA 4 HN ALA 4 -36.315 13.068 6.781 23 HA ALA 4 HA ALA 4 -36.265 11.518 4.296 24 HB1 ALA 4 HB1 ALA 4 -37.576 13.581 4.282 25 HB2 ALA 4 HB2 ALA 4 -36.224 13.673 3.153 26 HB3 ALA 4 HB3 ALA 4 -36.134 14.504 4.706 27 H MET 5 HN MET 5 -34.155 12.424 6.682 28 HA MET 5 HA MET 5 -31.898 13.117 5.039 29 HB2 MET 5 HB2 MET 5 -31.999 13.952 7.316 30 HB3 MET 5 HB1 MET 5 -32.075 12.313 7.950 31 HG2 MET 5 HG2 MET 5 -29.856 13.291 8.211 32 HG3 MET 5 HG1 MET 5 -29.829 11.870 7.169 33 HE1 MET 5 HE1 MET 5 -27.445 12.470 6.209 34 HE2 MET 5 HE2 MET 5 -27.396 13.852 7.303 35 HE3 MET 5 HE3 MET 5 -27.013 14.067 5.594 36 H LEU 6 HN LEU 6 -30.366 11.808 4.212 37 HA LEU 6 HA LEU 6 -30.148 9.056 5.140 38 HB2 LEU 6 HB2 LEU 6 -31.785 9.003 3.276 39 HB3 LEU 6 HB1 LEU 6 -30.600 9.765 2.234 40 HG LEU 6 HG LEU 6 -29.126 7.784 2.523 41 HD11 LEU 6 HD11 LEU 6 -30.103 5.728 3.437 42 HD12 LEU 6 HD12 LEU 6 -31.521 6.641 3.950 43 HD13 LEU 6 HD13 LEU 6 -29.943 6.988 4.658 44 HD21 LEU 6 HD21 LEU 6 -31.889 7.197 1.470 45 HD22 LEU 6 HD22 LEU 6 -30.419 6.309 1.073 46 HD23 LEU 6 HD23 LEU 6 -30.591 7.993 0.582 47 H ALA 7 HN ALA 7 -28.077 8.381 5.135 48 HA ALA 7 HA ALA 7 -25.971 10.158 4.487 49 HB1 ALA 7 HB1 ALA 7 -25.762 8.480 6.246 50 HB2 ALA 7 HB2 ALA 7 -24.496 8.289 5.035 51 HB3 ALA 7 HB3 ALA 7 -25.880 7.197 5.044 52 H ARG 8 HN ARG 8 -25.734 10.724 2.383 53 HA ARG 8 HA ARG 8 -25.500 8.520 0.443 54 HB2 ARG 8 HB2 ARG 8 -26.512 11.322 -0.062 55 HB3 ARG 8 HB1 ARG 8 -26.278 10.091 -1.294 56 HG2 ARG 8 HG2 ARG 8 -27.928 8.665 -0.069 57 HG3 ARG 8 HG1 ARG 8 -28.252 10.050 0.975 58 HD2 ARG 8 HD2 ARG 8 -29.903 9.929 -0.798 59 HD3 ARG 8 HD1 ARG 8 -28.898 11.365 -0.996 60 HE ARG 8 HE ARG 8 -27.869 9.170 -2.483 61 HH11 ARG 8 HH11 ARG 8 -30.421 11.574 -2.524 62 HH12 ARG 8 HH12 ARG 8 -30.526 11.609 -4.257 63 HH21 ARG 8 HH21 ARG 8 -28.030 9.211 -4.765 64 HH22 ARG 8 HH22 ARG 8 -29.177 10.268 -5.522 65 H ARG 9 HN ARG 9 -23.815 10.879 2.057 66 HA ARG 9 HA ARG 9 -22.032 11.631 -0.062 67 HB2 ARG 9 HB2 ARG 9 -22.426 13.116 1.864 68 HB3 ARG 9 HB1 ARG 9 -21.703 11.918 2.929 69 HG2 ARG 9 HG2 ARG 9 -19.582 12.145 1.690 70 HG3 ARG 9 HG1 ARG 9 -20.320 13.419 0.718 71 HD2 ARG 9 HD2 ARG 9 -19.950 13.456 3.707 72 HD3 ARG 9 HD1 ARG 9 -18.980 14.349 2.536 73 HE ARG 9 HE ARG 9 -21.387 15.282 1.961 74 HH11 ARG 9 HH11 ARG 9 -19.915 14.724 5.087 75 HH12 ARG 9 HH12 ARG 9 -20.802 15.992 5.874 76 HH21 ARG 9 HH21 ARG 9 -22.554 16.948 2.981 77 HH22 ARG 9 HH22 ARG 9 -22.306 17.260 4.672 78 H GLN 10 HN GLN 10 -21.804 9.535 2.791 79 HA GLN 10 HA GLN 10 -19.663 8.065 1.413 80 HB2 GLN 10 HB2 GLN 10 -18.675 9.272 3.262 81 HB3 GLN 10 HB1 GLN 10 -19.910 8.679 4.364 82 HG2 GLN 10 HG2 GLN 10 -17.747 7.534 4.623 83 HG3 GLN 10 HG1 GLN 10 -19.062 6.439 4.200 84 HE21 GLN 10 HE21 GLN 10 -17.698 4.890 3.378 85 HE22 GLN 10 HE22 GLN 10 -16.869 5.084 1.872 86 H ARG 11 HN ARG 11 -20.617 6.294 0.691 87 HA ARG 11 HA ARG 11 -22.137 4.666 2.621 88 HB2 ARG 11 HB2 ARG 11 -22.633 4.925 -0.351 89 HB3 ARG 11 HB1 ARG 11 -23.428 3.766 0.701 90 HG2 ARG 11 HG2 ARG 11 -24.370 5.650 1.994 91 HG3 ARG 11 HG1 ARG 11 -23.657 6.762 0.824 92 HD2 ARG 11 HD2 ARG 11 -25.999 6.350 0.307 93 HD3 ARG 11 HD1 ARG 11 -24.957 5.709 -0.963 94 HE ARG 11 HE ARG 11 -25.307 3.552 0.579 95 HH11 ARG 11 HH11 ARG 11 -27.601 5.867 -0.674 96 HH12 ARG 11 HH12 ARG 11 -28.908 4.729 -0.743 97 HH21 ARG 11 HH21 ARG 11 -27.013 2.049 0.485 98 HH22 ARG 11 HH22 ARG 11 -28.577 2.556 -0.077 99 H ASP 12 HN ASP 12 -20.263 4.631 -0.369 100 HA ASP 12 HA ASP 12 -19.716 1.827 -0.263 101 HB2 ASP 12 HB2 ASP 12 -18.343 3.998 -1.878 102 HB3 ASP 12 HB1 ASP 12 -18.224 2.265 -2.163 103 HA PRO 13 HA PRO 13 -16.420 2.423 2.805 104 HB2 PRO 13 HB2 PRO 13 -16.127 -0.491 2.390 105 HB3 PRO 13 HB1 PRO 13 -16.402 0.403 3.887 106 HG2 PRO 13 HG2 PRO 13 -18.334 -1.080 2.779 107 HG3 PRO 13 HG1 PRO 13 -18.696 0.453 3.594 108 HD2 PRO 13 HD2 PRO 13 -18.505 -0.140 0.664 109 HD3 PRO 13 HD1 PRO 13 -19.663 0.890 1.535 110 H LEU 14 HN LEU 14 -16.368 0.644 -0.193 111 HA LEU 14 HA LEU 14 -13.568 0.402 -0.492 112 HB2 LEU 14 HB2 LEU 14 -15.679 0.585 -2.651 113 HB3 LEU 14 HB1 LEU 14 -14.045 -0.040 -2.842 114 HG LEU 14 HG LEU 14 -16.155 -1.275 -1.068 115 HD11 LEU 14 HD11 LEU 14 -16.234 -3.047 -2.773 116 HD12 LEU 14 HD12 LEU 14 -15.194 -2.070 -3.807 117 HD13 LEU 14 HD13 LEU 14 -16.805 -1.494 -3.379 118 HD21 LEU 14 HD21 LEU 14 -13.997 -1.806 -0.226 119 HD22 LEU 14 HD22 LEU 14 -13.377 -2.131 -1.844 120 HD23 LEU 14 HD23 LEU 14 -14.568 -3.214 -1.123 121 H GLN 15 HN GLN 15 -15.834 2.980 -1.223 122 HA GLN 15 HA GLN 15 -14.119 4.540 -2.837 123 HB2 GLN 15 HB2 GLN 15 -16.529 4.929 -2.771 124 HB3 GLN 15 HB1 GLN 15 -16.440 5.363 -1.072 125 HG2 GLN 15 HG2 GLN 15 -16.663 7.335 -2.442 126 HG3 GLN 15 HG1 GLN 15 -15.089 7.320 -1.648 127 HE21 GLN 15 HE21 GLN 15 -16.784 7.020 -4.661 128 HE22 GLN 15 HE22 GLN 15 -15.402 7.187 -5.685 129 H ALA 16 HN ALA 16 -14.818 4.606 0.640 130 HA ALA 16 HA ALA 16 -13.036 6.699 1.286 131 HB1 ALA 16 HB1 ALA 16 -13.262 5.908 3.597 132 HB2 ALA 16 HB2 ALA 16 -14.058 4.446 3.013 133 HB3 ALA 16 HB3 ALA 16 -14.825 6.018 2.789 134 H LEU 17 HN LEU 17 -12.706 3.175 1.314 135 HA LEU 17 HA LEU 17 -10.070 3.095 2.290 136 HB2 LEU 17 HB2 LEU 17 -11.529 1.138 2.258 137 HB3 LEU 17 HB1 LEU 17 -11.514 1.142 0.505 138 HG LEU 17 HG LEU 17 -9.053 0.737 0.579 139 HD11 LEU 17 HD11 LEU 17 -9.559 0.342 3.521 140 HD12 LEU 17 HD12 LEU 17 -8.586 1.617 2.790 141 HD13 LEU 17 HD13 LEU 17 -8.070 -0.063 2.669 142 HD21 LEU 17 HD21 LEU 17 -9.237 -1.614 1.134 143 HD22 LEU 17 HD22 LEU 17 -10.657 -1.074 0.240 144 HD23 LEU 17 HD23 LEU 17 -10.751 -1.311 1.985 145 H ARG 18 HN ARG 18 -11.336 3.154 -1.028 146 HA ARG 18 HA ARG 18 -8.898 2.862 -2.360 147 HB2 ARG 18 HB2 ARG 18 -10.926 2.627 -3.595 148 HB3 ARG 18 HB1 ARG 18 -11.449 4.250 -3.171 149 HG2 ARG 18 HG2 ARG 18 -9.939 5.247 -4.636 150 HG3 ARG 18 HG1 ARG 18 -8.966 3.784 -4.776 151 HD2 ARG 18 HD2 ARG 18 -11.804 4.030 -5.758 152 HD3 ARG 18 HD1 ARG 18 -10.382 4.279 -6.773 153 HE ARG 18 HE ARG 18 -10.079 1.801 -5.565 154 HH11 ARG 18 HH11 ARG 18 -12.344 3.319 -7.766 155 HH12 ARG 18 HH12 ARG 18 -12.703 1.843 -8.605 156 HH21 ARG 18 HH21 ARG 18 -10.549 -0.128 -6.650 157 HH22 ARG 18 HH22 ARG 18 -11.688 -0.115 -7.972 158 H ARG 19 HN ARG 19 -10.485 5.766 -1.120 159 HA ARG 19 HA ARG 19 -8.689 7.670 -2.120 160 HB2 ARG 19 HB2 ARG 19 -10.853 8.167 -0.970 161 HB3 ARG 19 HB1 ARG 19 -10.104 7.714 0.555 162 HG2 ARG 19 HG2 ARG 19 -8.416 9.523 0.154 163 HG3 ARG 19 HG1 ARG 19 -9.407 10.042 -1.212 164 HD2 ARG 19 HD2 ARG 19 -9.984 11.369 0.703 165 HD3 ARG 19 HD1 ARG 19 -11.325 10.284 0.336 166 HE ARG 19 HE ARG 19 -9.360 9.645 2.439 167 HH11 ARG 19 HH11 ARG 19 -12.676 10.048 1.373 168 HH12 ARG 19 HH12 ARG 19 -13.354 9.546 2.886 169 HH21 ARG 19 HH21 ARG 19 -10.252 8.988 4.429 170 HH22 ARG 19 HH22 ARG 19 -11.977 8.937 4.625 171 H ARG 20 HN ARG 20 -8.654 5.768 0.847 172 HA ARG 20 HA ARG 20 -6.197 6.758 1.844 173 HB2 ARG 20 HB2 ARG 20 -7.661 4.177 2.418 174 HB3 ARG 20 HB1 ARG 20 -6.288 4.776 3.342 175 HG2 ARG 20 HG2 ARG 20 -7.528 6.671 4.090 176 HG3 ARG 20 HG1 ARG 20 -8.862 6.294 3.001 177 HD2 ARG 20 HD2 ARG 20 -9.277 4.220 4.244 178 HD3 ARG 20 HD1 ARG 20 -7.950 4.615 5.341 179 HE ARG 20 HE ARG 20 -9.477 6.785 5.588 180 HH11 ARG 20 HH11 ARG 20 -10.333 3.391 5.634 181 HH12 ARG 20 HH12 ARG 20 -11.706 3.621 6.667 182 HH21 ARG 20 HH21 ARG 20 -11.283 7.092 6.953 183 HH22 ARG 20 HH22 ARG 20 -12.246 5.725 7.418 184 H ASN 21 HN ASN 21 -7.031 3.971 -0.180 185 HA ASN 21 HA ASN 21 -4.456 2.826 -0.230 186 HB2 ASN 21 HB2 ASN 21 -6.694 2.665 -2.263 187 HB3 ASN 21 HB1 ASN 21 -5.210 1.728 -2.364 188 HD21 ASN 21 HD21 ASN 21 -7.872 0.702 -2.177 189 HD22 ASN 21 HD22 ASN 21 -7.948 -0.205 -0.707 190 H GLN 22 HN GLN 22 -5.987 5.251 -2.317 191 HA GLN 22 HA GLN 22 -3.792 5.525 -4.080 192 HB2 GLN 22 HB2 GLN 22 -6.126 6.342 -4.528 193 HB3 GLN 22 HB1 GLN 22 -5.829 7.649 -3.387 194 HG2 GLN 22 HG2 GLN 22 -3.977 8.434 -4.787 195 HG3 GLN 22 HG1 GLN 22 -4.302 7.139 -5.933 196 HE21 GLN 22 HE21 GLN 22 -4.346 10.044 -6.307 197 HE22 GLN 22 HE22 GLN 22 -5.927 10.422 -6.890 198 H GLU 23 HN GLU 23 -4.522 6.801 -0.937 199 HA GLU 23 HA GLU 23 -2.636 8.918 -0.858 200 HB2 GLU 23 HB2 GLU 23 -4.502 8.612 0.770 201 HB3 GLU 23 HB1 GLU 23 -3.678 7.199 1.411 202 HG2 GLU 23 HG2 GLU 23 -3.215 8.937 2.904 203 HG3 GLU 23 HG1 GLU 23 -1.747 8.734 1.950 204 H LEU 24 HN LEU 24 -2.535 5.518 0.137 205 HA LEU 24 HA LEU 24 0.203 5.514 0.893 206 HB2 LEU 24 HB2 LEU 24 -1.641 3.253 0.114 207 HB3 LEU 24 HB1 LEU 24 -0.026 3.027 0.755 208 HG LEU 24 HG LEU 24 -2.228 4.441 2.266 209 HD11 LEU 24 HD11 LEU 24 -2.479 2.398 3.542 210 HD12 LEU 24 HD12 LEU 24 -1.273 1.595 2.543 211 HD13 LEU 24 HD13 LEU 24 -2.813 2.088 1.840 212 HD21 LEU 24 HD21 LEU 24 -0.776 4.123 4.179 213 HD22 LEU 24 HD22 LEU 24 0.082 5.003 2.916 214 HD23 LEU 24 HD23 LEU 24 0.407 3.291 3.172 215 H LYS 25 HN LYS 25 -1.509 4.737 -2.095 216 HA LYS 25 HA LYS 25 0.631 3.631 -3.517 217 HB2 LYS 25 HB2 LYS 25 -1.754 3.556 -4.220 218 HB3 LYS 25 HB1 LYS 25 -1.653 5.260 -4.642 219 HG2 LYS 25 HG2 LYS 25 0.013 4.767 -6.338 220 HG3 LYS 25 HG1 LYS 25 -0.018 3.058 -5.887 221 HD2 LYS 25 HD2 LYS 25 -2.385 2.947 -6.505 222 HD3 LYS 25 HD1 LYS 25 -2.341 4.648 -6.967 223 HE2 LYS 25 HE2 LYS 25 -0.703 2.447 -8.217 224 HE3 LYS 25 HE1 LYS 25 -2.156 3.162 -8.910 225 HZ1 LYS 25 HZ1 LYS 25 -0.211 4.137 -9.892 226 HZ2 LYS 25 HZ2 LYS 25 0.406 4.562 -8.377 227 HZ3 LYS 25 HZ3 LYS 25 -0.996 5.305 -8.953 228 H GLN 26 HN GLN 26 -0.395 6.997 -3.144 229 HA GLN 26 HA GLN 26 1.490 8.130 -4.918 230 HB2 GLN 26 HB2 GLN 26 -0.510 9.322 -4.031 231 HB3 GLN 26 HB1 GLN 26 0.260 9.382 -2.451 232 HG2 GLN 26 HG2 GLN 26 2.125 10.669 -3.489 233 HG3 GLN 26 HG1 GLN 26 1.181 10.728 -4.978 234 HE21 GLN 26 HE21 GLN 26 1.007 12.950 -4.947 235 HE22 GLN 26 HE22 GLN 26 0.015 13.790 -3.804 236 H GLN 27 HN GLN 27 1.612 7.178 -1.551 237 HA GLN 27 HA GLN 27 4.108 8.420 -0.966 238 HB2 GLN 27 HB2 GLN 27 2.467 6.297 0.393 239 HB3 GLN 27 HB1 GLN 27 4.046 6.772 1.002 240 HG2 GLN 27 HG2 GLN 27 3.309 8.994 1.414 241 HG3 GLN 27 HG1 GLN 27 1.797 8.715 0.556 242 HE21 GLN 27 HE21 GLN 27 0.141 7.614 1.583 243 HE22 GLN 27 HE22 GLN 27 0.157 7.276 3.278 244 H VAL 28 HN VAL 28 3.118 5.297 -2.228 245 HA VAL 28 HA VAL 28 5.610 3.980 -1.892 246 HB VAL 28 HB VAL 28 3.330 3.429 -3.807 247 HG11 VAL 28 HG11 VAL 28 4.342 1.211 -4.104 248 HG12 VAL 28 HG12 VAL 28 5.734 1.732 -3.156 249 HG13 VAL 28 HG13 VAL 28 5.383 2.501 -4.704 250 HG21 VAL 28 HG21 VAL 28 2.729 3.164 -1.455 251 HG22 VAL 28 HG22 VAL 28 4.121 2.109 -1.212 252 HG23 VAL 28 HG23 VAL 28 2.801 1.599 -2.265 253 H ASP 29 HN ASP 29 4.081 5.617 -4.671 254 HA ASP 29 HA ASP 29 6.250 5.299 -6.437 255 HB2 ASP 29 HB2 ASP 29 3.926 7.188 -6.354 256 HB3 ASP 29 HB1 ASP 29 5.221 7.448 -7.517 257 H SER 30 HN SER 30 5.522 7.788 -4.048 258 HA SER 30 HA SER 30 7.605 9.553 -4.788 259 HB2 SER 30 HB2 SER 30 5.620 10.091 -3.292 260 HB3 SER 30 HB1 SER 30 6.462 9.232 -2.003 261 HG SER 30 HG SER 30 8.223 10.726 -2.331 262 H LEU 31 HN LEU 31 7.434 6.808 -2.587 263 HA LEU 31 HA LEU 31 10.004 7.043 -1.463 264 HB2 LEU 31 HB2 LEU 31 8.050 5.575 -0.717 265 HB3 LEU 31 HB1 LEU 31 8.524 4.462 -1.981 266 HG LEU 31 HG LEU 31 9.292 3.866 0.338 267 HD11 LEU 31 HD11 LEU 31 10.354 2.871 -1.587 268 HD12 LEU 31 HD12 LEU 31 11.554 3.213 -0.340 269 HD13 LEU 31 HD13 LEU 31 11.424 4.265 -1.750 270 HD21 LEU 31 HD21 LEU 31 11.194 6.171 -0.059 271 HD22 LEU 31 HD22 LEU 31 11.181 5.032 1.288 272 HD23 LEU 31 HD23 LEU 31 9.835 6.151 1.066 273 H LEU 32 HN LEU 32 8.798 5.219 -4.265 274 HA LEU 32 HA LEU 32 11.216 4.135 -5.123 275 HB2 LEU 32 HB2 LEU 32 8.828 5.015 -6.744 276 HB3 LEU 32 HB1 LEU 32 10.126 4.005 -7.349 277 HG LEU 32 HG LEU 32 8.254 3.260 -5.103 278 HD11 LEU 32 HD11 LEU 32 8.342 2.352 -7.976 279 HD12 LEU 32 HD12 LEU 32 7.097 3.361 -7.237 280 HD13 LEU 32 HD13 LEU 32 7.299 1.688 -6.718 281 HD21 LEU 32 HD21 LEU 32 10.433 2.210 -4.874 282 HD22 LEU 32 HD22 LEU 32 10.360 1.657 -6.548 283 HD23 LEU 32 HD23 LEU 32 9.222 1.026 -5.358 284 H SER 33 HN SER 33 9.829 7.314 -5.592 285 HA SER 33 HA SER 33 11.523 8.200 -7.650 286 HB2 SER 33 HB2 SER 33 10.195 9.832 -5.473 287 HB3 SER 33 HB1 SER 33 10.842 10.462 -6.989 288 HG SER 33 HG SER 33 8.713 8.588 -6.715 289 H GLU 34 HN GLU 34 11.893 8.186 -4.123 290 HA GLU 34 HA GLU 34 14.368 9.658 -4.219 291 HB2 GLU 34 HB2 GLU 34 13.058 8.106 -1.986 292 HB3 GLU 34 HB1 GLU 34 14.553 9.014 -1.818 293 HG2 GLU 34 HG2 GLU 34 13.257 11.046 -2.565 294 HG3 GLU 34 HG1 GLU 34 11.799 10.074 -2.359 295 H SER 35 HN SER 35 13.329 6.338 -4.097 296 HA SER 35 HA SER 35 15.840 5.156 -3.546 297 HB2 SER 35 HB2 SER 35 13.577 4.071 -3.244 298 HB3 SER 35 HB1 SER 35 13.502 3.887 -4.995 299 HG SER 35 HG SER 35 14.356 2.068 -3.650 300 H GLN 36 HN GLN 36 14.807 6.833 -6.225 301 HA GLN 36 HA GLN 36 16.215 5.158 -8.172 302 HB2 GLN 36 HB2 GLN 36 13.859 5.937 -8.619 303 HB3 GLN 36 HB1 GLN 36 14.471 7.581 -8.651 304 HG2 GLN 36 HG2 GLN 36 14.169 6.674 -10.890 305 HG3 GLN 36 HG1 GLN 36 15.858 7.061 -10.559 306 HE21 GLN 36 HE21 GLN 36 13.531 4.499 -10.948 307 HE22 GLN 36 HE22 GLN 36 14.677 3.233 -11.212 308 H LEU 37 HN LEU 37 16.674 7.719 -6.126 309 HA LEU 37 HA LEU 37 18.217 9.430 -7.838 310 HB2 LEU 37 HB2 LEU 37 17.926 9.393 -4.835 311 HB3 LEU 37 HB1 LEU 37 18.700 10.663 -5.761 312 HG LEU 37 HG LEU 37 15.784 9.918 -5.972 313 HD11 LEU 37 HD11 LEU 37 16.316 10.896 -3.801 314 HD12 LEU 37 HD12 LEU 37 15.357 11.998 -4.787 315 HD13 LEU 37 HD13 LEU 37 17.090 12.262 -4.604 316 HD21 LEU 37 HD21 LEU 37 16.517 10.847 -8.035 317 HD22 LEU 37 HD22 LEU 37 17.427 12.112 -7.211 318 HD23 LEU 37 HD23 LEU 37 15.665 12.118 -7.161 319 H LYS 38 HN LYS 38 20.344 9.498 -8.090 320 HA LYS 38 HA LYS 38 21.912 7.235 -7.383 321 HB2 LYS 38 HB2 LYS 38 22.718 9.894 -8.583 322 HB3 LYS 38 HB1 LYS 38 23.745 8.469 -8.504 323 HG2 LYS 38 HG2 LYS 38 22.288 7.259 -9.977 324 HG3 LYS 38 HG1 LYS 38 21.101 8.562 -9.944 325 HD2 LYS 38 HD2 LYS 38 22.367 8.642 -12.006 326 HD3 LYS 38 HD1 LYS 38 22.735 10.054 -11.018 327 HE2 LYS 38 HE2 LYS 38 24.805 9.001 -10.273 328 HE3 LYS 38 HE1 LYS 38 24.431 7.568 -11.231 329 HZ1 LYS 38 HZ1 LYS 38 25.982 9.011 -12.378 330 HZ2 LYS 38 HZ2 LYS 38 24.888 10.297 -12.310 331 HZ3 LYS 38 HZ3 LYS 38 24.524 8.923 -13.230 332 H GLU 39 HN GLU 39 21.487 10.431 -6.063 333 HA GLU 39 HA GLU 39 23.727 10.354 -4.294 334 HB2 GLU 39 HB2 GLU 39 22.647 12.464 -4.997 335 HB3 GLU 39 HB1 GLU 39 21.193 12.002 -4.126 336 HG2 GLU 39 HG2 GLU 39 22.446 12.038 -2.027 337 HG3 GLU 39 HG1 GLU 39 23.897 12.513 -2.905 338 H ALA 40 HN ALA 40 20.648 8.880 -4.302 339 HA ALA 40 HA ALA 40 20.350 8.647 -1.462 340 HB1 ALA 40 HB1 ALA 40 18.505 7.123 -1.992 341 HB2 ALA 40 HB2 ALA 40 18.963 7.181 -3.696 342 HB3 ALA 40 HB3 ALA 40 18.390 8.639 -2.885 343 H LEU 41 HN LEU 41 22.460 7.304 -3.569 344 HA LEU 41 HA LEU 41 22.665 4.647 -2.617 345 HB2 LEU 41 HB2 LEU 41 23.720 5.416 -4.700 346 HB3 LEU 41 HB1 LEU 41 24.786 6.459 -3.782 347 HG LEU 41 HG LEU 41 25.780 4.443 -2.722 348 HD11 LEU 41 HD11 LEU 41 25.349 2.254 -3.742 349 HD12 LEU 41 HD12 LEU 41 24.061 2.971 -4.711 350 HD13 LEU 41 HD13 LEU 41 23.917 2.915 -2.954 351 HD21 LEU 41 HD21 LEU 41 27.057 3.746 -4.684 352 HD22 LEU 41 HD22 LEU 41 26.835 5.495 -4.652 353 HD23 LEU 41 HD23 LEU 41 25.860 4.503 -5.735 354 H GLU 42 HN GLU 42 23.347 7.654 -1.232 355 HA GLU 42 HA GLU 42 25.358 7.210 0.601 356 HB2 GLU 42 HB2 GLU 42 24.339 9.379 0.389 357 HB3 GLU 42 HB1 GLU 42 22.765 8.746 0.840 358 HG2 GLU 42 HG2 GLU 42 23.744 10.038 2.640 359 HG3 GLU 42 HG1 GLU 42 23.561 8.349 3.106 360 HA PRO 43 HA PRO 43 23.765 3.563 2.744 361 HB2 PRO 43 HB2 PRO 43 25.806 4.500 4.708 362 HB3 PRO 43 HB1 PRO 43 25.542 2.884 4.047 363 HG2 PRO 43 HG2 PRO 43 27.558 4.389 3.189 364 HG3 PRO 43 HG1 PRO 43 26.642 3.365 2.069 365 HD2 PRO 43 HD2 PRO 43 26.557 6.321 2.445 366 HD3 PRO 43 HD1 PRO 43 26.342 5.361 0.966 367 H ASN 44 HN ASN 44 24.237 6.740 4.202 368 HA ASN 44 HA ASN 44 22.681 6.206 6.528 369 HB2 ASN 44 HB2 ASN 44 23.407 8.844 5.223 370 HB3 ASN 44 HB1 ASN 44 22.604 8.694 6.784 371 HD21 ASN 44 HD21 ASN 44 25.166 9.913 6.160 372 HD22 ASN 44 HD22 ASN 44 26.345 9.070 7.102 373 H LYS 45 HN LYS 45 21.942 7.854 3.441 374 HA LYS 45 HA LYS 45 19.232 8.294 4.033 375 HB2 LYS 45 HB2 LYS 45 20.410 9.528 2.279 376 HB3 LYS 45 HB1 LYS 45 20.617 8.050 1.354 377 HG2 LYS 45 HG2 LYS 45 18.824 9.377 0.420 378 HG3 LYS 45 HG1 LYS 45 18.175 7.883 1.098 379 HD2 LYS 45 HD2 LYS 45 17.553 9.131 3.144 380 HD3 LYS 45 HD1 LYS 45 18.119 10.615 2.379 381 HE2 LYS 45 HE2 LYS 45 15.933 8.843 1.296 382 HE3 LYS 45 HE1 LYS 45 15.662 10.303 2.244 383 HZ1 LYS 45 HZ1 LYS 45 16.974 10.153 -0.416 384 HZ2 LYS 45 HZ2 LYS 45 16.831 11.558 0.507 385 HZ3 LYS 45 HZ3 LYS 45 15.440 10.793 -0.078 386 H ARG 46 HN ARG 46 20.942 5.583 2.574 387 HA ARG 46 HA ARG 46 18.754 4.149 1.602 388 HB2 ARG 46 HB2 ARG 46 21.392 3.196 2.712 389 HB3 ARG 46 HB1 ARG 46 20.203 2.102 2.017 390 HG2 ARG 46 HG2 ARG 46 20.343 3.287 -0.109 391 HG3 ARG 46 HG1 ARG 46 21.523 4.401 0.586 392 HD2 ARG 46 HD2 ARG 46 22.640 2.692 -0.728 393 HD3 ARG 46 HD1 ARG 46 23.049 2.522 0.977 394 HE ARG 46 HE ARG 46 20.936 0.832 0.614 395 HH11 ARG 46 HH11 ARG 46 24.065 1.200 -0.908 396 HH12 ARG 46 HH12 ARG 46 24.230 -0.486 -1.274 397 HH21 ARG 46 HH21 ARG 46 21.157 -1.399 0.138 398 HH22 ARG 46 HH22 ARG 46 22.581 -1.955 -0.689 399 H GLN 47 HN GLN 47 20.152 4.230 4.857 400 HA GLN 47 HA GLN 47 18.399 2.297 5.956 401 HB2 GLN 47 HB2 GLN 47 19.950 4.526 7.276 402 HB3 GLN 47 HB1 GLN 47 19.090 3.267 8.151 403 HG2 GLN 47 HG2 GLN 47 21.380 2.833 6.246 404 HG3 GLN 47 HG1 GLN 47 21.479 2.802 8.005 405 HE21 GLN 47 HE21 GLN 47 22.091 0.730 6.031 406 HE22 GLN 47 HE22 GLN 47 21.115 -0.630 6.457 407 H HIS 48 HN HIS 48 18.199 5.762 5.480 408 HA HIS 48 HA HIS 48 15.856 6.199 7.026 409 HB2 HIS 48 HB2 HIS 48 17.410 8.021 6.277 410 HB3 HIS 48 HB1 HIS 48 16.846 7.783 4.628 411 HD1 HIS 48 HD1 HIS 48 15.968 9.424 7.827 412 HD2 HIS 48 HD2 HIS 48 14.179 8.702 4.146 413 HE1 HIS 48 HE1 HIS 48 13.989 10.972 7.722 414 HE2 HIS 48 HE2 HIS 48 13.037 10.647 5.413 415 H ILE 49 HN ILE 49 16.427 5.433 3.616 416 HA ILE 49 HA ILE 49 13.713 5.558 2.804 417 HB ILE 49 HB ILE 49 16.003 3.975 1.612 418 HG12 ILE 49 HG12 ILE 49 14.842 6.662 0.837 419 HG13 ILE 49 HG11 ILE 49 16.374 6.418 1.669 420 HG21 ILE 49 HG21 ILE 49 13.841 3.077 0.925 421 HG22 ILE 49 HG22 ILE 49 14.650 3.877 -0.421 422 HG23 ILE 49 HG23 ILE 49 13.325 4.685 0.417 423 HD11 ILE 49 HD11 ILE 49 17.228 5.212 -0.285 424 HD12 ILE 49 HD12 ILE 49 16.729 6.856 -0.685 425 HD13 ILE 49 HD13 ILE 49 15.697 5.492 -1.115 426 H TYR 50 HN TYR 50 15.804 2.849 3.790 427 HA TYR 50 HA TYR 50 14.019 0.771 3.674 428 HB2 TYR 50 HB2 TYR 50 16.393 0.504 4.205 429 HB3 TYR 50 HB1 TYR 50 16.155 1.289 5.761 430 HD1 TYR 50 HD1 TYR 50 16.168 -0.137 7.572 431 HD2 TYR 50 HD2 TYR 50 14.622 -1.563 3.871 432 HE1 TYR 50 HE1 TYR 50 15.706 -2.316 8.610 433 HE2 TYR 50 HE2 TYR 50 14.160 -3.745 4.900 434 HH TYR 50 HH TYR 50 14.150 -4.253 8.219 435 H GLN 51 HN GLN 51 14.371 3.151 6.282 436 HA GLN 51 HA GLN 51 12.538 1.927 8.062 437 HB2 GLN 51 HB2 GLN 51 14.128 3.577 8.871 438 HB3 GLN 51 HB1 GLN 51 13.446 4.805 7.814 439 HG2 GLN 51 HG2 GLN 51 12.768 5.086 10.152 440 HG3 GLN 51 HG1 GLN 51 11.399 4.830 9.073 441 HE21 GLN 51 HE21 GLN 51 10.083 4.166 10.730 442 HE22 GLN 51 HE22 GLN 51 10.248 2.627 11.496 443 H ARG 52 HN ARG 52 12.129 4.503 5.646 444 HA ARG 52 HA ARG 52 9.379 4.909 6.204 445 HB2 ARG 52 HB2 ARG 52 11.053 5.573 3.785 446 HB3 ARG 52 HB1 ARG 52 9.361 6.029 3.938 447 HG2 ARG 52 HG2 ARG 52 11.585 6.882 5.781 448 HG3 ARG 52 HG1 ARG 52 10.859 7.868 4.510 449 HD2 ARG 52 HD2 ARG 52 8.653 7.563 5.690 450 HD3 ARG 52 HD1 ARG 52 9.551 6.838 7.025 451 HE ARG 52 HE ARG 52 10.687 9.335 6.399 452 HH11 ARG 52 HH11 ARG 52 7.792 7.985 7.846 453 HH12 ARG 52 HH12 ARG 52 7.442 9.409 8.771 454 HH21 ARG 52 HH21 ARG 52 10.231 11.210 7.634 455 HH22 ARG 52 HH22 ARG 52 8.841 11.230 8.670 456 H CYS 53 HN CYS 53 11.111 2.734 4.123 457 HA CYS 53 HA CYS 53 8.895 1.902 2.548 458 HB2 CYS 53 HB2 CYS 53 11.296 1.520 1.932 459 HB3 CYS 53 HB1 CYS 53 11.382 0.299 3.203 460 HG CYS 53 HG CYS 53 9.070 -1.029 1.850 461 H ILE 54 HN ILE 54 10.418 0.573 5.467 462 HA ILE 54 HA ILE 54 8.699 -1.563 5.927 463 HB ILE 54 HB ILE 54 10.112 0.215 7.911 464 HG12 ILE 54 HG12 ILE 54 10.763 -2.549 6.858 465 HG13 ILE 54 HG11 ILE 54 11.594 -1.057 6.413 466 HG21 ILE 54 HG21 ILE 54 8.207 -0.864 8.983 467 HG22 ILE 54 HG22 ILE 54 9.732 -1.525 9.575 468 HG23 ILE 54 HG23 ILE 54 8.768 -2.436 8.411 469 HD11 ILE 54 HD11 ILE 54 12.876 -2.329 8.031 470 HD12 ILE 54 HD12 ILE 54 11.520 -2.293 9.156 471 HD13 ILE 54 HD13 ILE 54 12.346 -0.796 8.723 472 H GLN 55 HN GLN 55 8.399 1.822 6.894 473 HA GLN 55 HA GLN 55 6.134 1.538 8.515 474 HB2 GLN 55 HB2 GLN 55 7.679 3.549 8.312 475 HB3 GLN 55 HB1 GLN 55 6.772 3.981 6.870 476 HG2 GLN 55 HG2 GLN 55 4.710 4.017 8.252 477 HG3 GLN 55 HG1 GLN 55 5.716 3.753 9.674 478 HE21 GLN 55 HE21 GLN 55 3.993 5.974 9.103 479 HE22 GLN 55 HE22 GLN 55 4.990 7.387 9.085 480 H LEU 56 HN LEU 56 6.357 2.527 5.093 481 HA LEU 56 HA LEU 56 3.631 2.681 4.599 482 HB2 LEU 56 HB2 LEU 56 5.768 1.835 2.638 483 HB3 LEU 56 HB1 LEU 56 4.190 2.473 2.231 484 HG LEU 56 HG LEU 56 6.413 3.983 3.612 485 HD11 LEU 56 HD11 LEU 56 5.289 4.184 0.822 486 HD12 LEU 56 HD12 LEU 56 6.891 3.601 1.278 487 HD13 LEU 56 HD13 LEU 56 6.463 5.293 1.532 488 HD21 LEU 56 HD21 LEU 56 4.973 5.952 3.335 489 HD22 LEU 56 HD22 LEU 56 4.250 4.750 4.402 490 HD23 LEU 56 HD23 LEU 56 3.677 4.914 2.742 491 H LYS 57 HN LYS 57 5.792 -0.118 4.429 492 HA LYS 57 HA LYS 57 4.001 -1.915 3.249 493 HB2 LYS 57 HB2 LYS 57 6.285 -2.553 3.387 494 HB3 LYS 57 HB1 LYS 57 6.320 -2.328 5.130 495 HG2 LYS 57 HG2 LYS 57 5.045 -4.282 5.505 496 HG3 LYS 57 HG1 LYS 57 4.622 -4.418 3.800 497 HD2 LYS 57 HD2 LYS 57 6.777 -5.114 3.201 498 HD3 LYS 57 HD1 LYS 57 7.478 -4.542 4.714 499 HE2 LYS 57 HE2 LYS 57 7.215 -7.044 4.491 500 HE3 LYS 57 HE1 LYS 57 6.531 -6.322 5.943 501 HZ1 LYS 57 HZ1 LYS 57 4.349 -6.396 4.901 502 HZ2 LYS 57 HZ2 LYS 57 5.032 -7.936 4.983 503 HZ3 LYS 57 HZ3 LYS 57 5.012 -7.105 3.513 504 H GLN 58 HN GLN 58 4.589 -1.174 6.655 505 HA GLN 58 HA GLN 58 2.634 -2.917 7.699 506 HB2 GLN 58 HB2 GLN 58 3.849 -0.401 8.830 507 HB3 GLN 58 HB1 GLN 58 2.754 -1.439 9.731 508 HG2 GLN 58 HG2 GLN 58 4.321 -3.297 9.502 509 HG3 GLN 58 HG1 GLN 58 5.419 -2.255 8.593 510 HE21 GLN 58 HE21 GLN 58 7.056 -2.517 10.104 511 HE22 GLN 58 HE22 GLN 58 7.005 -1.767 11.662 512 H ALA 59 HN ALA 59 2.455 0.374 6.490 513 HA ALA 59 HA ALA 59 -0.137 0.954 7.478 514 HB1 ALA 59 HB1 ALA 59 1.438 2.698 6.799 515 HB2 ALA 59 HB2 ALA 59 -0.091 2.836 5.932 516 HB3 ALA 59 HB3 ALA 59 1.320 2.153 5.126 517 H ILE 60 HN ILE 60 1.071 -0.420 4.457 518 HA ILE 60 HA ILE 60 -1.455 -0.524 3.159 519 HB ILE 60 HB ILE 60 0.989 -2.239 2.669 520 HG12 ILE 60 HG12 ILE 60 0.102 0.280 1.247 521 HG13 ILE 60 HG11 ILE 60 1.355 0.237 2.485 522 HG21 ILE 60 HG21 ILE 60 -1.382 -1.648 0.898 523 HG22 ILE 60 HG22 ILE 60 -1.064 -3.176 1.718 524 HG23 ILE 60 HG23 ILE 60 0.030 -2.609 0.456 525 HD11 ILE 60 HD11 ILE 60 2.681 -1.249 1.077 526 HD12 ILE 60 HD12 ILE 60 2.315 0.271 0.261 527 HD13 ILE 60 HD13 ILE 60 1.427 -1.194 -0.158 528 H ASP 61 HN ASP 61 0.389 -2.776 5.143 529 HA ASP 61 HA ASP 61 -1.302 -5.012 4.978 530 HB2 ASP 61 HB2 ASP 61 0.970 -5.067 5.977 531 HB3 ASP 61 HB1 ASP 61 0.390 -4.098 7.330 532 H GLU 62 HN GLU 62 -1.367 -2.170 7.013 533 HA GLU 62 HA GLU 62 -3.511 -2.853 8.681 534 HB2 GLU 62 HB2 GLU 62 -2.026 -0.945 9.093 535 HB3 GLU 62 HB1 GLU 62 -2.672 -0.128 7.677 536 HG2 GLU 62 HG2 GLU 62 -3.635 0.773 9.701 537 HG3 GLU 62 HG1 GLU 62 -4.865 -0.033 8.730 538 H ASN 63 HN ASN 63 -3.482 -1.114 5.569 539 HA ASN 63 HA ASN 63 -6.281 -0.800 5.374 540 HB2 ASN 63 HB2 ASN 63 -4.070 -0.795 3.332 541 HB3 ASN 63 HB1 ASN 63 -5.756 -0.682 2.840 542 HD21 ASN 63 HD21 ASN 63 -5.424 1.390 1.997 543 HD22 ASN 63 HD22 ASN 63 -5.232 2.768 3.029 544 H LYS 64 HN LYS 64 -4.097 -3.346 4.291 545 HA LYS 64 HA LYS 64 -5.902 -4.951 2.907 546 HB2 LYS 64 HB2 LYS 64 -3.485 -5.322 2.915 547 HB3 LYS 64 HB1 LYS 64 -3.538 -5.751 4.616 548 HG2 LYS 64 HG2 LYS 64 -4.881 -7.721 4.078 549 HG3 LYS 64 HG1 LYS 64 -4.824 -7.287 2.367 550 HD2 LYS 64 HD2 LYS 64 -2.396 -7.493 2.381 551 HD3 LYS 64 HD1 LYS 64 -2.426 -7.872 4.103 552 HE2 LYS 64 HE2 LYS 64 -3.688 -9.904 3.652 553 HE3 LYS 64 HE1 LYS 64 -3.719 -9.519 1.931 554 HZ1 LYS 64 HZ1 LYS 64 -1.329 -9.712 1.866 555 HZ2 LYS 64 HZ2 LYS 64 -1.998 -11.135 2.481 556 HZ3 LYS 64 HZ3 LYS 64 -1.264 -10.026 3.526 557 H ASN 65 HN ASN 65 -5.111 -4.900 6.370 558 HA ASN 65 HA ASN 65 -6.893 -6.987 7.081 559 HB2 ASN 65 HB2 ASN 65 -5.437 -4.871 8.614 560 HB3 ASN 65 HB1 ASN 65 -6.692 -5.805 9.414 561 HD21 ASN 65 HD21 ASN 65 -6.150 -8.238 7.913 562 HD22 ASN 65 HD22 ASN 65 -4.666 -8.865 8.537 563 H ALA 66 HN ALA 66 -7.231 -3.483 6.923 564 HA ALA 66 HA ALA 66 -9.797 -3.305 8.055 565 HB1 ALA 66 HB1 ALA 66 -9.950 -1.140 6.939 566 HB2 ALA 66 HB2 ALA 66 -8.552 -1.548 5.941 567 HB3 ALA 66 HB3 ALA 66 -8.366 -1.355 7.686 568 H LEU 67 HN LEU 67 -8.746 -3.649 4.680 569 HA LEU 67 HA LEU 67 -11.334 -3.759 3.573 570 HB2 LEU 67 HB2 LEU 67 -9.349 -3.292 2.238 571 HB3 LEU 67 HB1 LEU 67 -8.737 -4.905 2.549 572 HG LEU 67 HG LEU 67 -10.549 -5.882 1.260 573 HD11 LEU 67 HD11 LEU 67 -11.493 -3.043 0.950 574 HD12 LEU 67 HD12 LEU 67 -12.358 -4.390 1.689 575 HD13 LEU 67 HD13 LEU 67 -12.055 -4.381 -0.046 576 HD21 LEU 67 HD21 LEU 67 -8.552 -5.275 0.052 577 HD22 LEU 67 HD22 LEU 67 -9.148 -3.630 -0.164 578 HD23 LEU 67 HD23 LEU 67 -9.968 -4.974 -0.958 579 H GLN 68 HN GLN 68 -9.148 -6.272 4.776 580 HA GLN 68 HA GLN 68 -10.649 -8.504 4.108 581 HB2 GLN 68 HB2 GLN 68 -8.362 -8.549 5.060 582 HB3 GLN 68 HB1 GLN 68 -9.023 -8.093 6.623 583 HG2 GLN 68 HG2 GLN 68 -10.315 -10.166 6.678 584 HG3 GLN 68 HG1 GLN 68 -9.637 -10.625 5.117 585 HE21 GLN 68 HE21 GLN 68 -8.703 -12.473 5.939 586 HE22 GLN 68 HE22 GLN 68 -7.314 -12.432 6.966 587 H LYS 69 HN LYS 69 -11.112 -6.209 6.730 588 HA LYS 69 HA LYS 69 -13.174 -7.769 7.990 589 HB2 LYS 69 HB2 LYS 69 -11.760 -6.027 9.165 590 HB3 LYS 69 HB1 LYS 69 -12.669 -4.800 8.295 591 HG2 LYS 69 HG2 LYS 69 -13.537 -5.086 10.537 592 HG3 LYS 69 HG1 LYS 69 -14.734 -5.590 9.342 593 HD2 LYS 69 HD2 LYS 69 -14.134 -7.923 9.706 594 HD3 LYS 69 HD1 LYS 69 -12.887 -7.439 10.854 595 HE2 LYS 69 HE2 LYS 69 -14.639 -6.462 12.291 596 HE3 LYS 69 HE1 LYS 69 -15.862 -7.031 11.155 597 HZ1 LYS 69 HZ1 LYS 69 -15.614 -8.548 13.009 598 HZ2 LYS 69 HZ2 LYS 69 -13.972 -8.750 12.667 599 HZ3 LYS 69 HZ3 LYS 69 -15.133 -9.298 11.571 600 H LEU 70 HN LEU 70 -12.951 -5.382 5.503 601 HA LEU 70 HA LEU 70 -15.841 -5.086 5.316 602 HB2 LEU 70 HB2 LEU 70 -13.664 -3.875 3.608 603 HB3 LEU 70 HB1 LEU 70 -15.360 -3.435 3.591 604 HG LEU 70 HG LEU 70 -13.470 -3.026 5.910 605 HD11 LEU 70 HD11 LEU 70 -14.667 -1.059 3.966 606 HD12 LEU 70 HD12 LEU 70 -12.972 -1.539 4.054 607 HD13 LEU 70 HD13 LEU 70 -13.707 -0.646 5.386 608 HD21 LEU 70 HD21 LEU 70 -15.722 -3.420 6.694 609 HD22 LEU 70 HD22 LEU 70 -16.360 -2.247 5.542 610 HD23 LEU 70 HD23 LEU 70 -15.324 -1.709 6.865 611 H SER 71 HN SER 71 -14.879 -7.701 4.850 612 HA SER 71 HA SER 71 -14.861 -8.090 1.975 613 HB2 SER 71 HB2 SER 71 -14.816 -10.111 4.237 614 HB3 SER 71 HB1 SER 71 -14.627 -10.497 2.526 615 HG SER 71 HG SER 71 -12.844 -9.329 4.307 616 H LYS 72 HN LYS 72 -17.188 -6.979 3.445 617 HA LYS 72 HA LYS 72 -19.238 -9.011 3.165 618 HB2 LYS 72 HB2 LYS 72 -19.592 -6.046 3.701 619 HB3 LYS 72 HB1 LYS 72 -20.774 -7.315 3.977 620 HG2 LYS 72 HG2 LYS 72 -19.359 -8.258 5.759 621 HG3 LYS 72 HG1 LYS 72 -18.170 -6.979 5.484 622 HD2 LYS 72 HD2 LYS 72 -19.903 -5.299 6.038 623 HD3 LYS 72 HD1 LYS 72 -21.031 -6.607 6.391 624 HE2 LYS 72 HE2 LYS 72 -20.042 -5.742 8.438 625 HE3 LYS 72 HE1 LYS 72 -19.543 -7.408 8.163 626 HZ1 LYS 72 HZ1 LYS 72 -17.429 -6.615 7.330 627 HZ2 LYS 72 HZ2 LYS 72 -17.706 -6.005 8.879 628 HZ3 LYS 72 HZ3 LYS 72 -17.917 -5.006 7.535 629 H ALA 73 HN ALA 73 -19.431 -9.509 0.994 630 HA ALA 73 HA ALA 73 -19.328 -7.594 -1.080 631 HB1 ALA 73 HB1 ALA 73 -20.626 -10.313 -1.132 632 HB2 ALA 73 HB2 ALA 73 -18.907 -10.008 -1.384 633 HB3 ALA 73 HB3 ALA 73 -20.091 -9.370 -2.523 634 H ASP 74 HN ASP 74 -21.822 -8.626 1.044 635 HA ASP 74 HA ASP 74 -24.008 -7.773 -0.615 636 HB2 ASP 74 HB2 ASP 74 -23.897 -8.711 2.251 637 HB3 ASP 74 HB1 ASP 74 -25.385 -8.286 1.420 638 H GLU 75 HN GLU 75 -21.791 -5.995 0.909 639 HA GLU 75 HA GLU 75 -23.196 -4.290 2.611 640 HB2 GLU 75 HB2 GLU 75 -21.349 -2.701 2.300 641 HB3 GLU 75 HB1 GLU 75 -20.779 -4.337 2.593 642 HG2 GLU 75 HG2 GLU 75 -20.496 -4.556 0.099 643 HG3 GLU 75 HG1 GLU 75 -20.796 -2.821 0.001 644 H SER 76 HN SER 76 -23.042 -4.325 -0.879 645 HA SER 76 HA SER 76 -25.227 -2.418 -0.918 646 HB2 SER 76 HB2 SER 76 -22.770 -1.862 -2.588 647 HB3 SER 76 HB1 SER 76 -24.216 -0.864 -2.445 648 HG SER 76 HG SER 76 -23.319 -1.203 0.000 649 H ALA 77 HN ALA 77 -25.191 -5.138 -1.479 650 HA ALA 77 HA ALA 77 -25.940 -6.667 -2.978 651 HB1 ALA 77 HB1 ALA 77 -27.635 -4.973 -3.462 652 HB2 ALA 77 HB2 ALA 77 -27.222 -5.913 -4.894 653 HB3 ALA 77 HB3 ALA 77 -26.587 -4.280 -4.698 654 HA PRO 78 HA PRO 78 -22.080 -6.824 -5.307 655 HB2 PRO 78 HB2 PRO 78 -21.636 -9.452 -5.018 656 HB3 PRO 78 HB1 PRO 78 -21.394 -8.326 -3.680 657 HG2 PRO 78 HG2 PRO 78 -23.638 -10.217 -4.188 658 HG3 PRO 78 HG1 PRO 78 -22.886 -9.748 -2.653 659 HD2 PRO 78 HD2 PRO 78 -25.274 -8.723 -3.666 660 HD3 PRO 78 HD1 PRO 78 -24.295 -7.981 -2.395 661 H VAL 79 HN VAL 79 -23.813 -6.329 -7.053 662 HA VAL 79 HA VAL 79 -25.028 -8.362 -8.534 663 HB VAL 79 HB VAL 79 -24.128 -5.649 -9.501 664 HG11 VAL 79 HG11 VAL 79 -26.149 -7.557 -10.664 665 HG12 VAL 79 HG12 VAL 79 -24.584 -7.144 -11.365 666 HG13 VAL 79 HG13 VAL 79 -25.842 -5.917 -11.230 667 HG21 VAL 79 HG21 VAL 79 -26.447 -4.979 -9.060 668 HG22 VAL 79 HG22 VAL 79 -25.604 -5.477 -7.594 669 HG23 VAL 79 HG23 VAL 79 -26.757 -6.568 -8.361 670 H ALA 80 HN ALA 80 -22.108 -6.513 -9.479 671 HA ALA 80 HA ALA 80 -20.783 -8.904 -10.324 672 HB1 ALA 80 HB1 ALA 80 -22.269 -8.622 -12.215 673 HB2 ALA 80 HB2 ALA 80 -20.600 -8.319 -12.692 674 HB3 ALA 80 HB3 ALA 80 -21.704 -6.969 -12.437 675 H ASN 81 HN ASN 81 -20.688 -5.475 -11.329 676 HA ASN 81 HA ASN 81 -17.865 -5.394 -11.350 677 HB2 ASN 81 HB2 ASN 81 -19.237 -3.838 -12.685 678 HB3 ASN 81 HB1 ASN 81 -19.820 -3.083 -11.203 679 HD21 ASN 81 HD21 ASN 81 -18.531 -1.648 -10.121 680 HD22 ASN 81 HD22 ASN 81 -17.025 -1.073 -10.746 681 H TYR 82 HN TYR 82 -20.191 -4.849 -8.843 682 HA TYR 82 HA TYR 82 -18.631 -3.306 -7.087 683 HB2 TYR 82 HB2 TYR 82 -21.163 -3.988 -6.967 684 HB3 TYR 82 HB1 TYR 82 -20.565 -5.385 -6.074 685 HD1 TYR 82 HD1 TYR 82 -19.223 -4.976 -3.972 686 HD2 TYR 82 HD2 TYR 82 -21.441 -1.884 -5.892 687 HE1 TYR 82 HE1 TYR 82 -19.188 -3.665 -1.896 688 HE2 TYR 82 HE2 TYR 82 -21.395 -0.567 -3.820 689 HH TYR 82 HH TYR 82 -19.362 -1.186 -1.276 690 H ASN 83 HN ASN 83 -18.852 -6.793 -7.598 691 HA ASN 83 HA ASN 83 -17.116 -7.494 -5.449 692 HB2 ASN 83 HB2 ASN 83 -18.081 -8.984 -7.885 693 HB3 ASN 83 HB1 ASN 83 -16.925 -9.691 -6.760 694 HD21 ASN 83 HD21 ASN 83 -19.672 -10.486 -7.430 695 HD22 ASN 83 HD22 ASN 83 -20.526 -10.512 -5.929 696 H GLN 84 HN GLN 84 -16.694 -6.731 -8.834 697 HA GLN 84 HA GLN 84 -13.980 -7.470 -9.071 698 HB2 GLN 84 HB2 GLN 84 -15.656 -6.896 -10.936 699 HB3 GLN 84 HB1 GLN 84 -15.304 -5.216 -10.582 700 HG2 GLN 84 HG2 GLN 84 -13.170 -7.200 -11.312 701 HG3 GLN 84 HG1 GLN 84 -14.053 -6.260 -12.509 702 HE21 GLN 84 HE21 GLN 84 -14.216 -3.874 -10.909 703 HE22 GLN 84 HE22 GLN 84 -12.627 -3.191 -10.829 704 H ARG 85 HN ARG 85 -15.591 -4.443 -8.198 705 HA ARG 85 HA ARG 85 -13.276 -2.844 -8.067 706 HB2 ARG 85 HB2 ARG 85 -15.576 -1.939 -8.189 707 HB3 ARG 85 HB1 ARG 85 -15.878 -2.510 -6.554 708 HG2 ARG 85 HG2 ARG 85 -14.213 -0.997 -5.678 709 HG3 ARG 85 HG1 ARG 85 -13.778 -0.487 -7.308 710 HD2 ARG 85 HD2 ARG 85 -15.196 1.192 -6.384 711 HD3 ARG 85 HD1 ARG 85 -16.126 0.318 -7.598 712 HE ARG 85 HE ARG 85 -16.625 -0.884 -5.141 713 HH11 ARG 85 HH11 ARG 85 -17.193 2.167 -6.741 714 HH12 ARG 85 HH12 ARG 85 -18.586 2.560 -5.786 715 HH21 ARG 85 HH21 ARG 85 -18.463 -0.364 -3.862 716 HH22 ARG 85 HH22 ARG 85 -19.313 1.126 -4.142 717 H LYS 86 HN LYS 86 -14.921 -4.831 -5.671 718 HA LYS 86 HA LYS 86 -13.254 -4.077 -3.488 719 HB2 LYS 86 HB2 LYS 86 -15.472 -4.997 -3.122 720 HB3 LYS 86 HB1 LYS 86 -15.026 -6.490 -3.936 721 HG2 LYS 86 HG2 LYS 86 -13.410 -6.974 -2.135 722 HG3 LYS 86 HG1 LYS 86 -13.900 -5.484 -1.314 723 HD2 LYS 86 HD2 LYS 86 -15.691 -7.848 -1.910 724 HD3 LYS 86 HD1 LYS 86 -14.992 -7.451 -0.345 725 HE2 LYS 86 HE2 LYS 86 -16.941 -5.731 -1.887 726 HE3 LYS 86 HE1 LYS 86 -17.334 -6.747 -0.505 727 HZ1 LYS 86 HZ1 LYS 86 -15.411 -4.495 -0.416 728 HZ2 LYS 86 HZ2 LYS 86 -15.952 -5.409 0.897 729 HZ3 LYS 86 HZ3 LYS 86 -17.027 -4.385 0.071 730 H GLU 87 HN GLU 87 -13.152 -6.539 -5.952 731 HA GLU 87 HA GLU 87 -11.087 -8.128 -4.832 732 HB2 GLU 87 HB2 GLU 87 -12.662 -9.000 -6.473 733 HB3 GLU 87 HB1 GLU 87 -12.075 -7.859 -7.672 734 HG2 GLU 87 HG2 GLU 87 -9.913 -8.950 -7.684 735 HG3 GLU 87 HG1 GLU 87 -10.458 -10.070 -6.435 736 H GLU 88 HN GLU 88 -11.104 -5.529 -7.260 737 HA GLU 88 HA GLU 88 -8.398 -5.850 -7.973 738 HB2 GLU 88 HB2 GLU 88 -8.562 -3.729 -9.118 739 HB3 GLU 88 HB1 GLU 88 -9.993 -4.693 -9.422 740 HG2 GLU 88 HG2 GLU 88 -11.283 -3.349 -7.914 741 HG3 GLU 88 HG1 GLU 88 -9.844 -2.460 -7.414 742 H GLU 89 HN GLU 89 -9.921 -4.012 -5.400 743 HA GLU 89 HA GLU 89 -7.666 -2.503 -4.649 744 HB2 GLU 89 HB2 GLU 89 -9.863 -3.605 -2.883 745 HB3 GLU 89 HB1 GLU 89 -8.696 -2.384 -2.402 746 HG2 GLU 89 HG2 GLU 89 -10.822 -2.129 -4.512 747 HG3 GLU 89 HG1 GLU 89 -10.756 -1.310 -2.952 748 H HIS 90 HN HIS 90 -8.662 -5.802 -3.889 749 HA HIS 90 HA HIS 90 -6.607 -6.426 -2.059 750 HB2 HIS 90 HB2 HIS 90 -8.380 -8.042 -3.842 751 HB3 HIS 90 HB1 HIS 90 -6.954 -8.825 -3.178 752 HD1 HIS 90 HD1 HIS 90 -6.915 -9.291 -0.651 753 HD2 HIS 90 HD2 HIS 90 -10.416 -7.496 -1.986 754 HE1 HIS 90 HE1 HIS 90 -8.555 -9.541 1.227 755 HE2 HIS 90 HE2 HIS 90 -10.723 -8.639 0.310 756 H THR 91 HN THR 91 -6.787 -6.679 -5.578 757 HA THR 91 HA THR 91 -4.281 -7.851 -6.016 758 HB THR 91 HB THR 91 -5.652 -5.916 -7.885 759 HG1 THR 91 HG1 THR 91 -7.054 -7.496 -8.408 760 HG21 THR 91 HG21 THR 91 -3.421 -6.689 -8.565 761 HG22 THR 91 HG22 THR 91 -4.677 -7.316 -9.630 762 HG23 THR 91 HG23 THR 91 -3.957 -8.361 -8.405 763 H LEU 92 HN LEU 92 -5.264 -4.481 -5.642 764 HA LEU 92 HA LEU 92 -2.787 -3.362 -6.498 765 HB2 LEU 92 HB2 LEU 92 -4.824 -2.056 -6.600 766 HB3 LEU 92 HB1 LEU 92 -5.048 -2.197 -4.870 767 HG LEU 92 HG LEU 92 -2.988 -0.869 -4.518 768 HD11 LEU 92 HD11 LEU 92 -1.808 -1.393 -6.563 769 HD12 LEU 92 HD12 LEU 92 -2.029 0.352 -6.425 770 HD13 LEU 92 HD13 LEU 92 -3.051 -0.583 -7.517 771 HD21 LEU 92 HD21 LEU 92 -3.939 1.275 -5.193 772 HD22 LEU 92 HD22 LEU 92 -5.175 0.209 -4.526 773 HD23 LEU 92 HD23 LEU 92 -5.061 0.444 -6.270 774 H LEU 93 HN LEU 93 -4.249 -3.943 -3.310 775 HA LEU 93 HA LEU 93 -2.134 -2.824 -1.832 776 HB2 LEU 93 HB2 LEU 93 -4.162 -4.900 -0.999 777 HB3 LEU 93 HB1 LEU 93 -3.097 -4.044 0.097 778 HG LEU 93 HG LEU 93 -5.203 -2.737 -1.626 779 HD11 LEU 93 HD11 LEU 93 -5.190 -3.341 1.329 780 HD12 LEU 93 HD12 LEU 93 -6.200 -4.122 0.113 781 HD13 LEU 93 HD13 LEU 93 -6.417 -2.409 0.471 782 HD21 LEU 93 HD21 LEU 93 -4.745 -0.761 -0.245 783 HD22 LEU 93 HD22 LEU 93 -3.326 -1.263 -1.163 784 HD23 LEU 93 HD23 LEU 93 -3.439 -1.634 0.557 785 H ASP 94 HN ASP 94 -2.651 -6.055 -3.112 786 HA ASP 94 HA ASP 94 -0.599 -7.286 -1.569 787 HB2 ASP 94 HB2 ASP 94 -2.336 -8.649 -2.628 788 HB3 ASP 94 HB1 ASP 94 -1.788 -8.139 -4.224 789 H LYS 95 HN LYS 95 -0.671 -6.018 -4.917 790 HA LYS 95 HA LYS 95 1.962 -6.486 -5.581 791 HB2 LYS 95 HB2 LYS 95 0.400 -5.807 -7.243 792 HB3 LYS 95 HB1 LYS 95 -0.002 -4.338 -6.368 793 HG2 LYS 95 HG2 LYS 95 2.334 -3.540 -6.805 794 HG3 LYS 95 HG1 LYS 95 2.542 -4.947 -7.858 795 HD2 LYS 95 HD2 LYS 95 0.780 -4.216 -9.297 796 HD3 LYS 95 HD1 LYS 95 0.320 -2.933 -8.177 797 HE2 LYS 95 HE2 LYS 95 2.479 -1.837 -8.561 798 HE3 LYS 95 HE1 LYS 95 2.922 -3.117 -9.692 799 HZ1 LYS 95 HZ1 LYS 95 1.091 -2.478 -11.104 800 HZ2 LYS 95 HZ2 LYS 95 2.083 -1.140 -10.820 801 HZ3 LYS 95 HZ3 LYS 95 0.609 -1.283 -10.008 802 H LEU 96 HN LEU 96 0.576 -3.528 -4.161 803 HA LEU 96 HA LEU 96 2.959 -2.111 -3.949 804 HB2 LEU 96 HB2 LEU 96 0.594 -1.969 -2.077 805 HB3 LEU 96 HB1 LEU 96 1.857 -0.764 -2.228 806 HG LEU 96 HG LEU 96 -0.115 -1.506 -4.389 807 HD11 LEU 96 HD11 LEU 96 0.095 0.946 -2.650 808 HD12 LEU 96 HD12 LEU 96 -1.167 -0.284 -2.573 809 HD13 LEU 96 HD13 LEU 96 -1.016 0.739 -4.003 810 HD21 LEU 96 HD21 LEU 96 2.017 -0.828 -5.333 811 HD22 LEU 96 HD22 LEU 96 2.031 0.610 -4.312 812 HD23 LEU 96 HD23 LEU 96 0.811 0.437 -5.572 813 H THR 97 HN THR 97 1.454 -4.266 -1.545 814 HA THR 97 HA THR 97 3.426 -4.092 0.420 815 HB THR 97 HB THR 97 1.805 -6.546 -0.307 816 HG1 THR 97 HG1 THR 97 0.378 -4.900 0.144 817 HG21 THR 97 HG21 THR 97 3.699 -6.989 1.213 818 HG22 THR 97 HG22 THR 97 2.140 -7.206 2.009 819 HG23 THR 97 HG23 THR 97 3.088 -5.750 2.308 820 H GLN 98 HN GLN 98 3.204 -6.247 -2.391 821 HA GLN 98 HA GLN 98 5.463 -7.817 -1.813 822 HB2 GLN 98 HB2 GLN 98 3.757 -8.511 -3.413 823 HB3 GLN 98 HB1 GLN 98 4.168 -7.165 -4.466 824 HG2 GLN 98 HG2 GLN 98 6.420 -8.126 -4.756 825 HG3 GLN 98 HG1 GLN 98 5.926 -9.508 -3.780 826 HE21 GLN 98 HE21 GLN 98 6.817 -9.420 -6.547 827 HE22 GLN 98 HE22 GLN 98 5.539 -10.111 -7.484 828 H GLN 99 HN GLN 99 5.052 -4.948 -3.843 829 HA GLN 99 HA GLN 99 7.653 -4.886 -4.893 830 HB2 GLN 99 HB2 GLN 99 5.810 -3.659 -5.893 831 HB3 GLN 99 HB1 GLN 99 5.671 -2.649 -4.463 832 HG2 GLN 99 HG2 GLN 99 7.776 -1.614 -4.904 833 HG3 GLN 99 HG1 GLN 99 8.117 -2.751 -6.209 834 HE21 GLN 99 HE21 GLN 99 6.215 -0.007 -5.226 835 HE22 GLN 99 HE22 GLN 99 5.693 0.449 -6.810 836 H LEU 100 HN LEU 100 6.268 -3.375 -2.010 837 HA LEU 100 HA LEU 100 8.638 -1.932 -1.354 838 HB2 LEU 100 HB2 LEU 100 6.238 -2.688 0.305 839 HB3 LEU 100 HB1 LEU 100 7.542 -1.674 0.890 840 HG LEU 100 HG LEU 100 5.664 -1.032 -1.385 841 HD11 LEU 100 HD11 LEU 100 5.981 0.152 1.366 842 HD12 LEU 100 HD12 LEU 100 4.643 -0.851 0.808 843 HD13 LEU 100 HD13 LEU 100 4.899 0.747 0.108 844 HD21 LEU 100 HD21 LEU 100 6.772 1.173 -1.380 845 HD22 LEU 100 HD22 LEU 100 7.852 -0.130 -1.874 846 HD23 LEU 100 HD23 LEU 100 7.971 0.545 -0.248 847 H GLN 101 HN GLN 101 7.271 -5.024 -0.330 848 HA GLN 101 HA GLN 101 9.125 -5.578 1.706 849 HB2 GLN 101 HB2 GLN 101 6.979 -6.772 1.409 850 HB3 GLN 101 HB1 GLN 101 7.601 -7.521 -0.051 851 HG2 GLN 101 HG2 GLN 101 9.025 -7.888 2.552 852 HG3 GLN 101 HG1 GLN 101 7.587 -8.835 2.182 853 HE21 GLN 101 HE21 GLN 101 10.359 -9.692 2.566 854 HE22 GLN 101 HE22 GLN 101 10.813 -10.516 1.111 855 H GLY 102 HN GLY 102 9.131 -6.396 -1.758 856 HA2 GLY 102 HA2 GLY 102 11.599 -7.782 -1.729 857 HA3 GLY 102 HA1 GLY 102 10.847 -7.054 -3.139 858 H LEU 103 HN LEU 103 10.781 -4.389 -2.319 859 HA LEU 103 HA LEU 103 13.380 -3.555 -3.024 860 HB2 LEU 103 HB2 LEU 103 11.389 -2.245 -3.554 861 HB3 LEU 103 HB1 LEU 103 11.075 -1.991 -1.847 862 HG LEU 103 HG LEU 103 13.187 -0.691 -1.684 863 HD11 LEU 103 HD11 LEU 103 13.242 -1.031 -4.677 864 HD12 LEU 103 HD12 LEU 103 14.397 -1.708 -3.530 865 HD13 LEU 103 HD13 LEU 103 14.287 0.039 -3.743 866 HD21 LEU 103 HD21 LEU 103 11.062 0.445 -2.014 867 HD22 LEU 103 HD22 LEU 103 11.225 0.268 -3.760 868 HD23 LEU 103 HD23 LEU 103 12.358 1.282 -2.869 869 H ALA 104 HN ALA 104 11.647 -3.535 0.068 870 HA ALA 104 HA ALA 104 13.475 -2.105 1.587 871 HB1 ALA 104 HB1 ALA 104 11.636 -4.342 2.427 872 HB2 ALA 104 HB2 ALA 104 11.281 -2.612 2.430 873 HB3 ALA 104 HB3 ALA 104 12.486 -3.270 3.538 874 H VAL 105 HN VAL 105 13.295 -5.615 1.050 875 HA VAL 105 HA VAL 105 15.515 -6.274 2.662 876 HB VAL 105 HB VAL 105 14.281 -7.769 0.350 877 HG11 VAL 105 HG11 VAL 105 15.411 -9.754 1.236 878 HG12 VAL 105 HG12 VAL 105 16.251 -8.740 2.410 879 HG13 VAL 105 HG13 VAL 105 16.560 -8.534 0.685 880 HG21 VAL 105 HG21 VAL 105 13.255 -9.125 2.129 881 HG22 VAL 105 HG22 VAL 105 12.749 -7.437 2.195 882 HG23 VAL 105 HG23 VAL 105 13.955 -8.042 3.331 883 H THR 106 HN THR 106 15.179 -5.380 -0.703 884 HA THR 106 HA THR 106 17.788 -5.988 -1.557 885 HB THR 106 HB THR 106 15.885 -3.876 -2.591 886 HG1 THR 106 HG1 THR 106 14.960 -5.920 -2.761 887 HG21 THR 106 HG21 THR 106 18.268 -5.155 -3.929 888 HG22 THR 106 HG22 THR 106 18.170 -3.488 -3.366 889 HG23 THR 106 HG23 THR 106 17.137 -4.037 -4.687 890 H ILE 107 HN ILE 107 16.372 -3.068 -0.140 891 HA ILE 107 HA ILE 107 18.680 -1.447 -0.498 892 HB ILE 107 HB ILE 107 16.401 -1.074 1.449 893 HG12 ILE 107 HG12 ILE 107 16.778 0.118 -1.308 894 HG13 ILE 107 HG11 ILE 107 15.706 -1.232 -0.947 895 HG21 ILE 107 HG21 ILE 107 18.428 0.892 0.394 896 HG22 ILE 107 HG22 ILE 107 18.360 0.246 2.033 897 HG23 ILE 107 HG23 ILE 107 17.062 1.283 1.436 898 HD11 ILE 107 HD11 ILE 107 14.388 0.187 0.513 899 HD12 ILE 107 HD12 ILE 107 14.501 0.880 -1.105 900 HD13 ILE 107 HD13 ILE 107 15.480 1.537 0.206 901 H SER 108 HN SER 108 17.457 -3.421 2.170 902 HA SER 108 HA SER 108 19.517 -2.473 3.972 903 HB2 SER 108 HB2 SER 108 18.488 -4.149 5.545 904 HB3 SER 108 HB1 SER 108 17.364 -2.929 4.945 905 HG SER 108 HG SER 108 16.762 -5.311 4.914 906 H ARG 109 HN ARG 109 19.253 -4.766 1.572 907 HA ARG 109 HA ARG 109 20.576 -6.421 0.792 908 HB2 ARG 109 HB2 ARG 109 22.537 -5.178 2.720 909 HB3 ARG 109 HB1 ARG 109 22.962 -6.451 1.585 910 HG2 ARG 109 HG2 ARG 109 21.881 -3.744 0.832 911 HG3 ARG 109 HG1 ARG 109 23.578 -4.222 0.777 912 HD2 ARG 109 HD2 ARG 109 21.332 -5.477 -0.797 913 HD3 ARG 109 HD1 ARG 109 22.545 -4.368 -1.431 914 HE ARG 109 HE ARG 109 24.150 -6.228 -0.570 915 HH11 ARG 109 HH11 ARG 109 21.039 -6.685 -2.113 916 HH12 ARG 109 HH12 ARG 109 21.468 -8.209 -2.818 917 HH21 ARG 109 HH21 ARG 109 24.716 -8.239 -1.489 918 HH22 ARG 109 HH22 ARG 109 23.556 -9.097 -2.454 919 H GLU 110 HN GLU 110 18.758 -7.100 2.818 920 HA GLU 110 HA GLU 110 20.134 -8.884 4.641 921 HB2 GLU 110 HB2 GLU 110 17.202 -8.294 4.223 922 HB3 GLU 110 HB1 GLU 110 17.811 -9.415 5.432 923 HG2 GLU 110 HG2 GLU 110 19.010 -7.613 6.527 924 HG3 GLU 110 HG1 GLU 110 18.471 -6.483 5.287 925 H ASN 111 HN ASN 111 20.577 -9.515 1.982 926 HA ASN 111 HA ASN 111 18.943 -11.898 1.490 927 HB2 ASN 111 HB2 ASN 111 20.959 -10.505 -0.299 928 HB3 ASN 111 HB1 ASN 111 20.018 -11.921 -0.748 929 HD21 ASN 111 HD21 ASN 111 17.826 -11.702 -1.182 930 HD22 ASN 111 HD22 ASN 111 17.102 -10.150 -1.465 931 H ILE 112 HN ILE 112 21.143 -11.512 3.527 932 HA ILE 112 HA ILE 112 23.413 -12.976 2.587 933 HB ILE 112 HB ILE 112 22.632 -12.266 5.417 934 HG12 ILE 112 HG12 ILE 112 24.588 -10.912 3.550 935 HG13 ILE 112 HG11 ILE 112 22.980 -10.311 3.913 936 HG21 ILE 112 HG21 ILE 112 25.014 -12.648 5.920 937 HG22 ILE 112 HG22 ILE 112 25.237 -13.249 4.278 938 HG23 ILE 112 HG23 ILE 112 24.180 -14.108 5.397 939 HD11 ILE 112 HD11 ILE 112 24.685 -9.144 5.189 940 HD12 ILE 112 HD12 ILE 112 25.210 -10.671 5.898 941 HD13 ILE 112 HD13 ILE 112 23.601 -10.041 6.251 942 H THR 113 HN THR 113 20.849 -13.698 4.942 943 HA THR 113 HA THR 113 21.654 -16.459 5.145 944 HB THR 113 HB THR 113 19.509 -16.600 6.540 945 HG1 THR 113 HG1 THR 113 18.332 -14.850 6.015 946 HG21 THR 113 HG21 THR 113 20.542 -15.425 8.453 947 HG22 THR 113 HG22 THR 113 21.701 -14.686 7.348 948 HG23 THR 113 HG23 THR 113 21.693 -16.434 7.580 949 H GLU 114 HN GLU 114 19.949 -14.751 2.917 950 HA GLU 114 HA GLU 114 17.833 -16.557 2.330 951 HB2 GLU 114 HB2 GLU 114 17.784 -14.169 1.714 952 HB3 GLU 114 HB1 GLU 114 19.120 -14.433 0.611 953 HG2 GLU 114 HG2 GLU 114 17.734 -15.934 -0.718 954 HG3 GLU 114 HG1 GLU 114 16.389 -15.666 0.391 955 H VAL 115 HN VAL 115 18.462 -18.596 1.936 956 HA VAL 115 HA VAL 115 20.410 -19.035 -0.223 957 HB VAL 115 HB VAL 115 21.013 -21.190 0.952 958 HG11 VAL 115 HG11 VAL 115 22.493 -19.260 0.961 959 HG12 VAL 115 HG12 VAL 115 22.570 -20.108 2.505 960 HG13 VAL 115 HG13 VAL 115 21.656 -18.606 2.367 961 HG21 VAL 115 HG21 VAL 115 20.614 -21.298 3.375 962 HG22 VAL 115 HG22 VAL 115 19.109 -21.347 2.458 963 HG23 VAL 115 HG23 VAL 115 19.603 -19.858 3.265 964 H GLY 116 HN GLY 116 17.829 -18.805 -0.897 965 HA2 GLY 116 HA2 GLY 116 16.464 -21.356 -0.819 966 HA3 GLY 116 HA1 GLY 116 15.927 -19.907 -1.655 967 H ALA 117 HN ALA 117 18.417 -22.437 -1.830 968 HA ALA 117 HA ALA 117 18.008 -22.525 -4.734 969 HB1 ALA 117 HB1 ALA 117 19.953 -21.095 -4.336 970 HB2 ALA 117 HB2 ALA 117 20.411 -22.599 -5.134 971 HB3 ALA 117 HB3 ALA 117 20.714 -22.389 -3.410 972 HA PRO 118 HA PRO 118 18.493 -26.763 -2.900 973 HB2 PRO 118 HB2 PRO 118 15.961 -27.579 -2.682 974 HB3 PRO 118 HB1 PRO 118 16.678 -26.510 -1.474 975 HG2 PRO 118 HG2 PRO 118 14.712 -25.904 -3.604 976 HG3 PRO 118 HG1 PRO 118 14.934 -25.132 -2.026 977 HD2 PRO 118 HD2 PRO 118 15.891 -24.233 -4.559 978 HD3 PRO 118 HD1 PRO 118 16.207 -23.515 -2.968 979 H THR 119 HN THR 119 17.961 -25.535 -5.743 980 HA THR 119 HA THR 119 17.396 -28.114 -7.026 981 HB THR 119 HB THR 119 16.307 -25.465 -8.011 982 HG1 THR 119 HG1 THR 119 15.234 -27.469 -6.345 983 HG21 THR 119 HG21 THR 119 15.778 -28.304 -8.898 984 HG22 THR 119 HG22 THR 119 16.716 -27.101 -9.784 985 HG23 THR 119 HG23 THR 119 14.987 -26.862 -9.533 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 -38.220 20.457 -9.488 2 H2 GLY 1 HT2 GLY 1 -39.518 21.206 -8.707 3 H3 GLY 1 HT3 GLY 1 -38.543 20.108 -7.866 4 HA2 GLY 1 HA1 GLY 1 -37.664 22.734 -8.933 5 HA3 GLY 1 HA2 GLY 1 -38.015 22.387 -7.245 6 HA PRO 2 HA PRO 2 -33.508 21.489 -8.073 7 HB2 PRO 2 HB2 PRO 2 -32.852 23.507 -6.101 8 HB3 PRO 2 HB1 PRO 2 -32.426 23.460 -7.812 9 HG2 PRO 2 HG2 PRO 2 -34.160 25.275 -6.742 10 HG3 PRO 2 HG1 PRO 2 -34.225 24.730 -8.428 11 HD2 PRO 2 HD2 PRO 2 -35.878 23.855 -6.089 12 HD3 PRO 2 HD1 PRO 2 -36.377 24.175 -7.763 13 H MET 3 HN MET 3 -35.014 19.820 -6.614 14 HA MET 3 HA MET 3 -33.890 19.742 -3.912 15 HB2 MET 3 HB2 MET 3 -36.268 19.291 -4.057 16 HB3 MET 3 HB1 MET 3 -35.994 18.035 -5.255 17 HG2 MET 3 HG2 MET 3 -34.828 16.688 -3.608 18 HG3 MET 3 HG1 MET 3 -35.038 17.955 -2.403 19 HE1 MET 3 HE1 MET 3 -37.429 15.141 -1.118 20 HE2 MET 3 HE2 MET 3 -36.097 16.218 -0.708 21 HE3 MET 3 HE3 MET 3 -35.861 14.937 -1.896 22 H ALA 4 HN ALA 4 -34.314 17.534 -6.657 23 HA ALA 4 HA ALA 4 -33.080 15.828 -7.478 24 HB1 ALA 4 HB1 ALA 4 -30.769 17.406 -6.356 25 HB2 ALA 4 HB2 ALA 4 -31.506 17.639 -7.940 26 HB3 ALA 4 HB3 ALA 4 -30.664 16.133 -7.572 27 H MET 5 HN MET 5 -34.100 14.437 -5.902 28 HA MET 5 HA MET 5 -32.600 13.714 -3.547 29 HB2 MET 5 HB2 MET 5 -34.346 12.070 -3.148 30 HB3 MET 5 HB1 MET 5 -35.062 13.624 -3.544 31 HG2 MET 5 HG2 MET 5 -35.546 12.870 -5.788 32 HG3 MET 5 HG1 MET 5 -34.735 11.338 -5.477 33 HE1 MET 5 HE1 MET 5 -38.719 12.666 -3.571 34 HE2 MET 5 HE2 MET 5 -37.815 13.596 -4.767 35 HE3 MET 5 HE3 MET 5 -37.180 13.406 -3.133 36 H LEU 6 HN LEU 6 -30.979 12.318 -3.493 37 HA LEU 6 HA LEU 6 -30.761 10.331 -5.653 38 HB2 LEU 6 HB2 LEU 6 -28.677 11.891 -4.167 39 HB3 LEU 6 HB1 LEU 6 -28.271 10.311 -4.799 40 HG LEU 6 HG LEU 6 -27.531 12.003 -6.341 41 HD11 LEU 6 HD11 LEU 6 -28.606 11.261 -8.365 42 HD12 LEU 6 HD12 LEU 6 -29.981 10.651 -7.449 43 HD13 LEU 6 HD13 LEU 6 -28.396 9.901 -7.263 44 HD21 LEU 6 HD21 LEU 6 -30.396 12.937 -6.440 45 HD22 LEU 6 HD22 LEU 6 -29.082 13.522 -7.463 46 HD23 LEU 6 HD23 LEU 6 -29.039 13.808 -5.723 47 H ALA 7 HN ALA 7 -30.817 8.245 -5.095 48 HA ALA 7 HA ALA 7 -31.322 7.490 -2.402 49 HB1 ALA 7 HB1 ALA 7 -30.727 5.758 -4.796 50 HB2 ALA 7 HB2 ALA 7 -32.323 6.309 -4.289 51 HB3 ALA 7 HB3 ALA 7 -31.401 5.213 -3.260 52 H ARG 8 HN ARG 8 -29.565 8.054 -1.157 53 HA ARG 8 HA ARG 8 -26.914 7.115 -1.852 54 HB2 ARG 8 HB2 ARG 8 -27.922 8.611 0.575 55 HB3 ARG 8 HB1 ARG 8 -26.233 8.270 0.229 56 HG2 ARG 8 HG2 ARG 8 -26.279 9.664 -1.714 57 HG3 ARG 8 HG1 ARG 8 -28.024 9.877 -1.577 58 HD2 ARG 8 HD2 ARG 8 -26.863 11.844 -0.753 59 HD3 ARG 8 HD1 ARG 8 -27.708 11.029 0.560 60 HE ARG 8 HE ARG 8 -24.857 10.484 0.160 61 HH11 ARG 8 HH11 ARG 8 -27.404 11.948 2.058 62 HH12 ARG 8 HH12 ARG 8 -26.409 12.178 3.460 63 HH21 ARG 8 HH21 ARG 8 -23.530 10.803 1.998 64 HH22 ARG 8 HH22 ARG 8 -24.195 11.537 3.422 65 H ARG 9 HN ARG 9 -28.462 4.955 -1.660 66 HA ARG 9 HA ARG 9 -28.298 3.851 1.030 67 HB2 ARG 9 HB2 ARG 9 -29.456 2.744 -1.529 68 HB3 ARG 9 HB1 ARG 9 -29.445 1.879 0.000 69 HG2 ARG 9 HG2 ARG 9 -30.824 3.625 1.002 70 HG3 ARG 9 HG1 ARG 9 -30.835 4.494 -0.537 71 HD2 ARG 9 HD2 ARG 9 -31.922 2.602 -1.611 72 HD3 ARG 9 HD1 ARG 9 -31.884 1.705 -0.097 73 HE ARG 9 HE ARG 9 -33.271 4.256 -0.048 74 HH11 ARG 9 HH11 ARG 9 -33.470 0.774 -0.292 75 HH12 ARG 9 HH12 ARG 9 -35.168 0.710 0.050 76 HH21 ARG 9 HH21 ARG 9 -35.514 4.186 0.403 77 HH22 ARG 9 HH22 ARG 9 -36.334 2.658 0.440 78 H GLN 10 HN GLN 10 -27.299 2.901 -2.249 79 HA GLN 10 HA GLN 10 -25.617 0.809 -1.228 80 HB2 GLN 10 HB2 GLN 10 -25.826 1.847 -4.056 81 HB3 GLN 10 HB1 GLN 10 -25.140 0.311 -3.548 82 HG2 GLN 10 HG2 GLN 10 -28.029 1.129 -3.313 83 HG3 GLN 10 HG1 GLN 10 -27.352 0.010 -4.492 84 HE21 GLN 10 HE21 GLN 10 -26.803 -2.052 -3.866 85 HE22 GLN 10 HE22 GLN 10 -27.274 -2.724 -2.344 86 H ARG 11 HN ARG 11 -24.653 2.857 0.004 87 HA ARG 11 HA ARG 11 -22.709 4.433 -1.276 88 HB2 ARG 11 HB2 ARG 11 -22.716 3.507 1.606 89 HB3 ARG 11 HB1 ARG 11 -21.884 4.914 0.958 90 HG2 ARG 11 HG2 ARG 11 -23.981 5.993 0.474 91 HG3 ARG 11 HG1 ARG 11 -24.873 4.554 0.968 92 HD2 ARG 11 HD2 ARG 11 -23.875 4.819 3.246 93 HD3 ARG 11 HD1 ARG 11 -23.201 6.358 2.709 94 HE ARG 11 HE ARG 11 -25.974 6.318 2.193 95 HH11 ARG 11 HH11 ARG 11 -23.725 6.503 4.871 96 HH12 ARG 11 HH12 ARG 11 -24.818 7.379 5.895 97 HH21 ARG 11 HH21 ARG 11 -27.413 7.481 3.537 98 HH22 ARG 11 HH22 ARG 11 -26.916 7.931 5.136 99 H ASP 12 HN ASP 12 -20.595 4.078 -1.738 100 HA ASP 12 HA ASP 12 -19.783 1.283 -1.778 101 HB2 ASP 12 HB2 ASP 12 -18.672 3.747 -3.138 102 HB3 ASP 12 HB1 ASP 12 -17.953 2.146 -3.283 103 HA PRO 13 HA PRO 13 -17.191 2.230 1.850 104 HB2 PRO 13 HB2 PRO 13 -16.763 -0.678 1.768 105 HB3 PRO 13 HB1 PRO 13 -17.410 0.315 3.075 106 HG2 PRO 13 HG2 PRO 13 -18.953 -1.375 1.660 107 HG3 PRO 13 HG1 PRO 13 -19.569 0.158 2.301 108 HD2 PRO 13 HD2 PRO 13 -18.729 -0.530 -0.486 109 HD3 PRO 13 HD1 PRO 13 -20.097 0.457 0.071 110 H LEU 14 HN LEU 14 -16.526 -0.006 -0.788 111 HA LEU 14 HA LEU 14 -13.739 -0.184 -0.494 112 HB2 LEU 14 HB2 LEU 14 -15.313 -0.367 -3.069 113 HB3 LEU 14 HB1 LEU 14 -13.714 -1.019 -2.775 114 HG LEU 14 HG LEU 14 -16.225 -1.951 -1.375 115 HD11 LEU 14 HD11 LEU 14 -14.689 -3.182 -3.652 116 HD12 LEU 14 HD12 LEU 14 -16.326 -2.529 -3.714 117 HD13 LEU 14 HD13 LEU 14 -15.985 -3.970 -2.754 118 HD21 LEU 14 HD21 LEU 14 -14.305 -2.336 0.001 119 HD22 LEU 14 HD22 LEU 14 -13.398 -2.989 -1.361 120 HD23 LEU 14 HD23 LEU 14 -14.787 -3.870 -0.723 121 H GLN 15 HN GLN 15 -15.753 2.176 -2.175 122 HA GLN 15 HA GLN 15 -13.665 3.474 -3.559 123 HB2 GLN 15 HB2 GLN 15 -16.028 3.768 -4.160 124 HB3 GLN 15 HB1 GLN 15 -16.321 4.587 -2.631 125 HG2 GLN 15 HG2 GLN 15 -14.813 6.380 -3.286 126 HG3 GLN 15 HG1 GLN 15 -14.474 5.553 -4.804 127 HE21 GLN 15 HE21 GLN 15 -17.646 5.706 -3.319 128 HE22 GLN 15 HE22 GLN 15 -18.363 6.711 -4.529 129 H ALA 16 HN ALA 16 -15.049 3.956 -0.342 130 HA ALA 16 HA ALA 16 -13.659 6.355 0.245 131 HB1 ALA 16 HB1 ALA 16 -15.652 5.635 1.480 132 HB2 ALA 16 HB2 ALA 16 -14.289 5.935 2.557 133 HB3 ALA 16 HB3 ALA 16 -14.743 4.280 2.149 134 H LEU 17 HN LEU 17 -13.025 2.974 1.097 135 HA LEU 17 HA LEU 17 -10.527 3.361 2.288 136 HB2 LEU 17 HB2 LEU 17 -11.726 1.238 2.416 137 HB3 LEU 17 HB1 LEU 17 -11.483 0.983 0.697 138 HG LEU 17 HG LEU 17 -9.021 0.950 1.103 139 HD11 LEU 17 HD11 LEU 17 -8.231 0.600 3.398 140 HD12 LEU 17 HD12 LEU 17 -9.854 0.949 3.996 141 HD13 LEU 17 HD13 LEU 17 -8.932 2.202 3.165 142 HD21 LEU 17 HD21 LEU 17 -8.985 -1.290 2.088 143 HD22 LEU 17 HD22 LEU 17 -10.253 -1.114 0.877 144 HD23 LEU 17 HD23 LEU 17 -10.661 -1.084 2.592 145 H ARG 18 HN ARG 18 -11.408 2.998 -1.103 146 HA ARG 18 HA ARG 18 -8.852 2.666 -2.173 147 HB2 ARG 18 HB2 ARG 18 -11.030 2.396 -3.389 148 HB3 ARG 18 HB1 ARG 18 -11.126 4.148 -3.489 149 HG2 ARG 18 HG2 ARG 18 -9.265 4.275 -4.920 150 HG3 ARG 18 HG1 ARG 18 -8.786 2.610 -4.573 151 HD2 ARG 18 HD2 ARG 18 -11.204 3.543 -6.111 152 HD3 ARG 18 HD1 ARG 18 -9.818 2.638 -6.730 153 HE ARG 18 HE ARG 18 -10.589 0.855 -5.070 154 HH11 ARG 18 HH11 ARG 18 -12.744 2.986 -6.829 155 HH12 ARG 18 HH12 ARG 18 -14.117 1.942 -6.655 156 HH21 ARG 18 HH21 ARG 18 -12.362 -0.498 -4.823 157 HH22 ARG 18 HH22 ARG 18 -13.906 -0.045 -5.497 158 H ARG 19 HN ARG 19 -10.555 5.586 -1.194 159 HA ARG 19 HA ARG 19 -8.777 7.494 -2.211 160 HB2 ARG 19 HB2 ARG 19 -10.510 7.462 0.260 161 HB3 ARG 19 HB1 ARG 19 -9.551 8.863 -0.192 162 HG2 ARG 19 HG2 ARG 19 -11.605 7.610 -1.995 163 HG3 ARG 19 HG1 ARG 19 -11.953 8.936 -0.883 164 HD2 ARG 19 HD2 ARG 19 -9.950 8.977 -3.143 165 HD3 ARG 19 HD1 ARG 19 -11.520 9.784 -3.125 166 HE ARG 19 HE ARG 19 -9.998 10.623 -0.905 167 HH11 ARG 19 HH11 ARG 19 -10.066 10.963 -4.386 168 HH12 ARG 19 HH12 ARG 19 -9.347 12.542 -4.371 169 HH21 ARG 19 HH21 ARG 19 -9.064 12.694 -0.876 170 HH22 ARG 19 HH22 ARG 19 -8.777 13.529 -2.371 171 H ARG 20 HN ARG 20 -8.736 5.656 0.801 172 HA ARG 20 HA ARG 20 -6.304 6.756 1.772 173 HB2 ARG 20 HB2 ARG 20 -7.909 5.732 3.280 174 HB3 ARG 20 HB1 ARG 20 -7.750 4.193 2.455 175 HG2 ARG 20 HG2 ARG 20 -6.542 4.126 4.532 176 HG3 ARG 20 HG1 ARG 20 -5.408 4.062 3.188 177 HD2 ARG 20 HD2 ARG 20 -4.916 6.433 3.472 178 HD3 ARG 20 HD1 ARG 20 -6.070 6.522 4.805 179 HE ARG 20 HE ARG 20 -4.386 4.561 5.606 180 HH11 ARG 20 HH11 ARG 20 -3.869 7.838 4.491 181 HH12 ARG 20 HH12 ARG 20 -2.393 8.038 5.375 182 HH21 ARG 20 HH21 ARG 20 -2.452 4.822 6.768 183 HH22 ARG 20 HH22 ARG 20 -1.592 6.329 6.689 184 H ASN 21 HN ASN 21 -7.091 3.881 -0.169 185 HA ASN 21 HA ASN 21 -4.467 2.836 -0.279 186 HB2 ASN 21 HB2 ASN 21 -6.730 2.601 -2.278 187 HB3 ASN 21 HB1 ASN 21 -5.204 1.739 -2.424 188 HD21 ASN 21 HD21 ASN 21 -7.746 0.531 -2.250 189 HD22 ASN 21 HD22 ASN 21 -7.777 -0.394 -0.789 190 H GLN 22 HN GLN 22 -6.136 5.220 -2.258 191 HA GLN 22 HA GLN 22 -4.126 5.660 -4.162 192 HB2 GLN 22 HB2 GLN 22 -6.432 6.481 -4.382 193 HB3 GLN 22 HB1 GLN 22 -6.174 7.583 -3.038 194 HG2 GLN 22 HG2 GLN 22 -4.513 8.800 -4.333 195 HG3 GLN 22 HG1 GLN 22 -4.722 7.673 -5.674 196 HE21 GLN 22 HE21 GLN 22 -5.370 9.327 -7.077 197 HE22 GLN 22 HE22 GLN 22 -6.919 10.079 -6.955 198 H GLU 23 HN GLU 23 -4.518 6.719 -0.883 199 HA GLU 23 HA GLU 23 -2.596 8.832 -0.938 200 HB2 GLU 23 HB2 GLU 23 -4.429 8.604 0.762 201 HB3 GLU 23 HB1 GLU 23 -3.584 7.211 1.422 202 HG2 GLU 23 HG2 GLU 23 -3.083 9.069 2.795 203 HG3 GLU 23 HG1 GLU 23 -1.636 8.700 1.861 204 H LEU 24 HN LEU 24 -2.594 5.393 -0.156 205 HA LEU 24 HA LEU 24 0.122 5.254 0.669 206 HB2 LEU 24 HB2 LEU 24 -1.641 3.078 -0.468 207 HB3 LEU 24 HB1 LEU 24 -0.096 2.824 0.317 208 HG LEU 24 HG LEU 24 -2.608 3.868 1.635 209 HD11 LEU 24 HD11 LEU 24 -2.586 1.780 2.841 210 HD12 LEU 24 HD12 LEU 24 -1.095 1.295 2.041 211 HD13 LEU 24 HD13 LEU 24 -2.583 1.450 1.109 212 HD21 LEU 24 HD21 LEU 24 -1.314 3.726 3.719 213 HD22 LEU 24 HD22 LEU 24 -0.653 4.925 2.608 214 HD23 LEU 24 HD23 LEU 24 0.134 3.357 2.784 215 H LYS 25 HN LYS 25 -1.527 4.812 -2.430 216 HA LYS 25 HA LYS 25 0.624 3.909 -3.952 217 HB2 LYS 25 HB2 LYS 25 -1.851 5.461 -4.592 218 HB3 LYS 25 HB1 LYS 25 -0.618 5.280 -5.827 219 HG2 LYS 25 HG2 LYS 25 -1.902 2.980 -4.378 220 HG3 LYS 25 HG1 LYS 25 -2.450 3.605 -5.934 221 HD2 LYS 25 HD2 LYS 25 0.392 2.721 -5.517 222 HD3 LYS 25 HD1 LYS 25 -0.876 1.565 -5.915 223 HE2 LYS 25 HE2 LYS 25 0.122 2.138 -7.965 224 HE3 LYS 25 HE1 LYS 25 -1.396 3.024 -7.915 225 HZ1 LYS 25 HZ1 LYS 25 -0.231 5.024 -7.384 226 HZ2 LYS 25 HZ2 LYS 25 0.511 4.335 -8.733 227 HZ3 LYS 25 HZ3 LYS 25 1.242 4.206 -7.215 228 H GLN 26 HN GLN 26 -0.409 7.226 -3.264 229 HA GLN 26 HA GLN 26 1.510 8.538 -4.815 230 HB2 GLN 26 HB2 GLN 26 0.245 9.456 -2.229 231 HB3 GLN 26 HB1 GLN 26 1.073 10.490 -3.382 232 HG2 GLN 26 HG2 GLN 26 -0.609 10.049 -5.053 233 HG3 GLN 26 HG1 GLN 26 -1.411 8.900 -3.982 234 HE21 GLN 26 HE21 GLN 26 -0.023 11.924 -2.917 235 HE22 GLN 26 HE22 GLN 26 -1.518 12.694 -2.523 236 H GLN 27 HN GLN 27 1.661 7.243 -1.551 237 HA GLN 27 HA GLN 27 4.152 8.497 -0.908 238 HB2 GLN 27 HB2 GLN 27 2.520 6.342 0.409 239 HB3 GLN 27 HB1 GLN 27 4.075 6.864 1.045 240 HG2 GLN 27 HG2 GLN 27 3.270 9.066 1.426 241 HG3 GLN 27 HG1 GLN 27 1.780 8.740 0.548 242 HE21 GLN 27 HE21 GLN 27 0.157 7.550 1.551 243 HE22 GLN 27 HE22 GLN 27 0.153 7.255 3.253 244 H VAL 28 HN VAL 28 3.161 5.381 -2.206 245 HA VAL 28 HA VAL 28 5.679 4.095 -1.881 246 HB VAL 28 HB VAL 28 3.378 3.481 -3.750 247 HG11 VAL 28 HG11 VAL 28 5.452 2.603 -4.669 248 HG12 VAL 28 HG12 VAL 28 4.435 1.291 -4.068 249 HG13 VAL 28 HG13 VAL 28 5.824 1.834 -3.127 250 HG21 VAL 28 HG21 VAL 28 2.814 3.210 -1.397 251 HG22 VAL 28 HG22 VAL 28 4.247 2.210 -1.154 252 HG23 VAL 28 HG23 VAL 28 2.936 1.636 -2.185 253 H ASP 29 HN ASP 29 4.072 5.697 -4.619 254 HA ASP 29 HA ASP 29 6.171 5.440 -6.460 255 HB2 ASP 29 HB2 ASP 29 3.926 7.437 -6.214 256 HB3 ASP 29 HB1 ASP 29 5.121 7.550 -7.501 257 H SER 30 HN SER 30 5.546 7.835 -3.953 258 HA SER 30 HA SER 30 7.646 9.598 -4.614 259 HB2 SER 30 HB2 SER 30 6.380 9.028 -1.919 260 HB3 SER 30 HB1 SER 30 7.443 10.388 -2.265 261 HG SER 30 HG SER 30 4.824 9.883 -3.193 262 H LEU 31 HN LEU 31 7.509 6.665 -2.672 263 HA LEU 31 HA LEU 31 10.074 6.859 -1.516 264 HB2 LEU 31 HB2 LEU 31 8.284 5.327 -0.741 265 HB3 LEU 31 HB1 LEU 31 8.502 4.372 -2.195 266 HG LEU 31 HG LEU 31 10.878 3.969 -1.460 267 HD11 LEU 31 HD11 LEU 31 11.310 4.277 0.969 268 HD12 LEU 31 HD12 LEU 31 9.842 5.250 1.059 269 HD13 LEU 31 HD13 LEU 31 11.195 5.784 0.061 270 HD21 LEU 31 HD21 LEU 31 9.071 2.323 -1.183 271 HD22 LEU 31 HD22 LEU 31 8.722 3.001 0.407 272 HD23 LEU 31 HD23 LEU 31 10.275 2.229 0.100 273 H LEU 32 HN LEU 32 8.904 5.261 -4.461 274 HA LEU 32 HA LEU 32 11.350 4.203 -5.318 275 HB2 LEU 32 HB2 LEU 32 8.996 5.178 -6.947 276 HB3 LEU 32 HB1 LEU 32 10.298 4.181 -7.568 277 HG LEU 32 HG LEU 32 8.344 3.365 -5.417 278 HD11 LEU 32 HD11 LEU 32 7.463 1.845 -7.126 279 HD12 LEU 32 HD12 LEU 32 8.556 2.555 -8.311 280 HD13 LEU 32 HD13 LEU 32 7.280 3.536 -7.591 281 HD21 LEU 32 HD21 LEU 32 9.314 1.136 -5.701 282 HD22 LEU 32 HD22 LEU 32 10.503 2.301 -5.120 283 HD23 LEU 32 HD23 LEU 32 10.511 1.803 -6.812 284 H SER 33 HN SER 33 9.869 7.365 -5.768 285 HA SER 33 HA SER 33 11.731 8.373 -7.629 286 HB2 SER 33 HB2 SER 33 10.027 9.872 -5.625 287 HB3 SER 33 HB1 SER 33 10.841 10.585 -7.017 288 HG SER 33 HG SER 33 9.243 8.407 -7.597 289 H GLU 34 HN GLU 34 11.746 8.187 -4.109 290 HA GLU 34 HA GLU 34 13.997 9.961 -3.824 291 HB2 GLU 34 HB2 GLU 34 12.671 8.072 -1.879 292 HB3 GLU 34 HB1 GLU 34 14.062 9.064 -1.473 293 HG2 GLU 34 HG2 GLU 34 12.723 11.074 -2.054 294 HG3 GLU 34 HG1 GLU 34 11.325 10.021 -2.265 295 H SER 35 HN SER 35 13.424 6.503 -3.911 296 HA SER 35 HA SER 35 16.050 5.670 -3.323 297 HB2 SER 35 HB2 SER 35 14.053 4.191 -3.201 298 HB3 SER 35 HB1 SER 35 13.949 4.222 -4.960 299 HG SER 35 HG SER 35 16.435 3.535 -4.028 300 H GLN 36 HN GLN 36 14.949 7.387 -5.972 301 HA GLN 36 HA GLN 36 16.793 6.079 -7.839 302 HB2 GLN 36 HB2 GLN 36 14.387 6.230 -8.516 303 HB3 GLN 36 HB1 GLN 36 14.515 7.979 -8.440 304 HG2 GLN 36 HG2 GLN 36 14.680 7.198 -10.723 305 HG3 GLN 36 HG1 GLN 36 16.191 7.942 -10.207 306 HE21 GLN 36 HE21 GLN 36 18.013 6.677 -9.965 307 HE22 GLN 36 HE22 GLN 36 18.106 5.050 -10.546 308 H LEU 37 HN LEU 37 16.395 8.684 -5.788 309 HA LEU 37 HA LEU 37 17.638 10.735 -7.355 310 HB2 LEU 37 HB2 LEU 37 17.101 10.548 -4.392 311 HB3 LEU 37 HB1 LEU 37 17.705 11.978 -5.202 312 HG LEU 37 HG LEU 37 15.024 10.710 -5.755 313 HD11 LEU 37 HD11 LEU 37 15.159 11.630 -3.484 314 HD12 LEU 37 HD12 LEU 37 14.077 12.567 -4.514 315 HD13 LEU 37 HD13 LEU 37 15.692 13.172 -4.151 316 HD21 LEU 37 HD21 LEU 37 16.274 13.298 -6.652 317 HD22 LEU 37 HD22 LEU 37 14.576 12.876 -6.870 318 HD23 LEU 37 HD23 LEU 37 15.828 11.925 -7.664 319 H LYS 38 HN LYS 38 19.701 11.324 -7.430 320 HA LYS 38 HA LYS 38 21.713 9.495 -6.560 321 HB2 LYS 38 HB2 LYS 38 21.977 12.269 -7.743 322 HB3 LYS 38 HB1 LYS 38 23.279 11.097 -7.588 323 HG2 LYS 38 HG2 LYS 38 22.178 9.602 -9.128 324 HG3 LYS 38 HG1 LYS 38 20.779 10.672 -9.217 325 HD2 LYS 38 HD2 LYS 38 22.221 12.428 -10.175 326 HD3 LYS 38 HD1 LYS 38 23.584 11.307 -10.134 327 HE2 LYS 38 HE2 LYS 38 22.581 11.406 -12.361 328 HE3 LYS 38 HE1 LYS 38 22.408 9.802 -11.653 329 HZ1 LYS 38 HZ1 LYS 38 20.130 10.285 -11.115 330 HZ2 LYS 38 HZ2 LYS 38 20.377 10.605 -12.758 331 HZ3 LYS 38 HZ3 LYS 38 20.286 11.880 -11.654 332 H GLU 39 HN GLU 39 20.418 12.517 -5.399 333 HA GLU 39 HA GLU 39 22.411 13.024 -3.431 334 HB2 GLU 39 HB2 GLU 39 20.876 14.772 -4.217 335 HB3 GLU 39 HB1 GLU 39 19.512 13.892 -3.543 336 HG2 GLU 39 HG2 GLU 39 20.506 14.170 -1.293 337 HG3 GLU 39 HG1 GLU 39 21.774 15.156 -2.015 338 H ALA 40 HN ALA 40 19.650 10.958 -3.620 339 HA ALA 40 HA ALA 40 19.562 10.501 -0.757 340 HB1 ALA 40 HB1 ALA 40 17.460 10.718 -1.962 341 HB2 ALA 40 HB2 ALA 40 17.615 9.116 -1.241 342 HB3 ALA 40 HB3 ALA 40 17.890 9.336 -2.968 343 H LEU 41 HN LEU 41 21.448 9.451 -3.169 344 HA LEU 41 HA LEU 41 21.500 6.638 -2.468 345 HB2 LEU 41 HB2 LEU 41 21.830 7.482 -4.808 346 HB3 LEU 41 HB1 LEU 41 23.353 8.178 -4.289 347 HG LEU 41 HG LEU 41 24.186 5.917 -3.752 348 HD11 LEU 41 HD11 LEU 41 21.562 5.007 -4.920 349 HD12 LEU 41 HD12 LEU 41 22.097 4.809 -3.251 350 HD13 LEU 41 HD13 LEU 41 22.931 3.961 -4.551 351 HD21 LEU 41 HD21 LEU 41 23.136 6.231 -6.560 352 HD22 LEU 41 HD22 LEU 41 24.439 5.154 -6.060 353 HD23 LEU 41 HD23 LEU 41 24.642 6.900 -5.933 354 H GLU 42 HN GLU 42 22.138 8.788 -0.551 355 HA GLU 42 HA GLU 42 24.940 8.388 0.066 356 HB2 GLU 42 HB2 GLU 42 22.753 9.974 1.429 357 HB3 GLU 42 HB1 GLU 42 24.386 9.845 2.062 358 HG2 GLU 42 HG2 GLU 42 23.705 10.945 -0.655 359 HG3 GLU 42 HG1 GLU 42 23.950 11.924 0.791 360 HA PRO 43 HA PRO 43 24.679 4.872 2.529 361 HB2 PRO 43 HB2 PRO 43 25.911 5.602 4.913 362 HB3 PRO 43 HB1 PRO 43 26.736 5.049 3.454 363 HG2 PRO 43 HG2 PRO 43 26.282 7.829 4.435 364 HG3 PRO 43 HG1 PRO 43 27.706 7.138 3.636 365 HD2 PRO 43 HD2 PRO 43 25.993 8.702 2.306 366 HD3 PRO 43 HD1 PRO 43 26.749 7.293 1.527 367 H ASN 44 HN ASN 44 23.940 7.681 4.635 368 HA ASN 44 HA ASN 44 22.551 6.018 6.506 369 HB2 ASN 44 HB2 ASN 44 22.655 9.034 6.304 370 HB3 ASN 44 HB1 ASN 44 21.989 8.133 7.661 371 HD21 ASN 44 HD21 ASN 44 23.397 7.030 9.047 372 HD22 ASN 44 HD22 ASN 44 25.093 7.361 9.082 373 H LYS 45 HN LYS 45 21.583 8.064 3.823 374 HA LYS 45 HA LYS 45 18.849 8.229 4.366 375 HB2 LYS 45 HB2 LYS 45 19.845 9.604 2.657 376 HB3 LYS 45 HB1 LYS 45 20.359 8.194 1.746 377 HG2 LYS 45 HG2 LYS 45 18.488 9.142 0.628 378 HG3 LYS 45 HG1 LYS 45 17.952 7.641 1.378 379 HD2 LYS 45 HD2 LYS 45 16.898 8.867 3.173 380 HD3 LYS 45 HD1 LYS 45 17.537 10.392 2.551 381 HE2 LYS 45 HE2 LYS 45 16.247 10.067 0.481 382 HE3 LYS 45 HE1 LYS 45 15.587 8.571 1.137 383 HZ1 LYS 45 HZ1 LYS 45 15.208 11.262 2.328 384 HZ2 LYS 45 HZ2 LYS 45 14.516 9.822 2.878 385 HZ3 LYS 45 HZ3 LYS 45 14.065 10.457 1.373 386 H ARG 46 HN ARG 46 20.775 5.668 2.950 387 HA ARG 46 HA ARG 46 18.721 4.082 1.900 388 HB2 ARG 46 HB2 ARG 46 21.330 3.199 3.150 389 HB3 ARG 46 HB1 ARG 46 20.281 2.180 2.174 390 HG2 ARG 46 HG2 ARG 46 20.632 3.665 0.260 391 HG3 ARG 46 HG1 ARG 46 21.705 4.664 1.244 392 HD2 ARG 46 HD2 ARG 46 22.115 1.759 0.542 393 HD3 ARG 46 HD1 ARG 46 22.979 3.128 -0.154 394 HE ARG 46 HE ARG 46 23.389 3.321 2.554 395 HH11 ARG 46 HH11 ARG 46 23.956 0.859 0.137 396 HH12 ARG 46 HH12 ARG 46 25.377 0.241 0.914 397 HH21 ARG 46 HH21 ARG 46 25.256 2.493 3.596 398 HH22 ARG 46 HH22 ARG 46 26.115 1.165 2.883 399 H GLN 47 HN GLN 47 20.039 4.292 5.180 400 HA GLN 47 HA GLN 47 18.501 2.183 6.270 401 HB2 GLN 47 HB2 GLN 47 19.872 4.559 7.506 402 HB3 GLN 47 HB1 GLN 47 18.906 3.458 8.472 403 HG2 GLN 47 HG2 GLN 47 21.108 2.741 8.734 404 HG3 GLN 47 HG1 GLN 47 20.393 1.606 7.594 405 HE21 GLN 47 HE21 GLN 47 21.104 1.584 5.476 406 HE22 GLN 47 HE22 GLN 47 22.539 2.409 4.973 407 H HIS 48 HN HIS 48 17.949 5.618 5.840 408 HA HIS 48 HA HIS 48 15.574 5.737 7.399 409 HB2 HIS 48 HB2 HIS 48 17.108 7.688 6.651 410 HB3 HIS 48 HB1 HIS 48 16.222 7.628 5.131 411 HD1 HIS 48 HD1 HIS 48 16.185 9.246 8.321 412 HD2 HIS 48 HD2 HIS 48 13.270 7.961 5.646 413 HE1 HIS 48 HE1 HIS 48 14.100 10.515 8.925 414 HE2 HIS 48 HE2 HIS 48 12.383 9.797 7.233 415 H ILE 49 HN ILE 49 16.247 5.199 3.968 416 HA ILE 49 HA ILE 49 13.550 5.254 3.096 417 HB ILE 49 HB ILE 49 15.943 3.847 1.886 418 HG12 ILE 49 HG12 ILE 49 14.611 6.476 1.197 419 HG13 ILE 49 HG11 ILE 49 16.153 6.299 2.026 420 HG21 ILE 49 HG21 ILE 49 14.655 3.674 -0.157 421 HG22 ILE 49 HG22 ILE 49 13.274 4.447 0.619 422 HG23 ILE 49 HG23 ILE 49 13.810 2.854 1.157 423 HD11 ILE 49 HD11 ILE 49 16.486 6.851 -0.307 424 HD12 ILE 49 HD12 ILE 49 15.547 5.440 -0.795 425 HD13 ILE 49 HD13 ILE 49 17.090 5.230 0.032 426 H TYR 50 HN TYR 50 15.710 2.541 3.966 427 HA TYR 50 HA TYR 50 13.947 0.449 3.722 428 HB2 TYR 50 HB2 TYR 50 16.337 0.200 4.263 429 HB3 TYR 50 HB1 TYR 50 16.043 0.838 5.875 430 HD1 TYR 50 HD1 TYR 50 15.638 -0.640 7.622 431 HD2 TYR 50 HD2 TYR 50 15.031 -1.966 3.627 432 HE1 TYR 50 HE1 TYR 50 15.247 -2.918 8.447 433 HE2 TYR 50 HE2 TYR 50 14.634 -4.253 4.444 434 HH TYR 50 HH TYR 50 15.185 -5.628 6.415 435 H GLN 51 HN GLN 51 14.287 2.683 6.456 436 HA GLN 51 HA GLN 51 12.344 1.388 8.092 437 HB2 GLN 51 HB2 GLN 51 14.111 2.969 8.939 438 HB3 GLN 51 HB1 GLN 51 13.209 4.285 8.201 439 HG2 GLN 51 HG2 GLN 51 12.740 4.155 10.570 440 HG3 GLN 51 HG1 GLN 51 11.293 3.792 9.630 441 HE21 GLN 51 HE21 GLN 51 10.336 2.686 11.319 442 HE22 GLN 51 HE22 GLN 51 10.873 1.121 11.831 443 H ARG 52 HN ARG 52 12.229 4.068 5.793 444 HA ARG 52 HA ARG 52 9.541 4.799 6.206 445 HB2 ARG 52 HB2 ARG 52 11.244 6.151 4.960 446 HB3 ARG 52 HB1 ARG 52 11.134 5.000 3.639 447 HG2 ARG 52 HG2 ARG 52 9.821 6.959 3.137 448 HG3 ARG 52 HG1 ARG 52 8.759 5.567 3.354 449 HD2 ARG 52 HD2 ARG 52 8.257 6.301 5.630 450 HD3 ARG 52 HD1 ARG 52 9.332 7.684 5.432 451 HE ARG 52 HE ARG 52 7.638 8.112 3.432 452 HH11 ARG 52 HH11 ARG 52 6.981 7.116 6.731 453 HH12 ARG 52 HH12 ARG 52 5.416 7.869 6.776 454 HH21 ARG 52 HH21 ARG 52 5.582 9.103 3.497 455 HH22 ARG 52 HH22 ARG 52 4.620 9.001 4.938 456 H CYS 53 HN CYS 53 11.060 2.290 4.350 457 HA CYS 53 HA CYS 53 8.816 1.535 2.775 458 HB2 CYS 53 HB2 CYS 53 11.064 0.808 2.149 459 HB3 CYS 53 HB1 CYS 53 11.226 -0.083 3.664 460 HG CYS 53 HG CYS 53 10.435 -1.359 0.920 461 H ILE 54 HN ILE 54 10.124 0.381 5.858 462 HA ILE 54 HA ILE 54 8.247 -1.625 6.353 463 HB ILE 54 HB ILE 54 9.805 0.091 8.283 464 HG12 ILE 54 HG12 ILE 54 10.192 -2.750 7.295 465 HG13 ILE 54 HG11 ILE 54 11.172 -1.356 6.845 466 HG21 ILE 54 HG21 ILE 54 9.260 -1.552 10.006 467 HG22 ILE 54 HG22 ILE 54 8.210 -2.399 8.869 468 HG23 ILE 54 HG23 ILE 54 7.807 -0.763 9.390 469 HD11 ILE 54 HD11 ILE 54 10.951 -2.535 9.605 470 HD12 ILE 54 HD12 ILE 54 11.950 -1.157 9.146 471 HD13 ILE 54 HD13 ILE 54 12.294 -2.755 8.485 472 H GLN 55 HN GLN 55 8.156 1.833 7.112 473 HA GLN 55 HA GLN 55 5.810 1.818 8.655 474 HB2 GLN 55 HB2 GLN 55 6.939 3.979 6.875 475 HB3 GLN 55 HB1 GLN 55 5.630 4.223 8.022 476 HG2 GLN 55 HG2 GLN 55 7.098 3.705 9.863 477 HG3 GLN 55 HG1 GLN 55 8.413 3.335 8.745 478 HE21 GLN 55 HE21 GLN 55 8.226 5.346 10.874 479 HE22 GLN 55 HE22 GLN 55 8.525 6.870 10.112 480 H LEU 56 HN LEU 56 6.192 2.638 5.200 481 HA LEU 56 HA LEU 56 3.516 2.774 4.558 482 HB2 LEU 56 HB2 LEU 56 5.708 1.747 2.753 483 HB3 LEU 56 HB1 LEU 56 4.172 2.408 2.238 484 HG LEU 56 HG LEU 56 6.390 3.925 3.617 485 HD11 LEU 56 HD11 LEU 56 5.356 4.032 0.789 486 HD12 LEU 56 HD12 LEU 56 6.908 3.379 1.316 487 HD13 LEU 56 HD13 LEU 56 6.575 5.104 1.480 488 HD21 LEU 56 HD21 LEU 56 3.701 4.872 2.628 489 HD22 LEU 56 HD22 LEU 56 5.016 5.920 3.154 490 HD23 LEU 56 HD23 LEU 56 4.253 4.822 4.302 491 H LYS 57 HN LYS 57 5.584 -0.085 4.707 492 HA LYS 57 HA LYS 57 3.738 -1.881 3.562 493 HB2 LYS 57 HB2 LYS 57 6.147 -2.381 3.882 494 HB3 LYS 57 HB1 LYS 57 5.876 -2.468 5.617 495 HG2 LYS 57 HG2 LYS 57 4.377 -4.366 5.298 496 HG3 LYS 57 HG1 LYS 57 4.622 -4.270 3.554 497 HD2 LYS 57 HD2 LYS 57 6.019 -6.014 4.475 498 HD3 LYS 57 HD1 LYS 57 7.031 -4.690 3.900 499 HE2 LYS 57 HE2 LYS 57 7.245 -3.859 6.188 500 HE3 LYS 57 HE1 LYS 57 6.219 -5.171 6.765 501 HZ1 LYS 57 HZ1 LYS 57 7.875 -6.746 5.947 502 HZ2 LYS 57 HZ2 LYS 57 8.530 -5.699 7.099 503 HZ3 LYS 57 HZ3 LYS 57 8.868 -5.465 5.462 504 H GLN 58 HN GLN 58 4.296 -0.815 6.867 505 HA GLN 58 HA GLN 58 2.389 -2.452 8.128 506 HB2 GLN 58 HB2 GLN 58 4.100 -1.206 9.371 507 HB3 GLN 58 HB1 GLN 58 3.350 0.312 8.898 508 HG2 GLN 58 HG2 GLN 58 2.777 -0.241 11.171 509 HG3 GLN 58 HG1 GLN 58 1.340 -0.294 10.151 510 HE21 GLN 58 HE21 GLN 58 0.371 -2.277 9.712 511 HE22 GLN 58 HE22 GLN 58 0.727 -3.697 10.635 512 H ALA 59 HN ALA 59 2.137 0.723 6.591 513 HA ALA 59 HA ALA 59 -0.537 1.245 7.270 514 HB1 ALA 59 HB1 ALA 59 -0.467 2.926 5.537 515 HB2 ALA 59 HB2 ALA 59 0.974 2.185 4.838 516 HB3 ALA 59 HB3 ALA 59 1.054 2.932 6.433 517 H ILE 60 HN ILE 60 0.918 -0.432 4.511 518 HA ILE 60 HA ILE 60 -1.468 -0.833 3.055 519 HB ILE 60 HB ILE 60 1.024 -2.550 3.110 520 HG12 ILE 60 HG12 ILE 60 0.187 -0.362 1.194 521 HG13 ILE 60 HG11 ILE 60 1.411 -0.191 2.449 522 HG21 ILE 60 HG21 ILE 60 -1.213 -2.446 1.093 523 HG22 ILE 60 HG22 ILE 60 -0.898 -3.762 2.222 524 HG23 ILE 60 HG23 ILE 60 0.262 -3.398 0.946 525 HD11 ILE 60 HD11 ILE 60 2.471 -0.536 0.324 526 HD12 ILE 60 HD12 ILE 60 1.528 -1.999 0.047 527 HD13 ILE 60 HD13 ILE 60 2.731 -1.958 1.334 528 H ASP 61 HN ASP 61 0.181 -2.767 5.506 529 HA ASP 61 HA ASP 61 -1.566 -4.993 5.428 530 HB2 ASP 61 HB2 ASP 61 0.722 -4.973 6.482 531 HB3 ASP 61 HB1 ASP 61 0.046 -4.032 7.809 532 H GLU 62 HN GLU 62 -1.592 -1.977 7.226 533 HA GLU 62 HA GLU 62 -3.753 -2.512 8.934 534 HB2 GLU 62 HB2 GLU 62 -2.287 -0.602 9.263 535 HB3 GLU 62 HB1 GLU 62 -2.790 0.088 7.726 536 HG2 GLU 62 HG2 GLU 62 -5.047 0.389 8.592 537 HG3 GLU 62 HG1 GLU 62 -4.551 -0.318 10.129 538 H ASN 63 HN ASN 63 -3.620 -1.046 5.705 539 HA ASN 63 HA ASN 63 -6.393 -0.677 5.382 540 HB2 ASN 63 HB2 ASN 63 -4.134 -0.984 3.413 541 HB3 ASN 63 HB1 ASN 63 -5.801 -0.789 2.884 542 HD21 ASN 63 HD21 ASN 63 -5.273 1.156 1.868 543 HD22 ASN 63 HD22 ASN 63 -4.987 2.599 2.772 544 H LYS 64 HN LYS 64 -4.244 -3.368 4.642 545 HA LYS 64 HA LYS 64 -6.061 -5.024 3.322 546 HB2 LYS 64 HB2 LYS 64 -3.555 -5.333 3.578 547 HB3 LYS 64 HB1 LYS 64 -3.875 -5.960 5.186 548 HG2 LYS 64 HG2 LYS 64 -5.152 -7.791 4.257 549 HG3 LYS 64 HG1 LYS 64 -4.950 -7.133 2.631 550 HD2 LYS 64 HD2 LYS 64 -2.510 -7.398 2.848 551 HD3 LYS 64 HD1 LYS 64 -2.746 -8.108 4.446 552 HE2 LYS 64 HE2 LYS 64 -3.961 -9.963 3.494 553 HE3 LYS 64 HE1 LYS 64 -3.902 -9.229 1.892 554 HZ1 LYS 64 HZ1 LYS 64 -1.490 -9.451 1.935 555 HZ2 LYS 64 HZ2 LYS 64 -2.240 -10.953 2.120 556 HZ3 LYS 64 HZ3 LYS 64 -1.563 -10.177 3.460 557 H ASN 65 HN ASN 65 -5.385 -4.653 6.788 558 HA ASN 65 HA ASN 65 -7.245 -6.601 7.673 559 HB2 ASN 65 HB2 ASN 65 -5.889 -4.270 8.986 560 HB3 ASN 65 HB1 ASN 65 -7.187 -5.109 9.826 561 HD21 ASN 65 HD21 ASN 65 -6.892 -7.284 10.407 562 HD22 ASN 65 HD22 ASN 65 -5.310 -7.973 10.529 563 H ALA 66 HN ALA 66 -7.490 -3.090 7.254 564 HA ALA 66 HA ALA 66 -10.127 -2.799 8.156 565 HB1 ALA 66 HB1 ALA 66 -10.123 -0.668 6.968 566 HB2 ALA 66 HB2 ALA 66 -8.672 -1.151 6.089 567 HB3 ALA 66 HB3 ALA 66 -8.607 -0.908 7.835 568 H LEU 67 HN LEU 67 -8.820 -3.547 4.974 569 HA LEU 67 HA LEU 67 -11.282 -3.462 3.581 570 HB2 LEU 67 HB2 LEU 67 -9.142 -3.267 2.445 571 HB3 LEU 67 HB1 LEU 67 -8.698 -4.884 2.950 572 HG LEU 67 HG LEU 67 -10.440 -5.833 1.534 573 HD11 LEU 67 HD11 LEU 67 -11.628 -4.352 -0.074 574 HD12 LEU 67 HD12 LEU 67 -11.044 -2.967 0.845 575 HD13 LEU 67 HD13 LEU 67 -12.123 -4.136 1.602 576 HD21 LEU 67 HD21 LEU 67 -8.692 -3.846 0.096 577 HD22 LEU 67 HD22 LEU 67 -9.478 -5.244 -0.634 578 HD23 LEU 67 HD23 LEU 67 -8.230 -5.475 0.589 579 H GLN 68 HN GLN 68 -9.450 -6.114 5.076 580 HA GLN 68 HA GLN 68 -11.163 -8.193 4.363 581 HB2 GLN 68 HB2 GLN 68 -8.961 -8.542 5.389 582 HB3 GLN 68 HB1 GLN 68 -9.560 -7.892 6.908 583 HG2 GLN 68 HG2 GLN 68 -11.111 -9.737 7.120 584 HG3 GLN 68 HG1 GLN 68 -10.600 -10.370 5.556 585 HE21 GLN 68 HE21 GLN 68 -8.370 -8.956 7.828 586 HE22 GLN 68 HE22 GLN 68 -7.554 -10.424 8.233 587 H LYS 69 HN LYS 69 -11.436 -5.800 6.902 588 HA LYS 69 HA LYS 69 -13.816 -7.090 7.984 589 HB2 LYS 69 HB2 LYS 69 -12.062 -6.064 9.474 590 HB3 LYS 69 HB1 LYS 69 -12.515 -4.491 8.834 591 HG2 LYS 69 HG2 LYS 69 -13.530 -4.935 11.013 592 HG3 LYS 69 HG1 LYS 69 -14.742 -4.718 9.751 593 HD2 LYS 69 HD2 LYS 69 -14.975 -7.159 9.579 594 HD3 LYS 69 HD1 LYS 69 -13.781 -7.357 10.860 595 HE2 LYS 69 HE2 LYS 69 -16.070 -7.572 11.708 596 HE3 LYS 69 HE1 LYS 69 -15.235 -6.197 12.422 597 HZ1 LYS 69 HZ1 LYS 69 -16.405 -4.723 10.953 598 HZ2 LYS 69 HZ2 LYS 69 -17.528 -5.692 11.762 599 HZ3 LYS 69 HZ3 LYS 69 -17.140 -6.020 10.152 600 H LEU 70 HN LEU 70 -13.224 -5.273 5.381 601 HA LEU 70 HA LEU 70 -15.280 -3.262 5.700 602 HB2 LEU 70 HB2 LEU 70 -13.091 -2.880 4.524 603 HB3 LEU 70 HB1 LEU 70 -13.664 -3.929 3.245 604 HG LEU 70 HG LEU 70 -15.458 -2.365 2.722 605 HD11 LEU 70 HD11 LEU 70 -15.516 -0.158 3.825 606 HD12 LEU 70 HD12 LEU 70 -14.311 -0.728 4.979 607 HD13 LEU 70 HD13 LEU 70 -15.906 -1.479 4.927 608 HD21 LEU 70 HD21 LEU 70 -12.792 -0.977 2.956 609 HD22 LEU 70 HD22 LEU 70 -14.099 -0.556 1.849 610 HD23 LEU 70 HD23 LEU 70 -13.250 -2.091 1.671 611 H SER 71 HN SER 71 -16.727 -5.259 6.070 612 HA SER 71 HA SER 71 -18.295 -5.511 3.618 613 HB2 SER 71 HB2 SER 71 -17.656 -7.837 5.460 614 HB3 SER 71 HB1 SER 71 -18.783 -7.891 4.106 615 HG SER 71 HG SER 71 -16.237 -6.967 3.512 616 H LYS 72 HN LYS 72 -20.153 -4.510 4.128 617 HA LYS 72 HA LYS 72 -20.979 -4.480 6.940 618 HB2 LYS 72 HB2 LYS 72 -22.410 -2.528 6.185 619 HB3 LYS 72 HB1 LYS 72 -20.670 -2.271 6.103 620 HG2 LYS 72 HG2 LYS 72 -20.745 -2.754 3.673 621 HG3 LYS 72 HG1 LYS 72 -22.501 -2.922 3.786 622 HD2 LYS 72 HD2 LYS 72 -22.581 -0.583 4.691 623 HD3 LYS 72 HD1 LYS 72 -20.859 -0.447 4.330 624 HE2 LYS 72 HE2 LYS 72 -21.320 -0.881 1.968 625 HE3 LYS 72 HE1 LYS 72 -23.037 -1.039 2.328 626 HZ1 LYS 72 HZ1 LYS 72 -22.378 1.168 1.451 627 HZ2 LYS 72 HZ2 LYS 72 -21.467 1.418 2.854 628 HZ3 LYS 72 HZ3 LYS 72 -23.148 1.237 2.964 629 H ALA 73 HN ALA 73 -22.455 -5.928 7.463 630 HA ALA 73 HA ALA 73 -24.185 -7.135 5.511 631 HB1 ALA 73 HB1 ALA 73 -23.190 -8.430 7.333 632 HB2 ALA 73 HB2 ALA 73 -24.951 -8.523 7.346 633 HB3 ALA 73 HB3 ALA 73 -24.113 -7.486 8.500 634 H ASP 74 HN ASP 74 -24.420 -4.486 7.692 635 HA ASP 74 HA ASP 74 -27.279 -4.628 8.022 636 HB2 ASP 74 HB2 ASP 74 -27.064 -2.548 9.257 637 HB3 ASP 74 HB1 ASP 74 -25.787 -3.647 9.765 638 H GLU 75 HN GLU 75 -25.357 -3.759 5.500 639 HA GLU 75 HA GLU 75 -27.455 -2.036 4.365 640 HB2 GLU 75 HB2 GLU 75 -24.461 -1.733 4.126 641 HB3 GLU 75 HB1 GLU 75 -25.595 -0.924 3.053 642 HG2 GLU 75 HG2 GLU 75 -26.561 0.266 4.917 643 HG3 GLU 75 HG1 GLU 75 -25.514 -0.597 6.042 644 H SER 76 HN SER 76 -27.496 -2.094 1.984 645 HA SER 76 HA SER 76 -27.253 -4.817 1.080 646 HB2 SER 76 HB2 SER 76 -29.238 -3.487 0.502 647 HB3 SER 76 HB1 SER 76 -28.222 -2.342 -0.370 648 HG SER 76 HG SER 76 -28.569 -5.096 -0.990 649 H ALA 77 HN ALA 77 -25.798 -5.619 -0.329 650 HA ALA 77 HA ALA 77 -23.779 -3.783 -1.420 651 HB1 ALA 77 HB1 ALA 77 -22.833 -4.965 0.482 652 HB2 ALA 77 HB2 ALA 77 -22.080 -5.515 -1.014 653 HB3 ALA 77 HB3 ALA 77 -23.302 -6.510 -0.224 654 HA PRO 78 HA PRO 78 -25.234 -5.762 -5.205 655 HB2 PRO 78 HB2 PRO 78 -22.956 -4.282 -6.378 656 HB3 PRO 78 HB1 PRO 78 -24.669 -4.220 -6.804 657 HG2 PRO 78 HG2 PRO 78 -23.493 -2.193 -5.521 658 HG3 PRO 78 HG1 PRO 78 -25.160 -2.673 -5.156 659 HD2 PRO 78 HD2 PRO 78 -22.646 -3.256 -3.629 660 HD3 PRO 78 HD1 PRO 78 -24.254 -2.805 -3.023 661 H VAL 79 HN VAL 79 -24.551 -7.878 -4.718 662 HA VAL 79 HA VAL 79 -21.887 -8.694 -4.479 663 HB VAL 79 HB VAL 79 -22.681 -10.988 -4.730 664 HG11 VAL 79 HG11 VAL 79 -24.485 -9.242 -3.066 665 HG12 VAL 79 HG12 VAL 79 -22.929 -9.914 -2.581 666 HG13 VAL 79 HG13 VAL 79 -24.298 -10.984 -2.876 667 HG21 VAL 79 HG21 VAL 79 -25.342 -9.760 -5.440 668 HG22 VAL 79 HG22 VAL 79 -25.028 -11.474 -5.180 669 HG23 VAL 79 HG23 VAL 79 -24.285 -10.639 -6.543 670 H ALA 80 HN ALA 80 -20.923 -10.443 -5.902 671 HA ALA 80 HA ALA 80 -19.834 -10.991 -7.804 672 HB1 ALA 80 HB1 ALA 80 -20.837 -10.640 -9.987 673 HB2 ALA 80 HB2 ALA 80 -22.059 -9.589 -9.273 674 HB3 ALA 80 HB3 ALA 80 -22.013 -11.300 -8.853 675 H ASN 81 HN ASN 81 -21.185 -7.735 -8.395 676 HA ASN 81 HA ASN 81 -18.763 -6.719 -9.474 677 HB2 ASN 81 HB2 ASN 81 -21.166 -5.290 -8.304 678 HB3 ASN 81 HB1 ASN 81 -19.814 -4.458 -9.066 679 HD21 ASN 81 HD21 ASN 81 -19.534 -4.604 -11.283 680 HD22 ASN 81 HD22 ASN 81 -20.779 -5.183 -12.335 681 H TYR 82 HN TYR 82 -20.301 -6.323 -6.292 682 HA TYR 82 HA TYR 82 -18.218 -4.912 -5.047 683 HB2 TYR 82 HB2 TYR 82 -20.582 -5.310 -4.167 684 HB3 TYR 82 HB1 TYR 82 -20.052 -6.917 -3.690 685 HD1 TYR 82 HD1 TYR 82 -18.350 -7.167 -1.889 686 HD2 TYR 82 HD2 TYR 82 -20.043 -3.370 -2.833 687 HE1 TYR 82 HE1 TYR 82 -17.538 -6.273 0.250 688 HE2 TYR 82 HE2 TYR 82 -19.233 -2.476 -0.695 689 HH TYR 82 HH TYR 82 -18.527 -3.205 1.474 690 H ASN 83 HN ASN 83 -18.732 -8.349 -5.569 691 HA ASN 83 HA ASN 83 -16.748 -9.284 -3.778 692 HB2 ASN 83 HB2 ASN 83 -17.900 -10.652 -6.225 693 HB3 ASN 83 HB1 ASN 83 -16.978 -11.441 -4.951 694 HD21 ASN 83 HD21 ASN 83 -18.645 -12.845 -4.439 695 HD22 ASN 83 HD22 ASN 83 -20.079 -12.323 -3.623 696 H GLN 84 HN GLN 84 -16.740 -8.716 -7.280 697 HA GLN 84 HA GLN 84 -14.043 -9.543 -7.648 698 HB2 GLN 84 HB2 GLN 84 -15.940 -7.948 -9.364 699 HB3 GLN 84 HB1 GLN 84 -14.304 -8.344 -9.874 700 HG2 GLN 84 HG2 GLN 84 -16.391 -10.374 -9.111 701 HG3 GLN 84 HG1 GLN 84 -16.032 -9.875 -10.762 702 HE21 GLN 84 HE21 GLN 84 -14.880 -11.624 -7.981 703 HE22 GLN 84 HE22 GLN 84 -13.599 -12.451 -8.792 704 H ARG 85 HN ARG 85 -15.612 -6.420 -7.176 705 HA ARG 85 HA ARG 85 -13.352 -4.805 -7.659 706 HB2 ARG 85 HB2 ARG 85 -15.667 -3.938 -7.574 707 HB3 ARG 85 HB1 ARG 85 -15.718 -4.261 -5.848 708 HG2 ARG 85 HG2 ARG 85 -15.324 -1.950 -6.113 709 HG3 ARG 85 HG1 ARG 85 -13.803 -2.669 -5.586 710 HD2 ARG 85 HD2 ARG 85 -13.317 -1.103 -7.322 711 HD3 ARG 85 HD1 ARG 85 -13.087 -2.724 -7.974 712 HE ARG 85 HE ARG 85 -15.710 -1.896 -8.526 713 HH11 ARG 85 HH11 ARG 85 -12.421 -1.102 -9.417 714 HH12 ARG 85 HH12 ARG 85 -12.846 -0.556 -11.007 715 HH21 ARG 85 HH21 ARG 85 -16.277 -1.165 -10.625 716 HH22 ARG 85 HH22 ARG 85 -15.030 -0.600 -11.695 717 H LYS 86 HN LYS 86 -14.556 -6.426 -4.784 718 HA LYS 86 HA LYS 86 -12.775 -5.304 -2.920 719 HB2 LYS 86 HB2 LYS 86 -14.725 -6.469 -2.158 720 HB3 LYS 86 HB1 LYS 86 -14.238 -7.946 -2.987 721 HG2 LYS 86 HG2 LYS 86 -12.270 -8.088 -1.454 722 HG3 LYS 86 HG1 LYS 86 -12.911 -6.695 -0.573 723 HD2 LYS 86 HD2 LYS 86 -14.198 -9.417 -0.884 724 HD3 LYS 86 HD1 LYS 86 -13.527 -8.714 0.585 725 HE2 LYS 86 HE2 LYS 86 -15.259 -6.971 0.548 726 HE3 LYS 86 HE1 LYS 86 -15.933 -7.673 -0.925 727 HZ1 LYS 86 HZ1 LYS 86 -16.322 -9.731 0.341 728 HZ2 LYS 86 HZ2 LYS 86 -17.183 -8.416 0.960 729 HZ3 LYS 86 HZ3 LYS 86 -15.789 -8.958 1.747 730 H GLU 87 HN GLU 87 -12.507 -8.078 -5.084 731 HA GLU 87 HA GLU 87 -10.040 -9.014 -4.001 732 HB2 GLU 87 HB2 GLU 87 -11.365 -9.573 -6.655 733 HB3 GLU 87 HB1 GLU 87 -9.919 -10.389 -6.077 734 HG2 GLU 87 HG2 GLU 87 -12.678 -10.495 -4.887 735 HG3 GLU 87 HG1 GLU 87 -11.787 -11.799 -5.665 736 H GLU 88 HN GLU 88 -10.926 -6.924 -6.704 737 HA GLU 88 HA GLU 88 -8.377 -6.560 -7.809 738 HB2 GLU 88 HB2 GLU 88 -10.728 -4.669 -7.651 739 HB3 GLU 88 HB1 GLU 88 -9.282 -4.343 -8.595 740 HG2 GLU 88 HG2 GLU 88 -11.131 -6.685 -8.995 741 HG3 GLU 88 HG1 GLU 88 -11.128 -5.206 -9.951 742 H GLU 89 HN GLU 89 -9.993 -4.989 -5.112 743 HA GLU 89 HA GLU 89 -8.043 -3.004 -4.620 744 HB2 GLU 89 HB2 GLU 89 -10.516 -3.467 -3.672 745 HB3 GLU 89 HB1 GLU 89 -9.584 -4.140 -2.343 746 HG2 GLU 89 HG2 GLU 89 -10.081 -1.890 -1.802 747 HG3 GLU 89 HG1 GLU 89 -8.367 -1.961 -2.210 748 H HIS 90 HN HIS 90 -8.474 -6.329 -3.518 749 HA HIS 90 HA HIS 90 -6.293 -6.416 -1.722 750 HB2 HIS 90 HB2 HIS 90 -7.892 -8.481 -3.173 751 HB3 HIS 90 HB1 HIS 90 -6.325 -8.968 -2.538 752 HD1 HIS 90 HD1 HIS 90 -6.114 -9.286 -0.024 753 HD2 HIS 90 HD2 HIS 90 -9.831 -7.845 -1.188 754 HE1 HIS 90 HE1 HIS 90 -7.588 -9.499 2.002 755 HE2 HIS 90 HE2 HIS 90 -9.867 -8.794 1.214 756 H THR 91 HN THR 91 -6.555 -7.027 -5.193 757 HA THR 91 HA THR 91 -3.963 -8.032 -5.585 758 HB THR 91 HB THR 91 -5.631 -6.518 -7.599 759 HG1 THR 91 HG1 THR 91 -5.981 -8.967 -6.372 760 HG21 THR 91 HG21 THR 91 -3.545 -8.681 -7.933 761 HG22 THR 91 HG22 THR 91 -3.327 -6.973 -8.311 762 HG23 THR 91 HG23 THR 91 -4.479 -7.939 -9.230 763 H LEU 92 HN LEU 92 -5.202 -4.740 -5.471 764 HA LEU 92 HA LEU 92 -2.889 -3.513 -6.591 765 HB2 LEU 92 HB2 LEU 92 -5.043 -2.376 -6.593 766 HB3 LEU 92 HB1 LEU 92 -5.080 -2.381 -4.841 767 HG LEU 92 HG LEU 92 -3.081 -0.898 -4.837 768 HD11 LEU 92 HD11 LEU 92 -2.451 0.231 -6.913 769 HD12 LEU 92 HD12 LEU 92 -3.559 -0.802 -7.814 770 HD13 LEU 92 HD13 LEU 92 -2.158 -1.505 -7.005 771 HD21 LEU 92 HD21 LEU 92 -5.337 0.011 -4.624 772 HD22 LEU 92 HD22 LEU 92 -5.458 0.136 -6.379 773 HD23 LEU 92 HD23 LEU 92 -4.281 1.116 -5.504 774 H LEU 93 HN LEU 93 -4.069 -3.877 -3.254 775 HA LEU 93 HA LEU 93 -1.815 -2.668 -2.049 776 HB2 LEU 93 HB2 LEU 93 -3.797 -4.630 -0.885 777 HB3 LEU 93 HB1 LEU 93 -2.648 -3.689 0.043 778 HG LEU 93 HG LEU 93 -4.895 -2.540 -1.613 779 HD11 LEU 93 HD11 LEU 93 -5.915 -1.990 0.533 780 HD12 LEU 93 HD12 LEU 93 -4.601 -2.809 1.376 781 HD13 LEU 93 HD13 LEU 93 -5.707 -3.732 0.356 782 HD21 LEU 93 HD21 LEU 93 -2.930 -1.223 0.260 783 HD22 LEU 93 HD22 LEU 93 -4.313 -0.433 -0.498 784 HD23 LEU 93 HD23 LEU 93 -2.988 -1.038 -1.494 785 H ASP 94 HN ASP 94 -2.540 -5.925 -3.048 786 HA ASP 94 HA ASP 94 -0.529 -7.255 -1.573 787 HB2 ASP 94 HB2 ASP 94 -2.387 -8.490 -2.564 788 HB3 ASP 94 HB1 ASP 94 -1.859 -8.030 -4.180 789 H LYS 95 HN LYS 95 -0.537 -5.933 -4.908 790 HA LYS 95 HA LYS 95 2.083 -6.791 -5.497 791 HB2 LYS 95 HB2 LYS 95 0.455 -6.148 -7.233 792 HB3 LYS 95 HB1 LYS 95 0.504 -4.483 -6.666 793 HG2 LYS 95 HG2 LYS 95 2.867 -4.338 -7.282 794 HG3 LYS 95 HG1 LYS 95 2.826 -6.012 -7.840 795 HD2 LYS 95 HD2 LYS 95 1.115 -5.394 -9.501 796 HD3 LYS 95 HD1 LYS 95 1.229 -3.715 -8.971 797 HE2 LYS 95 HE2 LYS 95 2.546 -4.134 -11.002 798 HE3 LYS 95 HE1 LYS 95 3.559 -3.630 -9.650 799 HZ1 LYS 95 HZ1 LYS 95 4.151 -5.945 -9.277 800 HZ2 LYS 95 HZ2 LYS 95 4.544 -5.476 -10.853 801 HZ3 LYS 95 HZ3 LYS 95 3.174 -6.426 -10.571 802 H LEU 96 HN LEU 96 0.795 -3.735 -4.231 803 HA LEU 96 HA LEU 96 3.184 -2.329 -4.060 804 HB2 LEU 96 HB2 LEU 96 0.923 -2.273 -2.057 805 HB3 LEU 96 HB1 LEU 96 2.170 -1.057 -2.231 806 HG LEU 96 HG LEU 96 0.061 -1.714 -4.288 807 HD11 LEU 96 HD11 LEU 96 -0.790 -0.564 -2.281 808 HD12 LEU 96 HD12 LEU 96 -0.879 0.439 -3.726 809 HD13 LEU 96 HD13 LEU 96 0.392 0.720 -2.538 810 HD21 LEU 96 HD21 LEU 96 0.905 0.256 -5.467 811 HD22 LEU 96 HD22 LEU 96 2.144 -0.990 -5.328 812 HD23 LEU 96 HD23 LEU 96 2.191 0.423 -4.272 813 H THR 97 HN THR 97 1.789 -4.643 -1.761 814 HA THR 97 HA THR 97 3.774 -4.539 0.191 815 HB THR 97 HB THR 97 2.295 -7.021 -0.700 816 HG1 THR 97 HG1 THR 97 0.971 -5.087 -0.128 817 HG21 THR 97 HG21 THR 97 2.637 -7.786 1.574 818 HG22 THR 97 HG22 THR 97 3.454 -6.278 1.985 819 HG23 THR 97 HG23 THR 97 4.192 -7.397 0.836 820 H GLN 98 HN GLN 98 3.592 -6.503 -2.768 821 HA GLN 98 HA GLN 98 5.899 -8.041 -2.332 822 HB2 GLN 98 HB2 GLN 98 4.576 -7.195 -4.911 823 HB3 GLN 98 HB1 GLN 98 5.846 -8.404 -4.804 824 HG2 GLN 98 HG2 GLN 98 4.434 -9.839 -3.491 825 HG3 GLN 98 HG1 GLN 98 3.182 -8.599 -3.426 826 HE21 GLN 98 HE21 GLN 98 3.129 -11.345 -4.479 827 HE22 GLN 98 HE22 GLN 98 2.601 -11.196 -6.120 828 H GLN 99 HN GLN 99 5.420 -5.014 -4.097 829 HA GLN 99 HA GLN 99 8.048 -4.833 -5.099 830 HB2 GLN 99 HB2 GLN 99 6.131 -3.617 -6.056 831 HB3 GLN 99 HB1 GLN 99 6.053 -2.618 -4.610 832 HG2 GLN 99 HG2 GLN 99 8.241 -1.706 -5.085 833 HG3 GLN 99 HG1 GLN 99 8.397 -2.759 -6.490 834 HE21 GLN 99 HE21 GLN 99 7.176 -2.339 -8.326 835 HE22 GLN 99 HE22 GLN 99 6.424 -0.802 -8.593 836 H LEU 100 HN LEU 100 6.517 -3.364 -2.244 837 HA LEU 100 HA LEU 100 8.776 -1.864 -1.462 838 HB2 LEU 100 HB2 LEU 100 6.466 -2.919 0.168 839 HB3 LEU 100 HB1 LEU 100 7.668 -1.800 0.780 840 HG LEU 100 HG LEU 100 5.665 -1.277 -1.415 841 HD11 LEU 100 HD11 LEU 100 6.024 -0.071 1.322 842 HD12 LEU 100 HD12 LEU 100 4.759 -1.202 0.845 843 HD13 LEU 100 HD13 LEU 100 4.817 0.408 0.129 844 HD21 LEU 100 HD21 LEU 100 7.720 -0.186 -2.020 845 HD22 LEU 100 HD22 LEU 100 7.909 0.452 -0.387 846 HD23 LEU 100 HD23 LEU 100 6.590 1.020 -1.410 847 H GLN 101 HN GLN 101 7.591 -5.049 -0.493 848 HA GLN 101 HA GLN 101 9.595 -5.602 1.398 849 HB2 GLN 101 HB2 GLN 101 7.483 -6.839 1.276 850 HB3 GLN 101 HB1 GLN 101 7.934 -7.491 -0.290 851 HG2 GLN 101 HG2 GLN 101 9.711 -7.996 2.044 852 HG3 GLN 101 HG1 GLN 101 8.199 -8.890 1.912 853 HE21 GLN 101 HE21 GLN 101 10.974 -9.817 1.760 854 HE22 GLN 101 HE22 GLN 101 11.110 -10.632 0.239 855 H GLY 102 HN GLY 102 9.415 -6.133 -2.091 856 HA2 GLY 102 HA2 GLY 102 11.835 -7.604 -2.313 857 HA3 GLY 102 HA1 GLY 102 11.019 -6.755 -3.616 858 H LEU 103 HN LEU 103 11.067 -4.162 -2.701 859 HA LEU 103 HA LEU 103 13.670 -3.353 -3.444 860 HB2 LEU 103 HB2 LEU 103 11.665 -1.992 -3.853 861 HB3 LEU 103 HB1 LEU 103 11.453 -1.772 -2.126 862 HG LEU 103 HG LEU 103 13.598 -0.530 -2.040 863 HD11 LEU 103 HD11 LEU 103 13.524 -0.810 -5.041 864 HD12 LEU 103 HD12 LEU 103 14.699 -1.552 -3.954 865 HD13 LEU 103 HD13 LEU 103 14.639 0.203 -4.123 866 HD21 LEU 103 HD21 LEU 103 11.490 0.668 -2.269 867 HD22 LEU 103 HD22 LEU 103 11.587 0.527 -4.025 868 HD23 LEU 103 HD23 LEU 103 12.779 1.489 -3.149 869 H ALA 104 HN ALA 104 12.028 -3.570 -0.329 870 HA ALA 104 HA ALA 104 13.875 -2.289 1.299 871 HB1 ALA 104 HB1 ALA 104 12.962 -3.692 3.125 872 HB2 ALA 104 HB2 ALA 104 12.116 -4.660 1.918 873 HB3 ALA 104 HB3 ALA 104 11.712 -2.955 2.125 874 H VAL 105 HN VAL 105 13.776 -5.653 0.226 875 HA VAL 105 HA VAL 105 16.035 -6.507 1.689 876 HB VAL 105 HB VAL 105 14.769 -7.662 -0.793 877 HG11 VAL 105 HG11 VAL 105 16.798 -8.897 1.056 878 HG12 VAL 105 HG12 VAL 105 17.089 -8.389 -0.607 879 HG13 VAL 105 HG13 VAL 105 15.976 -9.715 -0.272 880 HG21 VAL 105 HG21 VAL 105 14.550 -8.416 2.115 881 HG22 VAL 105 HG22 VAL 105 13.811 -9.285 0.771 882 HG23 VAL 105 HG23 VAL 105 13.300 -7.638 1.144 883 H THR 106 HN THR 106 15.633 -5.128 -1.524 884 HA THR 106 HA THR 106 18.259 -5.575 -2.440 885 HB THR 106 HB THR 106 16.434 -3.289 -3.205 886 HG1 THR 106 HG1 THR 106 16.338 -6.014 -3.729 887 HG21 THR 106 HG21 THR 106 18.741 -3.061 -4.004 888 HG22 THR 106 HG22 THR 106 17.628 -3.366 -5.336 889 HG23 THR 106 HG23 THR 106 18.649 -4.666 -4.725 890 H ILE 107 HN ILE 107 16.793 -2.948 -0.592 891 HA ILE 107 HA ILE 107 19.036 -1.210 -0.704 892 HB ILE 107 HB ILE 107 16.808 -1.263 1.333 893 HG12 ILE 107 HG12 ILE 107 17.032 0.394 -1.191 894 HG13 ILE 107 HG11 ILE 107 16.063 -1.070 -1.062 895 HG21 ILE 107 HG21 ILE 107 18.718 0.033 2.075 896 HG22 ILE 107 HG22 ILE 107 17.375 1.101 1.670 897 HG23 ILE 107 HG23 ILE 107 18.729 0.928 0.556 898 HD11 ILE 107 HD11 ILE 107 15.681 1.442 0.546 899 HD12 ILE 107 HD12 ILE 107 14.704 -0.022 0.666 900 HD13 ILE 107 HD13 ILE 107 14.701 0.922 -0.823 901 H SER 108 HN SER 108 17.961 -3.657 1.594 902 HA SER 108 HA SER 108 20.063 -2.996 3.472 903 HB2 SER 108 HB2 SER 108 19.092 -5.049 4.687 904 HB3 SER 108 HB1 SER 108 18.047 -3.639 4.522 905 HG SER 108 HG SER 108 16.915 -4.648 2.928 906 H ARG 109 HN ARG 109 19.592 -5.036 0.806 907 HA ARG 109 HA ARG 109 20.936 -6.403 -0.361 908 HB2 ARG 109 HB2 ARG 109 23.036 -5.386 1.542 909 HB3 ARG 109 HB1 ARG 109 23.382 -6.432 0.173 910 HG2 ARG 109 HG2 ARG 109 22.366 -4.681 -1.302 911 HG3 ARG 109 HG1 ARG 109 22.297 -3.629 0.115 912 HD2 ARG 109 HD2 ARG 109 24.299 -3.174 -1.181 913 HD3 ARG 109 HD1 ARG 109 24.719 -3.857 0.390 914 HE ARG 109 HE ARG 109 24.667 -5.452 -2.095 915 HH11 ARG 109 HH11 ARG 109 26.184 -4.545 0.930 916 HH12 ARG 109 HH12 ARG 109 27.463 -5.706 0.780 917 HH21 ARG 109 HH21 ARG 109 26.343 -6.962 -2.299 918 HH22 ARG 109 HH22 ARG 109 27.552 -7.087 -1.064 919 H GLU 110 HN GLU 110 20.126 -8.368 -0.060 920 HA GLU 110 HA GLU 110 20.643 -9.895 2.332 921 HB2 GLU 110 HB2 GLU 110 18.510 -10.114 1.126 922 HB3 GLU 110 HB1 GLU 110 19.364 -10.701 -0.290 923 HG2 GLU 110 HG2 GLU 110 18.265 -12.480 1.018 924 HG3 GLU 110 HG1 GLU 110 20.004 -12.704 0.849 925 H ASN 111 HN ASN 111 22.993 -9.540 2.002 926 HA ASN 111 HA ASN 111 24.147 -11.595 0.236 927 HB2 ASN 111 HB2 ASN 111 25.312 -8.905 1.009 928 HB3 ASN 111 HB1 ASN 111 26.185 -10.146 0.120 929 HD21 ASN 111 HD21 ASN 111 25.665 -10.536 -2.030 930 HD22 ASN 111 HD22 ASN 111 24.683 -9.446 -2.950 931 H ILE 112 HN ILE 112 23.313 -12.276 2.748 932 HA ILE 112 HA ILE 112 25.424 -12.037 4.674 933 HB ILE 112 HB ILE 112 23.083 -13.947 4.657 934 HG12 ILE 112 HG12 ILE 112 23.363 -11.315 6.115 935 HG13 ILE 112 HG11 ILE 112 22.475 -11.508 4.615 936 HG21 ILE 112 HG21 ILE 112 24.884 -14.668 6.121 937 HG22 ILE 112 HG22 ILE 112 23.493 -14.125 7.058 938 HG23 ILE 112 HG23 ILE 112 24.905 -13.083 6.892 939 HD11 ILE 112 HD11 ILE 112 20.945 -13.049 5.706 940 HD12 ILE 112 HD12 ILE 112 20.998 -11.500 6.548 941 HD13 ILE 112 HD13 ILE 112 21.853 -12.894 7.209 942 H THR 113 HN THR 113 24.034 -14.849 3.010 943 HA THR 113 HA THR 113 26.731 -16.016 2.895 944 HB THR 113 HB THR 113 25.378 -18.249 2.840 945 HG1 THR 113 HG1 THR 113 23.307 -17.950 3.135 946 HG21 THR 113 HG21 THR 113 25.728 -16.653 5.381 947 HG22 THR 113 HG22 THR 113 26.937 -17.686 4.617 948 HG23 THR 113 HG23 THR 113 25.476 -18.397 5.301 949 H GLU 114 HN GLU 114 23.607 -15.632 1.375 950 HA GLU 114 HA GLU 114 22.966 -15.419 -0.774 951 HB2 GLU 114 HB2 GLU 114 25.925 -15.461 -1.334 952 HB3 GLU 114 HB1 GLU 114 24.698 -15.156 -2.549 953 HG2 GLU 114 HG2 GLU 114 23.948 -13.191 -1.313 954 HG3 GLU 114 HG1 GLU 114 25.180 -13.499 -0.088 955 H VAL 115 HN VAL 115 25.684 -17.723 -0.805 956 HA VAL 115 HA VAL 115 23.988 -19.507 -2.415 957 HB VAL 115 HB VAL 115 26.134 -20.606 -3.094 958 HG11 VAL 115 HG11 VAL 115 25.870 -17.669 -3.734 959 HG12 VAL 115 HG12 VAL 115 25.019 -18.988 -4.537 960 HG13 VAL 115 HG13 VAL 115 26.772 -18.851 -4.684 961 HG21 VAL 115 HG21 VAL 115 27.398 -18.189 -1.797 962 HG22 VAL 115 HG22 VAL 115 28.228 -19.423 -2.742 963 HG23 VAL 115 HG23 VAL 115 27.500 -19.842 -1.193 964 H GLY 116 HN GLY 116 23.858 -19.297 0.464 965 HA2 GLY 116 HA2 GLY 116 23.608 -20.750 2.236 966 HA3 GLY 116 HA1 GLY 116 24.019 -22.063 1.142 967 H ALA 117 HN ALA 117 25.653 -23.193 2.008 968 HA ALA 117 HA ALA 117 28.010 -21.696 2.912 969 HB1 ALA 117 HB1 ALA 117 26.760 -22.337 4.904 970 HB2 ALA 117 HB2 ALA 117 28.290 -23.211 4.808 971 HB3 ALA 117 HB3 ALA 117 26.783 -24.023 4.382 972 HA PRO 118 HA PRO 118 29.282 -25.214 0.183 973 HB2 PRO 118 HB2 PRO 118 30.226 -23.858 -1.917 974 HB3 PRO 118 HB1 PRO 118 28.492 -24.158 -1.737 975 HG2 PRO 118 HG2 PRO 118 30.054 -21.673 -1.177 976 HG3 PRO 118 HG1 PRO 118 28.450 -21.847 -1.914 977 HD2 PRO 118 HD2 PRO 118 28.926 -21.202 0.744 978 HD3 PRO 118 HD1 PRO 118 27.409 -21.869 0.116 979 H THR 119 HN THR 119 30.672 -22.391 1.513 980 HA THR 119 HA THR 119 33.399 -23.326 1.035 981 HB THR 119 HB THR 119 34.008 -21.065 2.054 982 HG1 THR 119 HG1 THR 119 32.363 -20.016 2.872 983 HG21 THR 119 HG21 THR 119 34.100 -21.493 -0.355 984 HG22 THR 119 HG22 THR 119 33.553 -19.851 -0.027 985 HG23 THR 119 HG23 THR 119 32.390 -21.090 -0.497
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